*HEADER    STRUCTURAL PROTEIN                      18-DEC-03   1RXL
*TITLE     SOLUTION STRUCTURE OF THE ENGINEERED PROTEIN AFAE-DSC
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: AFIMBRIAL ADHESIN AFA-III;
*COMPND   3 CHAIN: A;
*COMPND   4 SYNONYM: AFAE-DSC; AFA-III; AFAE-3;
*COMPND   5 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;
*SOURCE   3 ORGANISM_COMMON: BACTERIA;
*SOURCE   4 GENE: AFAE3;
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PRSETA
*KEYWDS    AFAE, DAF, AFIMBRIAL SHEATH, DAEC, UPEC, NMR, IG-LIKE
*KEYWDS   2 DOMAIN, DONOR STRAND COMPLEMENTED
*EXPDTA    NMR, 15 STRUCTURES
*AUTHOR    K.L.ANDERSON, J.BILLINGTON, D.PETTIGREW, E COTA, P.ROVERSI,
*AUTHOR   2 P.SIMPSON, H.A.CHEN, P.URVIL, L.DU MERLE, P.N.BARLOW,
*AUTHOR   3 M.E.MEDOF, R.A.SMITH, B.NOWICKI, C.LE BOUGUENEC, S.M.LEA,
*AUTHOR   4 S.MATTHEWS
*REVDAT   1   11-JAN-05 1RXL    0



 ASSI {    8}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 92   and name HD1 ))
      2.400     0.700     0.700 peak     8 spectrum    1 weight  0.10000E+01 volume  0.74844E-02 ppm1     11.214 ppm2      7.575 CV     1
 OR {    8}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 92   and name HZ2 ))
 ASSI {   10}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 92   and name HA  ))
      4.900     3.000     1.100 peak    10 spectrum    1 weight  0.10000E+01 volume  0.35383E-03 ppm1     11.212 ppm2      4.541 CV     1
 ASSI {   15}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 86   and name HB1 ))
      4.500     2.600     1.500 peak    15 spectrum    1 weight  0.10000E+01 volume  0.54830E-03 ppm1     11.207 ppm2      1.257 CV     1
 ASSI {   16}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 86   and name HD2 ))
      4.900     3.000     1.100 peak    16 spectrum    1 weight  0.10000E+01 volume  0.35376E-03 ppm1     11.207 ppm2      0.306 CV     1
 ASSI {   18}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      4.200     2.200     1.800 peak    18 spectrum    1 weight  0.10000E+01 volume  0.48196E-03 ppm1      9.494 ppm2      4.822 CV     1
 ASSI {   21}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      2.600     0.800     0.800 peak    21 spectrum    1 weight  0.10000E+01 volume  0.22916E-02 ppm1      9.487 ppm2      9.173 CV     1
 ASSI {   22}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 84   and name HD% )
      3.900     1.900     1.900 peak    22 spectrum    1 weight  0.10000E+01 volume  0.12648E-02 ppm1      9.486 ppm2      6.931 CV     1
 ASSI {   23}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      3.000     1.100     1.100 peak    23 spectrum    1 weight  0.10000E+01 volume  0.14963E-02 ppm1      9.490 ppm2      5.633 CV     1
 ASSI {   24}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      4.600     2.600     1.400 peak    24 spectrum    1 weight  0.10000E+01 volume  0.49460E-03 ppm1      9.486 ppm2      5.338 CV     1
 ASSI {   25}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      2.600     0.900     0.900 peak    25 spectrum    1 weight  0.10000E+01 volume  0.20282E-02 ppm1      9.485 ppm2      4.632 CV     1
 ASSI {   26}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      3.100     1.200     1.200 peak    26 spectrum    1 weight  0.10000E+01 volume  0.25396E-02 ppm1      9.488 ppm2      3.096 CV     1
 ASSI {   27}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      2.600     0.800     0.800 peak    27 spectrum    1 weight  0.10000E+01 volume  0.21556E-02 ppm1      9.488 ppm2      2.686 CV     1
 ASSI {   28}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 42   and name HG  ))
      4.300     2.400     1.700 peak    28 spectrum    1 weight  0.10000E+01 volume  0.66806E-03 ppm1      9.488 ppm2      1.836 CV     1
 OR {   28}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
 ASSI {   30}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 83   and name HG1%)
      3.500     1.500     1.500 peak    30 spectrum    1 weight  0.10000E+01 volume  0.39880E-02 ppm1      9.488 ppm2      1.112 CV     1
 ASSI {   34}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 54   and name HD% )
      3.500     1.500     1.500 peak    34 spectrum    1 weight  0.10000E+01 volume  0.11963E-02 ppm1      8.809 ppm2      7.259 CV     1
 OR {   34}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 54   and name HE% )
 ASSI {   35}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      2.700     0.900     0.900 peak    35 spectrum    1 weight  0.10000E+01 volume  0.24286E-02 ppm1      8.806 ppm2      4.864 CV     1
 ASSI {   37}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 44   and name HB% )
      2.400     0.700     0.700 peak    37 spectrum    1 weight  0.10000E+01 volume  0.58352E-02 ppm1      8.809 ppm2      1.531 CV     1
 ASSI {   38}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 116  and name HD2%)
      3.800     1.800     1.800 peak    38 spectrum    1 weight  0.10000E+01 volume  0.13478E-02 ppm1      8.813 ppm2      0.502 CV     1
 OR {   38}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI {   39}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      4.600     2.600     1.400 peak    39 spectrum    1 weight  0.10000E+01 volume  0.54054E-03 ppm1      8.802 ppm2      7.688 CV     1
 ASSI {   40}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 49   and name HE% )
      4.000     2.000     2.000 peak    40 spectrum    1 weight  0.10000E+01 volume  0.47924E-03 ppm1      8.813 ppm2      6.907 CV     1
 ASSI {   42}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 82   and name HA1 ))
      4.800     2.900     1.200 peak    42 spectrum    1 weight  0.10000E+01 volume  0.57159E-03 ppm1      8.800 ppm2      3.143 CV     1
 ASSI {   43}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
      3.300     1.400     1.400 peak    43 spectrum    1 weight  0.10000E+01 volume  0.28676E-02 ppm1      8.808 ppm2      1.199 CV     1
 ASSI {   44}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HB1 ))
      2.800     1.000     1.000 peak    44 spectrum    1 weight  0.10000E+01 volume  0.34683E-02 ppm1      8.807 ppm2      0.844 CV     1
 ASSI {   45}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
      4.300     2.300     1.700 peak    45 spectrum    1 weight  0.10000E+01 volume  0.99245E-03 ppm1      8.807 ppm2     -0.422 CV     1
 ASSI {   47}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
      4.300     2.300     1.700 peak    47 spectrum    1 weight  0.10000E+01 volume  0.40538E-03 ppm1      8.563 ppm2      3.020 CV     1
 ASSI {   48}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.000     1.100     1.100 peak    48 spectrum    1 weight  0.10000E+01 volume  0.17460E-02 ppm1      8.551 ppm2      2.625 CV     1
 ASSI {   51}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      2.200     0.600     0.600 peak    51 spectrum    1 weight  0.10000E+01 volume  0.66699E-02 ppm1      8.592 ppm2      4.045 CV     1
 ASSI {   54}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 105  and name HG2%)
      3.500     3.500     2.500 peak    54 spectrum    1 weight  0.10000E+01 volume  0.25198E-02 ppm1      8.592 ppm2      1.137 CV     1
 ASSI {   55}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
      4.000     2.000     2.000 peak    55 spectrum    1 weight  0.10000E+01 volume  0.91596E-03 ppm1      8.591 ppm2      8.264 CV     1
 ASSI {   61}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      4.000     2.000     2.000 peak    61 spectrum    1 weight  0.10000E+01 volume  0.42330E-03 ppm1      8.549 ppm2      2.224 CV     1
 ASSI {   62}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 100  and name HG2%)
      2.600     0.900     0.900 peak    62 spectrum    1 weight  0.10000E+01 volume  0.44621E-02 ppm1      8.545 ppm2      0.906 CV     1
 ASSI {   65}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      3.700     1.700     1.700 peak    65 spectrum    1 weight  0.10000E+01 volume  0.68602E-03 ppm1      8.750 ppm2      6.868 CV     1
 ASSI {   68}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      3.900     1.900     1.900 peak    68 spectrum    1 weight  0.10000E+01 volume  0.11937E-02 ppm1      8.748 ppm2      7.581 CV     1
 ASSI {   69}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      3.200     1.300     1.300 peak    69 spectrum    1 weight  0.10000E+01 volume  0.10832E-02 ppm1      8.746 ppm2      5.637 CV     1
 ASSI {   70}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      2.400     0.700     0.700 peak    70 spectrum    1 weight  0.10000E+01 volume  0.46281E-02 ppm1      8.752 ppm2      4.766 CV     1
 ASSI {   73}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 30   and name HB  ))
      3.800     3.800     2.200 peak    73 spectrum    1 weight  0.10000E+01 volume  0.26813E-02 ppm1      8.748 ppm2      2.198 CV     1
 ASSI {   74}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 32   and name HB% )
      2.500     0.800     0.800 peak    74 spectrum    1 weight  0.10000E+01 volume  0.58987E-02 ppm1      8.748 ppm2      1.739 CV     1
 ASSI {   76}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 92   and name HE3 ))
      5.400     3.700     0.600 peak    76 spectrum    1 weight  0.10000E+01 volume  0.39883E-03 ppm1      8.736 ppm2      7.390 CV     1
 ASSI {   78}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HN  ))
      4.200     2.200     1.800 peak    78 spectrum    1 weight  0.10000E+01 volume  0.64317E-03 ppm1      7.674 ppm2      9.104 CV     1
 ASSI {   81}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 128  and name HN  ))
      3.900     1.900     1.900 peak    81 spectrum    1 weight  0.10000E+01 volume  0.15090E-02 ppm1      7.678 ppm2      7.382 CV     1
 ASSI {   82}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      3.900     1.900     1.900 peak    82 spectrum    1 weight  0.10000E+01 volume  0.67681E-03 ppm1      7.680 ppm2      6.628 CV     1
 ASSI {   83}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
      2.600     0.900     0.900 peak    83 spectrum    1 weight  0.10000E+01 volume  0.29060E-02 ppm1      7.676 ppm2      4.861 CV     1
 ASSI {   85}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 128  and name HA1 ))
      3.100     1.200     1.200 peak    85 spectrum    1 weight  0.10000E+01 volume  0.59714E-03 ppm1      7.676 ppm2      3.326 CV     1
 ASSI {   86}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 122  and name HB% )
      2.400     2.400     3.600 peak    86 spectrum    1 weight  0.10000E+01 volume  0.83971E-02 ppm1      7.676 ppm2      1.271 CV     1
 ASSI {   88}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      3.600     1.600     1.600 peak    88 spectrum    1 weight  0.10000E+01 volume  0.16549E-02 ppm1      7.678 ppm2      8.301 CV     1
 ASSI {   89}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HE3 ))
      4.000     2.000     2.000 peak    89 spectrum    1 weight  0.10000E+01 volume  0.80107E-03 ppm1      7.676 ppm2      6.832 CV     1
 ASSI {   90}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HD1 ))
      3.600     1.600     1.600 peak    90 spectrum    1 weight  0.10000E+01 volume  0.67314E-03 ppm1      7.674 ppm2      6.397 CV     1
 ASSI {   91}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      3.700     1.700     1.700 peak    91 spectrum    1 weight  0.10000E+01 volume  0.11857E-02 ppm1      7.672 ppm2      2.749 CV     1
 ASSI {   92}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 128  and name HA2 ))
      4.300     2.300     1.700 peak    92 spectrum    1 weight  0.10000E+01 volume  0.14104E-02 ppm1      7.672 ppm2      2.398 CV     1
 ASSI {   94}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      4.500     2.500     1.500 peak    94 spectrum    1 weight  0.10000E+01 volume  0.60024E-03 ppm1      9.541 ppm2      5.829 CV     1
 ASSI {   95}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      4.400     2.400     1.600 peak    95 spectrum    1 weight  0.10000E+01 volume  0.66914E-03 ppm1      9.543 ppm2      9.187 CV     1
 ASSI {   96}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.200     1.300     1.300 peak    96 spectrum    1 weight  0.10000E+01 volume  0.14450E-02 ppm1      9.542 ppm2      8.871 CV     1
 ASSI {  101}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      3.300     1.400     1.400 peak   101 spectrum    1 weight  0.10000E+01 volume  0.85664E-03 ppm1      9.536 ppm2      5.299 CV     1
 ASSI {  102}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 114  and name HB1 ))
      4.100     2.100     1.900 peak   102 spectrum    1 weight  0.10000E+01 volume  0.99188E-03 ppm1      9.534 ppm2      1.514 CV     1
 ASSI {  103}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 141  and name HN  ))
      4.200     2.200     1.800 peak   103 spectrum    1 weight  0.10000E+01 volume  0.71710E-03 ppm1      9.430 ppm2      8.884 CV     1
 ASSI {  104}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      2.900     1.100     1.100 peak   104 spectrum    1 weight  0.10000E+01 volume  0.29252E-02 ppm1      9.431 ppm2      8.719 CV     1
 ASSI {  105}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      4.500     2.500     1.500 peak   105 spectrum    1 weight  0.10000E+01 volume  0.64569E-03 ppm1      9.420 ppm2      8.335 CV     1
 ASSI {  106}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 112  and name HD% )
      2.700     2.700     3.300 peak   106 spectrum    1 weight  0.10000E+01 volume  0.91588E-03 ppm1      9.422 ppm2      6.770 CV     1
 ASSI {  108}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      3.600     1.600     1.600 peak   108 spectrum    1 weight  0.10000E+01 volume  0.13324E-02 ppm1      9.422 ppm2      5.586 CV     1
 ASSI {  109}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 141  and name HA  ))
      2.300     0.700     0.700 peak   109 spectrum    1 weight  0.10000E+01 volume  0.71207E-02 ppm1      9.422 ppm2      5.140 CV     1
 ASSI {  110}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 110  and name HA1 ))
      4.100     2.100     1.900 peak   110 spectrum    1 weight  0.10000E+01 volume  0.10396E-02 ppm1      9.420 ppm2      4.239 CV     1
 ASSI {  112}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 141  and name HG2%)
      2.700     0.900     0.900 peak   112 spectrum    1 weight  0.10000E+01 volume  0.44332E-02 ppm1      9.422 ppm2      1.203 CV     1
 ASSI {  113}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      2.800     2.800     3.200 peak   113 spectrum    1 weight  0.10000E+01 volume  0.43408E-02 ppm1      9.426 ppm2      0.630 CV     1
 ASSI {  114}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 140  and name HG  ))
      3.600     1.600     1.600 peak   114 spectrum    1 weight  0.10000E+01 volume  0.71847E-03 ppm1      9.420 ppm2      0.402 CV     1
 ASSI {  116}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
      3.800     1.800     1.800 peak   116 spectrum    1 weight  0.10000E+01 volume  0.62604E-03 ppm1      9.641 ppm2      1.511 CV     1
 ASSI {  117}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
      4.500     2.600     1.500 peak   117 spectrum    1 weight  0.10000E+01 volume  0.51602E-03 ppm1      9.015 ppm2      9.284 CV     1
 ASSI {  118}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.800     0.900     0.900 peak   118 spectrum    1 weight  0.10000E+01 volume  0.23943E-02 ppm1      9.017 ppm2      4.628 CV     1
 ASSI {  119}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 5    and name HG1%)
      3.500     1.500     1.500 peak   119 spectrum    1 weight  0.10000E+01 volume  0.12108E-02 ppm1      9.013 ppm2      1.411 CV     1
 ASSI {  122}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HB1 ))
      2.900     1.000     1.000 peak   122 spectrum    1 weight  0.10000E+01 volume  0.40860E-02 ppm1      9.013 ppm2      1.921 CV     1
 ASSI {  125}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
      4.600     2.700     1.400 peak   125 spectrum    1 weight  0.10000E+01 volume  0.49538E-03 ppm1      8.950 ppm2      9.315 CV     1
 ASSI {  126}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HN  ))
      3.700     1.700     1.700 peak   126 spectrum    1 weight  0.10000E+01 volume  0.10992E-02 ppm1      8.954 ppm2      8.299 CV     1
 ASSI {  127}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HA  ))
      2.800     1.000     1.000 peak   127 spectrum    1 weight  0.10000E+01 volume  0.33058E-02 ppm1      8.954 ppm2      4.968 CV     1
 ASSI {  130}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HG1 ))
      3.100     1.200     1.200 peak   130 spectrum    1 weight  0.10000E+01 volume  0.34925E-02 ppm1      8.952 ppm2      2.320 CV     1
 ASSI {  131}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
      2.800     1.000     1.000 peak   131 spectrum    1 weight  0.10000E+01 volume  0.38411E-02 ppm1      8.950 ppm2      1.991 CV     1
 OR {  131}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  138}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      4.300     2.300     1.700 peak   138 spectrum    1 weight  0.10000E+01 volume  0.63574E-03 ppm1      9.637 ppm2      8.743 CV     1
 ASSI {  143}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 66   and name HE% )
      4.400     2.400     1.600 peak   143 spectrum    1 weight  0.10000E+01 volume  0.81329E-03 ppm1      9.638 ppm2      6.654 CV     1
 ASSI {  144}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      2.700     0.900     0.900 peak   144 spectrum    1 weight  0.10000E+01 volume  0.26763E-02 ppm1      9.635 ppm2      4.727 CV     1
 ASSI {  149}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HG  ))
      3.700     1.700     1.700 peak   149 spectrum    1 weight  0.10000E+01 volume  0.10592E-02 ppm1      9.640 ppm2      1.207 CV     1
 ASSI {  150}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 100  and name HG2%)
      3.400     3.400     2.600 peak   150 spectrum    1 weight  0.10000E+01 volume  0.15583E-02 ppm1      9.635 ppm2      0.892 CV     1
 ASSI {  153}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      4.500     2.500     1.500 peak   153 spectrum    1 weight  0.10000E+01 volume  0.50946E-03 ppm1      9.630 ppm2      5.290 CV     1
 ASSI {  157}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 112  and name HD% )
      4.500     2.600     1.500 peak   157 spectrum    1 weight  0.10000E+01 volume  0.62567E-03 ppm1      9.279 ppm2      6.783 CV     1
 ASSI {  162}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      3.700     1.700     1.700 peak   162 spectrum    1 weight  0.10000E+01 volume  0.87005E-03 ppm1      9.268 ppm2      2.730 CV     1
 ASSI {  163}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HB1 ))
      2.400     0.700     0.700 peak   163 spectrum    1 weight  0.10000E+01 volume  0.36298E-02 ppm1      9.272 ppm2      1.692 CV     1
 ASSI {  164}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HG1 ))
      3.000     1.100     1.100 peak   164 spectrum    1 weight  0.10000E+01 volume  0.27302E-02 ppm1      9.272 ppm2      1.265 CV     1
 OR {  164}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HG2 ))
 ASSI {  166}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
      3.600     1.600     1.600 peak   166 spectrum    1 weight  0.10000E+01 volume  0.37904E-02 ppm1      9.270 ppm2      0.673 CV     1
 OR {  166}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI {  167}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HG  ))
      3.500     1.500     1.500 peak   167 spectrum    1 weight  0.10000E+01 volume  0.17675E-02 ppm1      9.274 ppm2      0.402 CV     1
 ASSI {  168}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 77   and name HD1 ))
      2.700     0.900     0.900 peak   168 spectrum    1 weight  0.10000E+01 volume  0.36998E-02 ppm1      9.176 ppm2      6.812 CV     1
 ASSI {  169}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 77   and name HZ3 ))
      4.400     2.500     1.600 peak   169 spectrum    1 weight  0.10000E+01 volume  0.48444E-03 ppm1      9.174 ppm2      6.337 CV     1
 ASSI {  170}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 86   and name HA  ))
      4.400     2.400     1.600 peak   170 spectrum    1 weight  0.10000E+01 volume  0.78126E-03 ppm1      9.178 ppm2      2.701 CV     1
 OR {  170}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 86   and name HE1 ))
 ASSI {  171}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 71   and name HB2 ))
      4.100     2.100     1.900 peak   171 spectrum    1 weight  0.10000E+01 volume  0.87203E-03 ppm1      9.174 ppm2      2.419 CV     1
 ASSI {  172}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 86   and name HD2 ))
      4.100     2.100     1.900 peak   172 spectrum    1 weight  0.10000E+01 volume  0.64391E-03 ppm1      9.175 ppm2      0.299 CV     1
 ASSI {  173}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      3.500     1.500     1.500 peak   173 spectrum    1 weight  0.10000E+01 volume  0.18159E-02 ppm1      9.171 ppm2      8.830 CV     1
 ASSI {  175}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 76   and name HN  ))
      4.500     2.500     1.500 peak   175 spectrum    1 weight  0.10000E+01 volume  0.53427E-03 ppm1      9.177 ppm2      8.148 CV     1
 ASSI {  176}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 92   and name HZ2 ))
      4.300     2.300     1.700 peak   176 spectrum    1 weight  0.10000E+01 volume  0.44638E-03 ppm1      9.167 ppm2      7.636 CV     1
 ASSI {  178}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 75   and name HB2 ))
      3.500     1.500     1.500 peak   178 spectrum    1 weight  0.10000E+01 volume  0.94192E-03 ppm1      9.171 ppm2      4.329 CV     1
 ASSI {  182}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      2.800     1.000     1.000 peak   182 spectrum    1 weight  0.10000E+01 volume  0.35393E-02 ppm1      9.168 ppm2      1.658 CV     1
 ASSI {  184}
   (( segid "    " and resid 139  and name HN  ))
   (  segid "    " and resid 138  and name HG2%)
      3.200     3.200     2.800 peak   184 spectrum    1 weight  0.10000E+01 volume  0.43383E-02 ppm1      9.164 ppm2      0.808 CV     1
 ASSI {  186}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 86   and name HG2 ))
      4.700     2.700     1.300 peak   186 spectrum    1 weight  0.10000E+01 volume  0.49662E-03 ppm1      9.173 ppm2     -0.568 CV     1
 ASSI {  187}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      2.200     0.600     0.600 peak   187 spectrum    1 weight  0.10000E+01 volume  0.86485E-02 ppm1      9.167 ppm2      5.299 CV     1
 ASSI {  188}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      3.200     1.200     1.200 peak   188 spectrum    1 weight  0.10000E+01 volume  0.12659E-02 ppm1      9.165 ppm2      4.979 CV     1
 ASSI {  191}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      3.800     1.800     1.800 peak   191 spectrum    1 weight  0.10000E+01 volume  0.14260E-02 ppm1      9.013 ppm2      5.628 CV     1
 ASSI {  192}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      4.900     2.900     1.100 peak   192 spectrum    1 weight  0.10000E+01 volume  0.42504E-03 ppm1      8.955 ppm2      5.668 CV     1
 ASSI {  195}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      3.800     1.800     1.800 peak   195 spectrum    1 weight  0.10000E+01 volume  0.16767E-02 ppm1      8.342 ppm2      8.800 CV     1
 ASSI {  197}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      2.400     0.700     0.700 peak   197 spectrum    1 weight  0.10000E+01 volume  0.64226E-02 ppm1      8.351 ppm2      4.651 CV     1
 ASSI {  199}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 13   and name HB% )
      2.400     0.700     0.700 peak   199 spectrum    1 weight  0.10000E+01 volume  0.94952E-02 ppm1      8.340 ppm2      1.364 CV     1
 ASSI {  200}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 12   and name HG1%)
      2.500     0.800     0.800 peak   200 spectrum    1 weight  0.10000E+01 volume  0.77308E-02 ppm1      8.351 ppm2      0.918 CV     1
 OR {  200}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 12   and name HG2%)
 ASSI {  203}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 122  and name HN  ))
      3.800     1.800     1.800 peak   203 spectrum    1 weight  0.10000E+01 volume  0.72776E-03 ppm1      9.550 ppm2      7.708 CV     1
 ASSI {  205}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 121  and name HZ2 ))
      2.400     0.700     0.700 peak   205 spectrum    1 weight  0.10000E+01 volume  0.76342E-02 ppm1      9.551 ppm2      7.235 CV     1
 ASSI {  207}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 121  and name HD1 ))
      2.300     0.600     0.600 peak   207 spectrum    1 weight  0.10000E+01 volume  0.11549E-01 ppm1      9.546 ppm2      6.388 CV     1
 ASSI {  208}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 85   and name HD% )
      3.400     1.400     1.400 peak   208 spectrum    1 weight  0.10000E+01 volume  0.14053E-02 ppm1      9.550 ppm2      6.015 CV     1
 ASSI {  210}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      3.400     1.500     1.500 peak   210 spectrum    1 weight  0.10000E+01 volume  0.96546E-03 ppm1      9.549 ppm2      4.667 CV     1
 ASSI {  212}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HB  ))
      4.100     2.100     1.900 peak   212 spectrum    1 weight  0.10000E+01 volume  0.16851E-02 ppm1      9.539 ppm2      4.066 CV     1
 ASSI {  213}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 123  and name HA  ))
      3.200     1.300     1.300 peak   213 spectrum    1 weight  0.10000E+01 volume  0.21713E-02 ppm1      9.545 ppm2      3.935 CV     1
 ASSI {  214}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 128  and name HA1 ))
      3.700     1.700     1.700 peak   214 spectrum    1 weight  0.10000E+01 volume  0.76710E-03 ppm1      9.551 ppm2      3.321 CV     1
 ASSI {  217}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB2 ))
      2.900     1.000     1.000 peak   217 spectrum    1 weight  0.10000E+01 volume  0.33507E-02 ppm1      9.542 ppm2      2.330 CV     1
 ASSI {  219}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 126  and name HG1 ))
      3.400     1.500     1.500 peak   219 spectrum    1 weight  0.10000E+01 volume  0.24684E-02 ppm1      9.548 ppm2      1.366 CV     1
 OR {  219}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI {  225}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 8    and name HN  ))
      4.700     2.800     1.300 peak   225 spectrum    1 weight  0.10000E+01 volume  0.42111E-03 ppm1      7.675 ppm2      8.850 CV     1
 ASSI {  226}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 134  and name HN  ))
      3.500     1.500     1.500 peak   226 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      7.654 ppm2      8.403 CV     1
 ASSI {  227}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      2.800     1.000     1.000 peak   227 spectrum    1 weight  0.10000E+01 volume  0.22916E-02 ppm1      7.652 ppm2      4.923 CV     1
 ASSI {  229}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
      3.900     1.900     1.900 peak   229 spectrum    1 weight  0.10000E+01 volume  0.12554E-02 ppm1      7.654 ppm2      1.235 CV     1
 ASSI {  230}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 7    and name HG1%)
      3.300     3.300     2.700 peak   230 spectrum    1 weight  0.10000E+01 volume  0.35321E-02 ppm1      7.662 ppm2      0.914 CV     1
 ASSI {  231}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HN  ))
      4.500     2.500     1.500 peak   231 spectrum    1 weight  0.10000E+01 volume  0.49001E-03 ppm1      7.654 ppm2      9.018 CV     1
 ASSI {  236}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      4.200     2.200     1.800 peak   236 spectrum    1 weight  0.10000E+01 volume  0.10495E-02 ppm1      8.369 ppm2      8.178 CV     1
 ASSI {  237}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HD1 ))
      3.200     1.300     1.300 peak   237 spectrum    1 weight  0.10000E+01 volume  0.16494E-02 ppm1      8.369 ppm2      6.802 CV     1
 ASSI {  238}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      2.500     0.800     0.800 peak   238 spectrum    1 weight  0.10000E+01 volume  0.44436E-02 ppm1      8.365 ppm2      4.647 CV     1
 ASSI {  239}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
      3.900     1.900     1.900 peak   239 spectrum    1 weight  0.10000E+01 volume  0.16168E-02 ppm1      8.363 ppm2      2.054 CV     1
 ASSI {  240}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
      3.200     1.200     1.200 peak   240 spectrum    1 weight  0.10000E+01 volume  0.97714E-03 ppm1      8.368 ppm2      1.645 CV     1
 ASSI {  242}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      4.400     2.400     1.600 peak   242 spectrum    1 weight  0.10000E+01 volume  0.63111E-03 ppm1      8.362 ppm2      9.230 CV     1
 ASSI {  243}
   (( segid "    " and resid 77   and name HN  ))
   (  segid "    " and resid 84   and name HE% )
      4.700     2.700     1.300 peak   243 spectrum    1 weight  0.10000E+01 volume  0.48366E-03 ppm1      8.359 ppm2      6.275 CV     1
 ASSI {  245}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 113  and name HN  ))
      4.600     2.600     1.400 peak   245 spectrum    1 weight  0.10000E+01 volume  0.65568E-03 ppm1      8.122 ppm2      8.722 CV     1
 ASSI {  249}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      3.500     1.500     1.500 peak   249 spectrum    1 weight  0.10000E+01 volume  0.16076E-02 ppm1      8.123 ppm2      3.485 CV     1
 ASSI {  250}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      2.600     0.800     0.800 peak   250 spectrum    1 weight  0.10000E+01 volume  0.48626E-02 ppm1      8.123 ppm2      2.829 CV     1
 ASSI {  251}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
      2.800     1.000     1.000 peak   251 spectrum    1 weight  0.10000E+01 volume  0.50657E-02 ppm1      8.123 ppm2      2.740 CV     1
 ASSI {  254}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
      3.000     1.100     1.100 peak   254 spectrum    1 weight  0.10000E+01 volume  0.20604E-02 ppm1      8.028 ppm2      7.673 CV     1
 ASSI {  255}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 121  and name HE3 ))
      2.500     2.500     3.500 peak   255 spectrum    1 weight  0.10000E+01 volume  0.16139E-02 ppm1      8.024 ppm2      6.912 CV     1
 ASSI {  256}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      2.700     0.900     0.900 peak   256 spectrum    1 weight  0.10000E+01 volume  0.26206E-02 ppm1      8.024 ppm2      4.693 CV     1
 ASSI {  260}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 129  and name HB1 ))
      4.300     2.400     1.700 peak   260 spectrum    1 weight  0.10000E+01 volume  0.12109E-02 ppm1      8.022 ppm2      3.139 CV     1
 ASSI {  261}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 129  and name HB2 ))
      3.700     1.800     1.800 peak   261 spectrum    1 weight  0.10000E+01 volume  0.91658E-03 ppm1      8.024 ppm2      2.971 CV     1
 ASSI {  263}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 41   and name HB% )
      4.200     2.200     1.800 peak   263 spectrum    1 weight  0.10000E+01 volume  0.49047E-03 ppm1      8.027 ppm2      1.488 CV     1
 ASSI {  265}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      4.000     2.000     2.000 peak   265 spectrum    1 weight  0.10000E+01 volume  0.68759E-03 ppm1      8.021 ppm2      6.646 CV     1
 ASSI {  276}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 99   and name HD% )
      2.500     0.800     0.800 peak   276 spectrum    1 weight  0.10000E+01 volume  0.26849E-02 ppm1      8.995 ppm2      6.824 CV     1
 ASSI {  277}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      4.200     2.200     1.800 peak   277 spectrum    1 weight  0.10000E+01 volume  0.55834E-03 ppm1      8.993 ppm2      5.257 CV     1
 ASSI {  280}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      4.000     2.000     2.000 peak   280 spectrum    1 weight  0.10000E+01 volume  0.42937E-03 ppm1      8.995 ppm2      3.512 CV     1
 ASSI {  281}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      2.800     1.000     1.000 peak   281 spectrum    1 weight  0.10000E+01 volume  0.34685E-02 ppm1      8.997 ppm2      2.535 CV     1
 OR {  281}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI {  284}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 98   and name HG2%)
      2.600     0.800     0.800 peak   284 spectrum    1 weight  0.10000E+01 volume  0.53381E-02 ppm1      8.997 ppm2      0.514 CV     1
 ASSI {  286}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      2.700     2.700     3.300 peak   286 spectrum    1 weight  0.10000E+01 volume  0.88896E-03 ppm1      8.989 ppm2     -0.116 CV     1
 ASSI {  288}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 85   and name HD% )
      3.500     1.500     1.500 peak   288 spectrum    1 weight  0.10000E+01 volume  0.16052E-02 ppm1      8.512 ppm2      6.018 CV     1
 ASSI {  291}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 77   and name HH2 ))
      3.800     1.800     1.800 peak   291 spectrum    1 weight  0.10000E+01 volume  0.79290E-03 ppm1      8.504 ppm2      6.650 CV     1
 ASSI {  293}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      2.300     0.700     0.700 peak   293 spectrum    1 weight  0.10000E+01 volume  0.44770E-02 ppm1      8.512 ppm2      5.686 CV     1
 ASSI {  294}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HB1 ))
      3.800     1.800     1.800 peak   294 spectrum    1 weight  0.10000E+01 volume  0.22522E-02 ppm1      8.506 ppm2      2.755 CV     1
 ASSI {  295}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
      2.900     1.100     1.100 peak   295 spectrum    1 weight  0.10000E+01 volume  0.14682E-02 ppm1      8.504 ppm2      2.390 CV     1
 ASSI {  296}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      2.700     0.900     0.900 peak   296 spectrum    1 weight  0.10000E+01 volume  0.25994E-02 ppm1      8.506 ppm2      1.275 CV     1
 ASSI {  297}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HG1 ))
      4.500     2.600     1.500 peak   297 spectrum    1 weight  0.10000E+01 volume  0.52969E-03 ppm1      8.504 ppm2      0.959 CV     1
 ASSI {  298}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      3.700     1.700     1.700 peak   298 spectrum    1 weight  0.10000E+01 volume  0.17946E-02 ppm1      8.509 ppm2     -0.798 CV     1
 ASSI {  314}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 92   and name HZ3 ))
      4.600     2.600     1.400 peak   314 spectrum    1 weight  0.10000E+01 volume  0.48836E-03 ppm1      8.900 ppm2      6.739 CV     1
 OR {  314}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 92   and name HH2 ))
 ASSI {  316}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.200     1.300     1.300 peak   316 spectrum    1 weight  0.10000E+01 volume  0.92508E-03 ppm1      8.900 ppm2      4.779 CV     1
 ASSI {  319}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
      2.700     0.900     0.900 peak   319 spectrum    1 weight  0.10000E+01 volume  0.37133E-02 ppm1      8.905 ppm2      1.976 CV     1
 ASSI {  320}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      4.100     2.100     1.900 peak   320 spectrum    1 weight  0.10000E+01 volume  0.11468E-02 ppm1      8.902 ppm2      8.589 CV     1
 ASSI {  324}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      4.100     2.100     1.900 peak   324 spectrum    1 weight  0.10000E+01 volume  0.58665E-03 ppm1      8.853 ppm2      8.025 CV     1
 ASSI {  325}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HB1 ))
      3.200     1.300     1.300 peak   325 spectrum    1 weight  0.10000E+01 volume  0.23542E-02 ppm1      8.855 ppm2      1.496 CV     1
 ASSI {  329}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      4.300     2.300     1.700 peak   329 spectrum    1 weight  0.10000E+01 volume  0.63735E-03 ppm1      8.598 ppm2      9.468 CV     1
 ASSI {  330}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      3.000     1.100     1.100 peak   330 spectrum    1 weight  0.10000E+01 volume  0.31404E-02 ppm1      8.586 ppm2      8.196 CV     1
 ASSI {  332}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      2.800     1.000     1.000 peak   332 spectrum    1 weight  0.10000E+01 volume  0.66414E-02 ppm1      8.586 ppm2      3.850 CV     1
 ASSI {  333}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB1 ))
      2.900     1.100     1.100 peak   333 spectrum    1 weight  0.10000E+01 volume  0.28883E-02 ppm1      8.583 ppm2      2.537 CV     1
 OR {  333}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI {  334}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
      2.900     1.000     1.000 peak   334 spectrum    1 weight  0.10000E+01 volume  0.32674E-02 ppm1      8.585 ppm2      1.511 CV     1
 ASSI {  335}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 100  and name HG1%)
      3.400     3.400     2.600 peak   335 spectrum    1 weight  0.10000E+01 volume  0.19985E-02 ppm1      8.591 ppm2      0.915 CV     1
 ASSI {  337}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      3.800     1.800     1.800 peak   337 spectrum    1 weight  0.10000E+01 volume  0.95877E-03 ppm1      8.338 ppm2      5.515 CV     1
 ASSI {  338}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 14   and name HN  ))
      3.500     1.600     1.600 peak   338 spectrum    1 weight  0.10000E+01 volume  0.11558E-02 ppm1      8.340 ppm2      8.711 CV     1
 ASSI {  339}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      2.300     0.600     0.600 peak   339 spectrum    1 weight  0.10000E+01 volume  0.79566E-02 ppm1      8.338 ppm2      5.134 CV     1
 ASSI {  341}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      2.100     2.100     3.900 peak   341 spectrum    1 weight  0.10000E+01 volume  0.42289E-02 ppm1      8.338 ppm2      0.689 CV     1
 ASSI {  344}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      3.200     1.300     1.300 peak   344 spectrum    1 weight  0.10000E+01 volume  0.10408E-02 ppm1      9.116 ppm2      3.949 CV     1
 ASSI {  345}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 86   and name HE1 ))
      3.500     1.500     1.500 peak   345 spectrum    1 weight  0.10000E+01 volume  0.55726E-03 ppm1      9.114 ppm2      2.750 CV     1
 ASSI {  346}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
      4.300     2.300     1.700 peak   346 spectrum    1 weight  0.10000E+01 volume  0.50991E-03 ppm1      9.119 ppm2      2.490 CV     1
 ASSI {  348}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
      2.700     0.900     0.900 peak   348 spectrum    1 weight  0.10000E+01 volume  0.51119E-02 ppm1      9.112 ppm2      1.251 CV     1
 OR {  348}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 40   and name HG1%)
 ASSI {  350}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      4.200     2.200     1.800 peak   350 spectrum    1 weight  0.10000E+01 volume  0.35689E-03 ppm1      9.110 ppm2      8.535 CV     1
 ASSI {  351}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      4.400     2.400     1.600 peak   351 spectrum    1 weight  0.10000E+01 volume  0.57010E-03 ppm1      9.106 ppm2      8.236 CV     1
 ASSI {  352}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      3.000     1.100     1.100 peak   352 spectrum    1 weight  0.10000E+01 volume  0.12186E-02 ppm1      9.110 ppm2      4.658 CV     1
 ASSI {  353}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      5.200     3.400     0.800 peak   353 spectrum    1 weight  0.10000E+01 volume  0.48399E-03 ppm1      9.110 ppm2     -0.807 CV     1
 ASSI {  355}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HN  ))
      4.100     2.100     1.900 peak   355 spectrum    1 weight  0.10000E+01 volume  0.76053E-03 ppm1      8.905 ppm2      9.247 CV     1
 ASSI {  357}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
      2.200     0.600     0.600 peak   357 spectrum    1 weight  0.10000E+01 volume  0.79876E-02 ppm1      8.889 ppm2      5.429 CV     1
 ASSI {  361}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      2.500     2.500     3.500 peak   361 spectrum    1 weight  0.10000E+01 volume  0.59491E-02 ppm1      8.885 ppm2      0.648 CV     1
 ASSI {  362}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HG  ))
      3.600     1.600     1.600 peak   362 spectrum    1 weight  0.10000E+01 volume  0.13038E-02 ppm1      8.887 ppm2      0.409 CV     1
 ASSI {  363}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      4.100     2.100     1.900 peak   363 spectrum    1 weight  0.10000E+01 volume  0.94147E-03 ppm1      8.742 ppm2      8.426 CV     1
 ASSI {  364}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      2.600     0.800     0.800 peak   364 spectrum    1 weight  0.10000E+01 volume  0.46240E-02 ppm1      8.739 ppm2      4.582 CV     1
 ASSI {  366}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      4.400     2.400     1.600 peak   366 spectrum    1 weight  0.10000E+01 volume  0.48518E-03 ppm1      8.735 ppm2      9.188 CV     1
 ASSI {  368}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 142  and name HB  ))
      4.900     3.000     1.100 peak   368 spectrum    1 weight  0.10000E+01 volume  0.60643E-03 ppm1      8.334 ppm2      2.153 CV     1
 ASSI {  370}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      3.500     1.500     1.500 peak   370 spectrum    1 weight  0.10000E+01 volume  0.89400E-03 ppm1      7.571 ppm2      4.561 CV     1
 ASSI {  371}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      2.400     0.700     0.700 peak   371 spectrum    1 weight  0.10000E+01 volume  0.52027E-02 ppm1      7.579 ppm2      4.039 CV     1
 ASSI {  372}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      3.400     1.400     1.400 peak   372 spectrum    1 weight  0.10000E+01 volume  0.13593E-02 ppm1      7.578 ppm2      3.864 CV     1
 OR {  372}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
 ASSI {  373}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HB1 ))
      3.100     1.200     1.200 peak   373 spectrum    1 weight  0.10000E+01 volume  0.22232E-02 ppm1      7.579 ppm2      3.149 CV     1
 ASSI {  374}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
      3.100     1.200     1.200 peak   374 spectrum    1 weight  0.10000E+01 volume  0.23836E-02 ppm1      7.579 ppm2      2.974 CV     1
 ASSI {  375}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 86   and name HE1 ))
      3.500     1.500     1.500 peak   375 spectrum    1 weight  0.10000E+01 volume  0.89061E-03 ppm1      7.569 ppm2      2.701 CV     1
 ASSI {  376}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 32   and name HB% )
      2.700     0.900     0.900 peak   376 spectrum    1 weight  0.10000E+01 volume  0.44543E-02 ppm1      7.569 ppm2      1.768 CV     1
 ASSI {  377}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
      3.100     3.100     2.900 peak   377 spectrum    1 weight  0.10000E+01 volume  0.29047E-02 ppm1      7.569 ppm2      1.246 CV     1
 OR {  377}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 40   and name HG1%)
 ASSI {  378}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      4.400     2.400     1.600 peak   378 spectrum    1 weight  0.10000E+01 volume  0.64338E-03 ppm1      7.572 ppm2      8.235 CV     1
 ASSI {  381}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 133  and name HN  ))
      4.100     2.100     1.900 peak   381 spectrum    1 weight  0.10000E+01 volume  0.10317E-02 ppm1      9.306 ppm2      8.374 CV     1
 ASSI {  385}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
      3.500     1.600     1.600 peak   385 spectrum    1 weight  0.10000E+01 volume  0.21116E-02 ppm1      9.304 ppm2      1.992 CV     1
 OR {  385}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI {  387}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 5    and name HG2%)
      3.200     1.300     1.300 peak   387 spectrum    1 weight  0.10000E+01 volume  0.14681E-02 ppm1      9.304 ppm2      1.071 CV     1
 ASSI {  388}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      3.100     1.200     1.200 peak   388 spectrum    1 weight  0.10000E+01 volume  0.18336E-02 ppm1      8.741 ppm2      5.276 CV     1
 ASSI {  391}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HB2 ))
      3.700     1.700     1.700 peak   391 spectrum    1 weight  0.10000E+01 volume  0.13193E-02 ppm1      8.739 ppm2      1.456 CV     1
 ASSI {  393}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 10   and name HD1%)
      4.200     2.200     1.800 peak   393 spectrum    1 weight  0.10000E+01 volume  0.13791E-02 ppm1      8.733 ppm2      0.518 CV     1
 ASSI {  394}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 130  and name HN  ))
      4.300     2.300     1.700 peak   394 spectrum    1 weight  0.10000E+01 volume  0.79240E-03 ppm1      8.389 ppm2      8.022 CV     1
 ASSI {  395}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HN  ))
      3.200     1.300     1.300 peak   395 spectrum    1 weight  0.10000E+01 volume  0.17200E-02 ppm1      8.389 ppm2      7.391 CV     1
 ASSI {  396}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 121  and name HE3 ))
      2.900     2.900     3.100 peak   396 spectrum    1 weight  0.10000E+01 volume  0.27745E-02 ppm1      8.382 ppm2      6.906 CV     1
 ASSI {  397}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      3.600     1.600     1.600 peak   397 spectrum    1 weight  0.10000E+01 volume  0.61497E-03 ppm1      8.389 ppm2      4.701 CV     1
 ASSI {  398}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HA1 ))
      2.900     1.100     1.100 peak   398 spectrum    1 weight  0.10000E+01 volume  0.57146E-02 ppm1      8.389 ppm2      3.328 CV     1
 ASSI {  399}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 129  and name HB1 ))
      2.600     0.800     0.800 peak   399 spectrum    1 weight  0.10000E+01 volume  0.39983E-02 ppm1      8.389 ppm2      3.141 CV     1
 ASSI {  400}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 129  and name HB2 ))
      3.100     1.200     1.200 peak   400 spectrum    1 weight  0.10000E+01 volume  0.43841E-02 ppm1      8.389 ppm2      2.980 CV     1
 ASSI {  401}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HA2 ))
      2.500     0.800     0.800 peak   401 spectrum    1 weight  0.10000E+01 volume  0.39395E-02 ppm1      8.386 ppm2      2.369 CV     1
 ASSI {  403}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 43   and name HG2 ))
      4.100     2.100     1.900 peak   403 spectrum    1 weight  0.10000E+01 volume  0.20355E-02 ppm1      8.393 ppm2      0.843 CV     1
 ASSI {  406}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.700     0.900     0.900 peak   406 spectrum    1 weight  0.10000E+01 volume  0.24982E-02 ppm1      8.006 ppm2      4.693 CV     1
 ASSI {  409}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HB2 ))
      3.900     1.900     1.900 peak   409 spectrum    1 weight  0.10000E+01 volume  0.13755E-02 ppm1      8.008 ppm2      1.511 CV     1
 OR {  409}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI {  410}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HG  ))
      3.900     1.900     1.900 peak   410 spectrum    1 weight  0.10000E+01 volume  0.14973E-02 ppm1      8.014 ppm2      1.293 CV     1
 ASSI {  411}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 114  and name HD2%)
      3.600     3.600     2.400 peak   411 spectrum    1 weight  0.10000E+01 volume  0.40277E-02 ppm1      8.008 ppm2      0.809 CV     1
 ASSI {  416}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 116  and name HG  ))
      3.400     3.400     2.600 peak   416 spectrum    1 weight  0.10000E+01 volume  0.14689E-02 ppm1      8.007 ppm2      0.535 CV     1
 ASSI {  418}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HD21))
      4.500     2.600     1.500 peak   418 spectrum    1 weight  0.10000E+01 volume  0.90547E-03 ppm1      9.306 ppm2      7.753 CV     1
 ASSI {  419}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      4.700     2.700     1.300 peak   419 spectrum    1 weight  0.10000E+01 volume  0.74567E-03 ppm1      9.304 ppm2      7.452 CV     1
 ASSI {  422}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
      2.900     1.000     1.000 peak   422 spectrum    1 weight  0.10000E+01 volume  0.19802E-02 ppm1      9.300 ppm2      5.658 CV     1
 ASSI {  424}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      2.400     0.700     0.700 peak   424 spectrum    1 weight  0.10000E+01 volume  0.87691E-02 ppm1      9.302 ppm2      4.077 CV     1
 ASSI {  425}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HB1 ))
      3.400     1.500     1.500 peak   425 spectrum    1 weight  0.10000E+01 volume  0.30758E-02 ppm1      9.304 ppm2      3.059 CV     1
 ASSI {  426}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      2.300     0.700     0.700 peak   426 spectrum    1 weight  0.10000E+01 volume  0.45550E-02 ppm1      9.304 ppm2      2.603 CV     1
 ASSI {  429}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.400     0.700     0.700 peak   429 spectrum    1 weight  0.10000E+01 volume  0.52131E-02 ppm1      9.003 ppm2      5.635 CV     1
 ASSI {  431}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 4    and name HG1 ))
      4.000     2.000     2.000 peak   431 spectrum    1 weight  0.10000E+01 volume  0.83108E-03 ppm1      8.999 ppm2      2.291 CV     1
 ASSI {  432}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
      3.800     1.800     1.800 peak   432 spectrum    1 weight  0.10000E+01 volume  0.92009E-03 ppm1      9.002 ppm2      1.985 CV     1
 OR {  432}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  435}
   (( segid "    " and resid 33   and name HN  ))
   (  segid "    " and resid 33   and name HD2%)
      3.800     1.800     1.800 peak   435 spectrum    1 weight  0.10000E+01 volume  0.14781E-02 ppm1      8.997 ppm2      0.897 CV     1
 ASSI {  437}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
      3.300     1.300     1.300 peak   437 spectrum    1 weight  0.10000E+01 volume  0.11366E-02 ppm1      8.682 ppm2      9.417 CV     1
 ASSI {  438}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      4.600     2.700     1.400 peak   438 spectrum    1 weight  0.10000E+01 volume  0.46392E-03 ppm1      8.688 ppm2      9.098 CV     1
 ASSI {  439}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      4.500     2.500     1.500 peak   439 spectrum    1 weight  0.10000E+01 volume  0.55631E-03 ppm1      8.687 ppm2      8.030 CV     1
 ASSI {  442}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HB1 ))
      3.600     1.600     1.600 peak   442 spectrum    1 weight  0.10000E+01 volume  0.21656E-02 ppm1      8.680 ppm2      1.788 CV     1
 ASSI {  445}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HG  ))
      3.200     1.300     1.300 peak   445 spectrum    1 weight  0.10000E+01 volume  0.26063E-02 ppm1      8.686 ppm2      0.510 CV     1
 OR {  445}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 116  and name HD2%)
 ASSI {  446}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 127  and name HB1 ))
      4.100     2.100     1.900 peak   446 spectrum    1 weight  0.10000E+01 volume  0.36930E-03 ppm1      8.406 ppm2      1.933 CV     1
 ASSI {  447}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      3.900     1.900     1.900 peak   447 spectrum    1 weight  0.10000E+01 volume  0.80177E-03 ppm1      9.449 ppm2      9.009 CV     1
 ASSI {  450}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      2.900     1.100     1.100 peak   450 spectrum    1 weight  0.10000E+01 volume  0.16772E-02 ppm1      9.458 ppm2      3.522 CV     1
 ASSI {  451}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 23   and name HB% )
      3.400     3.400     2.600 peak   451 spectrum    1 weight  0.10000E+01 volume  0.24397E-02 ppm1      9.451 ppm2      1.529 CV     1
 ASSI {  452}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 100  and name HG1%)
      2.200     2.200     3.800 peak   452 spectrum    1 weight  0.10000E+01 volume  0.97012E-02 ppm1      9.453 ppm2      0.910 CV     1
 ASSI {  457}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      2.100     0.600     0.600 peak   457 spectrum    1 weight  0.10000E+01 volume  0.12178E-01 ppm1      8.822 ppm2      5.279 CV     1
 ASSI {  458}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      3.300     1.400     1.400 peak   458 spectrum    1 weight  0.10000E+01 volume  0.11317E-02 ppm1      8.822 ppm2      4.641 CV     1
 ASSI {  460}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 12   and name HG2%)
      2.800     2.800     3.200 peak   460 spectrum    1 weight  0.10000E+01 volume  0.63149E-02 ppm1      8.827 ppm2      0.904 CV     1
 OR {  460}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI {  461}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      3.700     3.700     2.300 peak   461 spectrum    1 weight  0.10000E+01 volume  0.15936E-02 ppm1      8.822 ppm2      0.671 CV     1
 OR {  461}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
 ASSI {  463}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      4.400     2.400     1.600 peak   463 spectrum    1 weight  0.10000E+01 volume  0.15013E-02 ppm1      8.821 ppm2      1.660 CV     1
 OR {  463}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 139  and name HD1 ))
 ASSI {  464}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 11   and name HG2%)
      2.900     2.900     3.100 peak   464 spectrum    1 weight  0.10000E+01 volume  0.57559E-02 ppm1      8.820 ppm2      1.228 CV     1
 ASSI {  465}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      3.900     1.900     1.900 peak   465 spectrum    1 weight  0.10000E+01 volume  0.13958E-02 ppm1      8.773 ppm2      9.124 CV     1
 ASSI {  468}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
      3.700     1.700     1.700 peak   468 spectrum    1 weight  0.10000E+01 volume  0.21855E-02 ppm1      8.552 ppm2      4.115 CV     1
 ASSI {  474}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
      2.300     0.700     0.700 peak   474 spectrum    1 weight  0.10000E+01 volume  0.66001E-02 ppm1      8.183 ppm2      2.487 CV     1
 OR {  474}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {  475}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      3.000     1.100     1.100 peak   475 spectrum    1 weight  0.10000E+01 volume  0.21650E-02 ppm1      8.188 ppm2      9.463 CV     1
 ASSI {  478}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      4.000     2.000     2.000 peak   478 spectrum    1 weight  0.10000E+01 volume  0.93156E-03 ppm1      9.438 ppm2      8.399 CV     1
 ASSI {  480}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 49   and name HE% )
      3.400     1.500     1.500 peak   480 spectrum    1 weight  0.10000E+01 volume  0.12979E-02 ppm1      9.440 ppm2      6.915 CV     1
 ASSI {  481}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      3.400     1.400     1.400 peak   481 spectrum    1 weight  0.10000E+01 volume  0.98230E-03 ppm1      9.438 ppm2      6.560 CV     1
 ASSI {  482}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      2.200     0.600     0.600 peak   482 spectrum    1 weight  0.10000E+01 volume  0.90857E-02 ppm1      9.443 ppm2      4.420 CV     1
 ASSI {  483}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      2.200     0.600     0.600 peak   483 spectrum    1 weight  0.10000E+01 volume  0.12228E-01 ppm1      9.438 ppm2      3.902 CV     1
 ASSI {  485}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HB2 ))
      3.000     1.100     1.100 peak   485 spectrum    1 weight  0.10000E+01 volume  0.27985E-02 ppm1      9.440 ppm2      2.021 CV     1
 ASSI {  488}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB  ))
      4.000     2.000     2.000 peak   488 spectrum    1 weight  0.10000E+01 volume  0.92062E-03 ppm1      8.776 ppm2      2.019 CV     1
 ASSI {  492}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      4.900     3.000     1.100 peak   492 spectrum    1 weight  0.10000E+01 volume  0.68631E-03 ppm1      8.773 ppm2      3.035 CV     1
 ASSI {  493}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 40   and name HG1%)
      3.000     1.100     1.100 peak   493 spectrum    1 weight  0.10000E+01 volume  0.39042E-02 ppm1      8.771 ppm2      1.267 CV     1
 OR {  493}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
 ASSI {  499}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      2.300     2.300     3.700 peak   499 spectrum    1 weight  0.10000E+01 volume  0.21650E-01 ppm1      8.205 ppm2      4.403 CV     1
 ASSI {  501}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 100  and name HG1%)
      2.500     2.500     3.500 peak   501 spectrum    1 weight  0.10000E+01 volume  0.13192E-01 ppm1      8.207 ppm2      0.900 CV     1
 ASSI {  504}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 99   and name HD% )
      3.900     1.900     1.900 peak   504 spectrum    1 weight  0.10000E+01 volume  0.45418E-03 ppm1      8.180 ppm2      6.840 CV     1
 ASSI {  505}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      2.600     0.800     0.800 peak   505 spectrum    1 weight  0.10000E+01 volume  0.30847E-02 ppm1      8.182 ppm2      4.041 CV     1
 ASSI {  507}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      4.300     2.300     1.700 peak   507 spectrum    1 weight  0.10000E+01 volume  0.51548E-03 ppm1      7.608 ppm2      8.322 CV     1
 ASSI {  508}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      2.200     0.600     0.600 peak   508 spectrum    1 weight  0.10000E+01 volume  0.10440E-01 ppm1      7.592 ppm2      7.796 CV     1
 ASSI {  511}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 106  and name HB1 ))
      4.100     2.100     1.900 peak   511 spectrum    1 weight  0.10000E+01 volume  0.13897E-02 ppm1      7.592 ppm2      2.992 CV     1
 ASSI {  512}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.900     1.100     1.100 peak   512 spectrum    1 weight  0.10000E+01 volume  0.67764E-02 ppm1      7.596 ppm2      1.882 CV     1
 ASSI {  513}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      2.400     2.400     3.600 peak   513 spectrum    1 weight  0.10000E+01 volume  0.49063E-02 ppm1      7.596 ppm2      1.118 CV     1
 ASSI {  514}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HG  ))
      2.700     0.900     0.900 peak   514 spectrum    1 weight  0.10000E+01 volume  0.31630E-02 ppm1      7.597 ppm2      0.808 CV     1
 ASSI {  515}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 19   and name HD2%)
      2.900     1.100     1.100 peak   515 spectrum    1 weight  0.10000E+01 volume  0.35507E-02 ppm1      7.596 ppm2      0.426 CV     1
 ASSI {  521}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      3.400     1.400     1.400 peak   521 spectrum    1 weight  0.10000E+01 volume  0.73027E-03 ppm1      9.198 ppm2      4.474 CV     1
 ASSI {  524}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.000     1.100     1.100 peak   524 spectrum    1 weight  0.10000E+01 volume  0.30431E-02 ppm1      9.196 ppm2      1.565 CV     1
 ASSI {  526}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      3.900     1.900     1.900 peak   526 spectrum    1 weight  0.10000E+01 volume  0.12759E-02 ppm1      9.202 ppm2      0.295 CV     1
 ASSI {  528}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
      4.100     2.100     1.900 peak   528 spectrum    1 weight  0.10000E+01 volume  0.60569E-03 ppm1      9.200 ppm2      4.096 CV     1
 ASSI {  530}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
      3.200     1.300     1.300 peak   530 spectrum    1 weight  0.10000E+01 volume  0.96587E-03 ppm1      9.167 ppm2      2.070 CV     1
 ASSI {  531}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      4.000     2.000     2.000 peak   531 spectrum    1 weight  0.10000E+01 volume  0.11432E-02 ppm1      9.163 ppm2      9.538 CV     1
 ASSI {  532}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 84   and name HD% )
      3.400     3.400     2.600 peak   532 spectrum    1 weight  0.10000E+01 volume  0.16948E-02 ppm1      9.161 ppm2      6.948 CV     1
 ASSI {  533}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 85   and name HD% )
      2.500     0.800     0.800 peak   533 spectrum    1 weight  0.10000E+01 volume  0.27074E-02 ppm1      9.165 ppm2      5.997 CV     1
 ASSI {  535}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      3.600     1.600     1.600 peak   535 spectrum    1 weight  0.10000E+01 volume  0.10962E-02 ppm1      9.165 ppm2      3.069 CV     1
 ASSI {  537}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
      4.200     2.200     1.800 peak   537 spectrum    1 weight  0.10000E+01 volume  0.11473E-02 ppm1      9.161 ppm2      2.380 CV     1
 ASSI {  538}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      4.400     2.400     1.600 peak   538 spectrum    1 weight  0.10000E+01 volume  0.65972E-03 ppm1      9.160 ppm2      0.818 CV     1
 ASSI {  539}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      4.400     2.500     1.600 peak   539 spectrum    1 weight  0.10000E+01 volume  0.50578E-03 ppm1      8.507 ppm2      9.673 CV     1
 ASSI {  540}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.300     1.400     1.400 peak   540 spectrum    1 weight  0.10000E+01 volume  0.94519E-03 ppm1      8.515 ppm2      4.681 CV     1
 ASSI {  542}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      2.600     0.800     0.800 peak   542 spectrum    1 weight  0.10000E+01 volume  0.25622E-02 ppm1      8.513 ppm2      8.940 CV     1
 ASSI {  551}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      2.800     1.000     1.000 peak   551 spectrum    1 weight  0.10000E+01 volume  0.17342E-02 ppm1      8.501 ppm2      2.220 CV     1
 ASSI {  552}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 57   and name HD1%)
      2.600     0.900     0.900 peak   552 spectrum    1 weight  0.10000E+01 volume  0.55788E-02 ppm1      8.507 ppm2      1.009 CV     1
 OR {  552}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI {  553}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      2.700     2.700     3.300 peak   553 spectrum    1 weight  0.10000E+01 volume  0.10177E-01 ppm1      8.499 ppm2      8.260 CV     1
 ASSI {  554}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      3.700     1.700     1.700 peak   554 spectrum    1 weight  0.10000E+01 volume  0.89470E-03 ppm1      8.500 ppm2      7.942 CV     1
 ASSI {  559}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      2.600     0.900     0.900 peak   559 spectrum    1 weight  0.10000E+01 volume  0.34672E-02 ppm1      8.500 ppm2      3.512 CV     1
 OR {  559}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB2 ))
 ASSI {  561}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HB  ))
      2.800     2.800     3.200 peak   561 spectrum    1 weight  0.10000E+01 volume  0.11287E-01 ppm1      8.500 ppm2      1.965 CV     1
 ASSI {  562}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      3.400     1.400     1.400 peak   562 spectrum    1 weight  0.10000E+01 volume  0.18580E-02 ppm1      8.420 ppm2      9.181 CV     1
 ASSI {  565}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HG  ))
      3.200     1.300     1.300 peak   565 spectrum    1 weight  0.10000E+01 volume  0.15926E-02 ppm1      8.421 ppm2      1.154 CV     1
 ASSI {  566}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 138  and name HG2%)
      3.600     1.600     1.600 peak   566 spectrum    1 weight  0.10000E+01 volume  0.18990E-02 ppm1      8.420 ppm2      0.789 CV     1
 ASSI {  569}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      3.500     1.500     1.500 peak   569 spectrum    1 weight  0.10000E+01 volume  0.91922E-03 ppm1      8.411 ppm2      4.596 CV     1
 ASSI {  571}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HB1 ))
      3.100     1.200     1.200 peak   571 spectrum    1 weight  0.10000E+01 volume  0.23589E-02 ppm1      8.413 ppm2      1.837 CV     1
 ASSI {  573}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 10   and name HD2%)
      3.300     3.300     2.700 peak   573 spectrum    1 weight  0.10000E+01 volume  0.15780E-02 ppm1      8.413 ppm2      0.984 CV     1
 ASSI {  574}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 10   and name HD1%)
      4.000     2.000     2.000 peak   574 spectrum    1 weight  0.10000E+01 volume  0.16458E-02 ppm1      8.413 ppm2      0.505 CV     1
 ASSI {  576}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      4.300     2.300     1.700 peak   576 spectrum    1 weight  0.10000E+01 volume  0.86176E-03 ppm1      8.406 ppm2      8.086 CV     1
 ASSI {  580}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      2.900     1.100     1.100 peak   580 spectrum    1 weight  0.10000E+01 volume  0.20628E-02 ppm1      8.399 ppm2      4.401 CV     1
 ASSI {  584}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      2.700     0.900     0.900 peak   584 spectrum    1 weight  0.10000E+01 volume  0.53423E-02 ppm1      8.398 ppm2      2.301 CV     1
 OR {  584}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
 OR {  584}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI {  585}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      4.500     2.500     1.500 peak   585 spectrum    1 weight  0.10000E+01 volume  0.53596E-03 ppm1      8.159 ppm2      7.845 CV     1
 ASSI {  586}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.600     0.900     0.900 peak   586 spectrum    1 weight  0.10000E+01 volume  0.47098E-02 ppm1      8.149 ppm2      4.290 CV     1
 OR {  586}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI {  589}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 76   and name HB% )
      2.400     0.700     0.700 peak   589 spectrum    1 weight  0.10000E+01 volume  0.94254E-02 ppm1      8.151 ppm2      1.337 CV     1
 ASSI {  591}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      3.000     1.100     1.100 peak   591 spectrum    1 weight  0.10000E+01 volume  0.16681E-02 ppm1      7.966 ppm2      7.297 CV     1
 ASSI {  592}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.700     1.700     1.700 peak   592 spectrum    1 weight  0.10000E+01 volume  0.11599E-02 ppm1      7.960 ppm2      4.701 CV     1
 ASSI {  595}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HB2 ))
      3.000     1.200     1.200 peak   595 spectrum    1 weight  0.10000E+01 volume  0.20697E-02 ppm1      7.966 ppm2      2.334 CV     1
 ASSI {  597}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
      3.100     3.100     2.900 peak   597 spectrum    1 weight  0.10000E+01 volume  0.42731E-03 ppm1      7.966 ppm2      1.643 CV     1
 ASSI {  598}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.900     1.900     1.900 peak   598 spectrum    1 weight  0.10000E+01 volume  0.14307E-02 ppm1      7.964 ppm2      1.324 CV     1
 OR {  598}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HD1 ))
 ASSI {  599}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HG1 ))
      4.100     2.100     1.900 peak   599 spectrum    1 weight  0.10000E+01 volume  0.72226E-03 ppm1      7.960 ppm2      1.022 CV     1
 ASSI {  601}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      3.500     1.500     1.500 peak   601 spectrum    1 weight  0.10000E+01 volume  0.57369E-03 ppm1      7.962 ppm2     -0.788 CV     1
 ASSI {  602}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 85   and name HD% )
      3.100     3.100     2.900 peak   602 spectrum    1 weight  0.10000E+01 volume  0.37338E-03 ppm1      7.959 ppm2      5.989 CV     1
 ASSI {  604}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 112  and name HD% )
      3.100     1.200     1.200 peak   604 spectrum    1 weight  0.10000E+01 volume  0.26323E-02 ppm1      9.472 ppm2      6.775 CV     1
 ASSI {  611}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
      4.100     2.100     1.900 peak   611 spectrum    1 weight  0.10000E+01 volume  0.15514E-02 ppm1      9.468 ppm2      0.628 CV     1
 OR {  611}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI {  615}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      4.000     2.000     2.000 peak   615 spectrum    1 weight  0.10000E+01 volume  0.99332E-03 ppm1      9.092 ppm2      8.785 CV     1
 ASSI {  618}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      3.200     1.300     1.300 peak   618 spectrum    1 weight  0.10000E+01 volume  0.13419E-02 ppm1      9.089 ppm2      6.627 CV     1
 ASSI {  621}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      4.200     2.200     1.800 peak   621 spectrum    1 weight  0.10000E+01 volume  0.45455E-03 ppm1      9.089 ppm2      3.949 CV     1
 ASSI {  622}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      3.200     1.300     1.300 peak   622 spectrum    1 weight  0.10000E+01 volume  0.22461E-02 ppm1      9.089 ppm2      2.996 CV     1
 ASSI {  624}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
      3.300     1.300     1.300 peak   624 spectrum    1 weight  0.10000E+01 volume  0.24301E-02 ppm1      9.091 ppm2      2.497 CV     1
 ASSI {  625}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 41   and name HB% )
      3.200     1.300     1.300 peak   625 spectrum    1 weight  0.10000E+01 volume  0.22924E-02 ppm1      9.089 ppm2      1.518 CV     1
 ASSI {  627}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      3.700     1.700     1.700 peak   627 spectrum    1 weight  0.10000E+01 volume  0.65237E-03 ppm1      9.091 ppm2      8.236 CV     1
 ASSI {  630}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      2.200     0.600     0.600 peak   630 spectrum    1 weight  0.10000E+01 volume  0.55536E-02 ppm1      8.576 ppm2      6.868 CV     1
 ASSI {  631}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      2.400     0.700     0.700 peak   631 spectrum    1 weight  0.10000E+01 volume  0.46999E-02 ppm1      8.574 ppm2      4.192 CV     1
 ASSI {  634}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HG12))
      2.700     0.900     0.900 peak   634 spectrum    1 weight  0.10000E+01 volume  0.27882E-02 ppm1      8.576 ppm2      1.043 CV     1
 ASSI {  638}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HG1 ))
      2.900     2.900     3.100 peak   638 spectrum    1 weight  0.10000E+01 volume  0.68478E-02 ppm1      8.279 ppm2      2.273 CV     1
 OR {  638}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HG2 ))
 ASSI {  644}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      2.600     0.900     0.900 peak   644 spectrum    1 weight  0.10000E+01 volume  0.19468E-02 ppm1      7.671 ppm2      6.858 CV     1
 ASSI {  645}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      4.400     2.400     1.600 peak   645 spectrum    1 weight  0.10000E+01 volume  0.83909E-03 ppm1      7.663 ppm2      9.264 CV     1
 ASSI {  646}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      3.700     1.700     1.700 peak   646 spectrum    1 weight  0.10000E+01 volume  0.11646E-02 ppm1      7.671 ppm2      9.008 CV     1
 ASSI {  647}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      3.700     1.700     1.700 peak   647 spectrum    1 weight  0.10000E+01 volume  0.70835E-03 ppm1      7.671 ppm2      8.596 CV     1
 ASSI {  648}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      4.300     2.300     1.700 peak   648 spectrum    1 weight  0.10000E+01 volume  0.11071E-02 ppm1      7.667 ppm2      5.127 CV     1
 ASSI {  652}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HB  ))
      2.500     0.800     0.800 peak   652 spectrum    1 weight  0.10000E+01 volume  0.42632E-02 ppm1      7.663 ppm2      1.519 CV     1
 ASSI {  653}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 25   and name HG12))
      4.700     2.700     1.300 peak   653 spectrum    1 weight  0.10000E+01 volume  0.74489E-03 ppm1      7.663 ppm2      1.058 CV     1
 ASSI {  654}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 98   and name HD1%)
      3.000     1.100     1.100 peak   654 spectrum    1 weight  0.10000E+01 volume  0.42508E-02 ppm1      7.663 ppm2      0.516 CV     1
 OR {  654}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI {  655}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      4.300     2.400     1.700 peak   655 spectrum    1 weight  0.10000E+01 volume  0.42087E-03 ppm1      7.670 ppm2     -0.114 CV     1
 ASSI {  657}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HN  ))
      4.200     2.200     1.800 peak   657 spectrum    1 weight  0.10000E+01 volume  0.69543E-03 ppm1      9.468 ppm2      8.552 CV     1
 ASSI {  658}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 112  and name HE% )
      4.500     2.500     1.500 peak   658 spectrum    1 weight  0.10000E+01 volume  0.66084E-03 ppm1      9.472 ppm2      6.356 CV     1
 ASSI {  661}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 141  and name HA  ))
      3.400     1.400     1.400 peak   661 spectrum    1 weight  0.10000E+01 volume  0.10622E-02 ppm1      9.475 ppm2      5.129 CV     1
 ASSI {  672}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      4.600     2.700     1.400 peak   672 spectrum    1 weight  0.10000E+01 volume  0.81300E-03 ppm1      9.406 ppm2      8.417 CV     1
 ASSI {  673}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      4.400     2.400     1.600 peak   673 spectrum    1 weight  0.10000E+01 volume  0.45455E-03 ppm1      9.412 ppm2      7.915 CV     1
 ASSI {  675}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HA1 ))
      3.400     1.400     1.400 peak   675 spectrum    1 weight  0.10000E+01 volume  0.24367E-02 ppm1      9.406 ppm2      4.533 CV     1
 ASSI {  677}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HA2 ))
      2.700     0.900     0.900 peak   677 spectrum    1 weight  0.10000E+01 volume  0.22885E-02 ppm1      9.410 ppm2      3.437 CV     1
 ASSI {  678}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 9    and name HB1 ))
      3.700     1.700     1.700 peak   678 spectrum    1 weight  0.10000E+01 volume  0.70406E-03 ppm1      9.408 ppm2      2.991 CV     1
 ASSI {  685}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      5.000     3.100     1.000 peak   685 spectrum    1 weight  0.10000E+01 volume  0.75389E-03 ppm1      8.994 ppm2      7.682 CV     1
 ASSI {  686}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 112  and name HD% )
      3.600     1.600     1.600 peak   686 spectrum    1 weight  0.10000E+01 volume  0.58352E-03 ppm1      8.997 ppm2      6.746 CV     1
 ASSI {  693}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 57   and name HG2%)
      2.400     0.700     0.700 peak   693 spectrum    1 weight  0.10000E+01 volume  0.87988E-02 ppm1      8.994 ppm2      1.036 CV     1
 OR {  693}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 57   and name HD1%)
 ASSI {  694}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 28   and name HG2%)
      2.800     1.000     1.000 peak   694 spectrum    1 weight  0.10000E+01 volume  0.51099E-02 ppm1      8.991 ppm2      0.620 CV     1
 OR {  694}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 28   and name HG1%)
 ASSI {  695}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 113  and name HN  ))
      2.800     1.000     1.000 peak   695 spectrum    1 weight  0.10000E+01 volume  0.21389E-02 ppm1      8.987 ppm2      8.755 CV     1
 ASSI {  697}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
      4.100     2.100     1.900 peak   697 spectrum    1 weight  0.10000E+01 volume  0.17044E-02 ppm1      8.993 ppm2      7.197 CV     1
 ASSI {  699}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      2.800     1.000     1.000 peak   699 spectrum    1 weight  0.10000E+01 volume  0.17262E-02 ppm1      8.987 ppm2      4.579 CV     1
 ASSI {  701}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      4.600     2.700     1.400 peak   701 spectrum    1 weight  0.10000E+01 volume  0.56779E-03 ppm1      8.986 ppm2      0.121 CV     1
 ASSI {  704}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      3.500     1.500     1.500 peak   704 spectrum    1 weight  0.10000E+01 volume  0.73593E-03 ppm1      8.885 ppm2      4.863 CV     1
 ASSI {  706}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HE1 ))
      4.300     2.300     1.700 peak   706 spectrum    1 weight  0.10000E+01 volume  0.36927E-03 ppm1      8.891 ppm2      2.921 CV     1
 OR {  706}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HE2 ))
 ASSI {  708}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
      3.900     1.900     1.900 peak   708 spectrum    1 weight  0.10000E+01 volume  0.11364E-02 ppm1      8.885 ppm2      1.823 CV     1
 OR {  708}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HG  ))
 ASSI {  711}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HB1 ))
      3.500     1.500     1.500 peak   711 spectrum    1 weight  0.10000E+01 volume  0.29178E-02 ppm1      8.885 ppm2      0.810 CV     1
 OR {  711}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI {  712}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
      2.900     1.100     1.100 peak   712 spectrum    1 weight  0.10000E+01 volume  0.14344E-02 ppm1      8.887 ppm2     -0.432 CV     1
 ASSI {  716}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 116  and name HD2%)
      3.900     1.900     1.900 peak   716 spectrum    1 weight  0.10000E+01 volume  0.92310E-03 ppm1      8.887 ppm2      0.495 CV     1
 OR {  716}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI {  719}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.800     1.000     1.000 peak   719 spectrum    1 weight  0.10000E+01 volume  0.18208E-02 ppm1      8.763 ppm2      4.817 CV     1
 ASSI {  720}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.500     1.500     1.500 peak   720 spectrum    1 weight  0.10000E+01 volume  0.82799E-03 ppm1      8.763 ppm2      4.631 CV     1
 ASSI {  723}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.100     1.200     1.200 peak   723 spectrum    1 weight  0.10000E+01 volume  0.34441E-02 ppm1      8.767 ppm2      2.410 CV     1
 ASSI {  724}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      2.700     0.900     0.900 peak   724 spectrum    1 weight  0.10000E+01 volume  0.30710E-02 ppm1      8.769 ppm2      2.166 CV     1
 ASSI {  727}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      3.800     1.800     1.800 peak   727 spectrum    1 weight  0.10000E+01 volume  0.91493E-03 ppm1      8.761 ppm2      9.251 CV     1
 ASSI {  733}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA1 ))
      3.100     1.200     1.200 peak   733 spectrum    1 weight  0.10000E+01 volume  0.54054E-02 ppm1      8.627 ppm2      4.255 CV     1
 ASSI {  734}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      2.600     0.900     0.900 peak   734 spectrum    1 weight  0.10000E+01 volume  0.31678E-02 ppm1      8.633 ppm2      4.060 CV     1
 ASSI {  735}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      3.100     1.200     1.200 peak   735 spectrum    1 weight  0.10000E+01 volume  0.14132E-02 ppm1      8.619 ppm2      8.277 CV     1
 ASSI {  737}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      4.800     2.900     1.200 peak   737 spectrum    1 weight  0.10000E+01 volume  0.51916E-03 ppm1      8.625 ppm2      7.593 CV     1
 ASSI {  738}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA2 ))
      2.400     0.700     0.700 peak   738 spectrum    1 weight  0.10000E+01 volume  0.60630E-02 ppm1      8.625 ppm2      3.465 CV     1
 ASSI {  740}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB1 ))
      2.300     0.700     0.700 peak   740 spectrum    1 weight  0.10000E+01 volume  0.11929E-01 ppm1      8.622 ppm2      2.176 CV     1
 OR {  740}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI {  741}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      2.400     0.700     0.700 peak   741 spectrum    1 weight  0.10000E+01 volume  0.32574E-02 ppm1      8.573 ppm2      8.320 CV     1
 ASSI {  743}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      3.600     1.700     1.700 peak   743 spectrum    1 weight  0.10000E+01 volume  0.28692E-02 ppm1      8.572 ppm2      1.182 CV     1
 ASSI {  744}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      4.300     2.300     1.700 peak   744 spectrum    1 weight  0.10000E+01 volume  0.43849E-03 ppm1      8.573 ppm2      7.817 CV     1
 ASSI {  747}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      3.700     1.700     1.700 peak   747 spectrum    1 weight  0.10000E+01 volume  0.96166E-03 ppm1      7.688 ppm2      7.994 CV     1
 ASSI {  748}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      3.300     1.400     1.400 peak   748 spectrum    1 weight  0.10000E+01 volume  0.11487E-02 ppm1      7.694 ppm2      4.566 CV     1
 ASSI {  751}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 65   and name HD2%)
      3.800     1.800     1.800 peak   751 spectrum    1 weight  0.10000E+01 volume  0.61530E-03 ppm1      7.214 ppm2      0.416 CV     1
 ASSI {  752}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
      2.700     0.900     0.900 peak   752 spectrum    1 weight  0.10000E+01 volume  0.54124E-02 ppm1      7.217 ppm2      8.281 CV     1
 ASSI {  753}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      4.300     2.300     1.700 peak   753 spectrum    1 weight  0.10000E+01 volume  0.10352E-02 ppm1      7.212 ppm2      7.709 CV     1
 ASSI {  757}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      2.800     1.000     1.000 peak   757 spectrum    1 weight  0.10000E+01 volume  0.28063E-02 ppm1      7.214 ppm2      4.113 CV     1
 ASSI {  758}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HB  ))
      2.600     0.800     0.800 peak   758 spectrum    1 weight  0.10000E+01 volume  0.50066E-02 ppm1      7.216 ppm2      3.722 CV     1
 ASSI {  759}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      3.800     1.800     1.800 peak   759 spectrum    1 weight  0.10000E+01 volume  0.18380E-02 ppm1      7.212 ppm2      2.822 CV     1
 ASSI {  761}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 109  and name HG2 ))
      3.700     1.700     1.700 peak   761 spectrum    1 weight  0.10000E+01 volume  0.80260E-03 ppm1      7.212 ppm2      2.076 CV     1
 ASSI {  762}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 16   and name HB2 ))
      4.000     2.000     2.000 peak   762 spectrum    1 weight  0.10000E+01 volume  0.76177E-03 ppm1      7.214 ppm2      1.722 CV     1
 ASSI {  771}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HD1 ))
      3.700     1.700     1.700 peak   771 spectrum    1 weight  0.10000E+01 volume  0.10433E-02 ppm1      8.582 ppm2      3.327 CV     1
 ASSI {  773}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      2.200     0.600     0.600 peak   773 spectrum    1 weight  0.10000E+01 volume  0.56527E-02 ppm1      8.572 ppm2      5.081 CV     1
 ASSI {  774}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
      2.900     1.100     1.100 peak   774 spectrum    1 weight  0.10000E+01 volume  0.18045E-02 ppm1      8.571 ppm2      4.450 CV     1
 ASSI {  775}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HD2 ))
      2.800     1.000     1.000 peak   775 spectrum    1 weight  0.10000E+01 volume  0.13043E-02 ppm1      8.577 ppm2      3.129 CV     1
 ASSI {  777}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HB2 ))
      2.300     0.700     0.700 peak   777 spectrum    1 weight  0.10000E+01 volume  0.69353E-02 ppm1      8.570 ppm2      1.736 CV     1
 OR {  777}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI {  781}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB1 ))
      2.800     1.000     1.000 peak   781 spectrum    1 weight  0.10000E+01 volume  0.36427E-02 ppm1      8.346 ppm2      2.732 CV     1
 OR {  781}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
 ASSI {  784}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HG1 ))
      2.600     0.800     0.800 peak   784 spectrum    1 weight  0.10000E+01 volume  0.34284E-02 ppm1      8.347 ppm2      1.387 CV     1
 OR {  784}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI {  785}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 124  and name HN  ))
      2.900     2.900     3.100 peak   785 spectrum    1 weight  0.10000E+01 volume  0.76227E-02 ppm1      8.289 ppm2      8.103 CV     1
 ASSI {  788}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HA  ))
      2.500     0.800     0.800 peak   788 spectrum    1 weight  0.10000E+01 volume  0.54983E-02 ppm1      8.288 ppm2      3.907 CV     1
 ASSI {  789}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HB1 ))
      2.400     2.400     3.600 peak   789 spectrum    1 weight  0.10000E+01 volume  0.11649E-01 ppm1      8.288 ppm2      1.776 CV     1
 OR {  789}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HB2 ))
 ASSI {  790}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 126  and name HG2 ))
      3.300     3.300     2.700 peak   790 spectrum    1 weight  0.10000E+01 volume  0.52539E-02 ppm1      8.289 ppm2      1.434 CV     1
 OR {  790}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 126  and name HG1 ))
 ASSI {  793}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      4.400     2.400     1.600 peak   793 spectrum    1 weight  0.10000E+01 volume  0.79001E-03 ppm1      7.687 ppm2      8.454 CV     1
 ASSI {  794}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      2.300     0.700     0.700 peak   794 spectrum    1 weight  0.10000E+01 volume  0.56899E-02 ppm1      7.694 ppm2      5.314 CV     1
 ASSI {  796}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
      4.100     2.100     1.900 peak   796 spectrum    1 weight  0.10000E+01 volume  0.69622E-03 ppm1      7.690 ppm2      3.610 CV     1
 ASSI {  797}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
      2.500     0.800     0.800 peak   797 spectrum    1 weight  0.10000E+01 volume  0.69250E-02 ppm1      7.686 ppm2      2.869 CV     1
 ASSI {  798}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 44   and name HB% )
      2.700     2.700     3.300 peak   798 spectrum    1 weight  0.10000E+01 volume  0.45377E-02 ppm1      7.692 ppm2      1.528 CV     1
 ASSI {  799}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      3.900     1.900     1.900 peak   799 spectrum    1 weight  0.10000E+01 volume  0.11500E-02 ppm1      7.690 ppm2      1.138 CV     1
 ASSI {  800}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 116  and name HD2%)
      3.600     1.600     1.600 peak   800 spectrum    1 weight  0.10000E+01 volume  0.19594E-02 ppm1      7.690 ppm2      0.490 CV     1
 OR {  800}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI {  802}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      3.800     1.800     1.800 peak   802 spectrum    1 weight  0.10000E+01 volume  0.56552E-03 ppm1      7.686 ppm2      4.982 CV     1
 ASSI {  803}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 54   and name HD% )
      5.000     3.100     1.000 peak   803 spectrum    1 weight  0.10000E+01 volume  0.54488E-03 ppm1      7.684 ppm2      7.258 CV     1
 OR {  803}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 54   and name HE% )
 ASSI {  807}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 84   and name HD% )
      4.900     3.000     1.100 peak   807 spectrum    1 weight  0.10000E+01 volume  0.36841E-03 ppm1      9.247 ppm2      6.919 CV     1
 ASSI {  809}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      4.100     2.100     1.900 peak   809 spectrum    1 weight  0.10000E+01 volume  0.77593E-03 ppm1      9.249 ppm2      7.976 CV     1
 ASSI {  810}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      2.900     1.000     1.000 peak   810 spectrum    1 weight  0.10000E+01 volume  0.14578E-02 ppm1      9.243 ppm2      4.707 CV     1
 ASSI {  811}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      2.700     0.900     0.900 peak   811 spectrum    1 weight  0.10000E+01 volume  0.36365E-02 ppm1      9.243 ppm2      2.051 CV     1
 ASSI {  812}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
      4.000     2.000     2.000 peak   812 spectrum    1 weight  0.10000E+01 volume  0.16932E-02 ppm1      9.243 ppm2      1.663 CV     1
 ASSI {  815}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 85   and name HD% )
      3.600     1.600     1.600 peak   815 spectrum    1 weight  0.10000E+01 volume  0.11718E-02 ppm1      9.245 ppm2      6.007 CV     1
 ASSI {  816}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 85   and name HE% )
      4.600     2.600     1.400 peak   816 spectrum    1 weight  0.10000E+01 volume  0.71244E-03 ppm1      9.242 ppm2      5.638 CV     1
 OR {  816}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI {  818}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      3.700     1.700     1.700 peak   818 spectrum    1 weight  0.10000E+01 volume  0.11047E-02 ppm1      9.243 ppm2      2.710 CV     1
 ASSI {  819}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      4.300     2.300     1.700 peak   819 spectrum    1 weight  0.10000E+01 volume  0.99353E-03 ppm1      9.245 ppm2      0.799 CV     1
 ASSI {  824}
   (( segid "    " and resid 132  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      4.400     2.400     1.600 peak   824 spectrum    1 weight  0.10000E+01 volume  0.60841E-03 ppm1      9.020 ppm2      6.617 CV     1
 ASSI {  825}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 119  and name HA1 ))
      2.900     1.000     1.000 peak   825 spectrum    1 weight  0.10000E+01 volume  0.24034E-02 ppm1      9.022 ppm2      4.269 CV     1
 ASSI {  827}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HB2 ))
      3.300     1.400     1.400 peak   827 spectrum    1 weight  0.10000E+01 volume  0.12108E-02 ppm1      9.019 ppm2      3.719 CV     1
 ASSI {  828}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      3.800     1.800     1.800 peak   828 spectrum    1 weight  0.10000E+01 volume  0.17362E-02 ppm1      9.022 ppm2      2.230 CV     1
 ASSI {  829}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
      3.800     1.800     1.800 peak   829 spectrum    1 weight  0.10000E+01 volume  0.13069E-02 ppm1      9.027 ppm2      2.053 CV     1
 ASSI {  831}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 84   and name HE% )
      4.500     2.600     1.500 peak   831 spectrum    1 weight  0.10000E+01 volume  0.41558E-03 ppm1      8.570 ppm2      6.243 CV     1
 ASSI {  832}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      3.000     1.200     1.200 peak   832 spectrum    1 weight  0.10000E+01 volume  0.18004E-02 ppm1      8.570 ppm2      9.265 CV     1
 ASSI {  833}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      4.200     2.200     1.800 peak   833 spectrum    1 weight  0.10000E+01 volume  0.76631E-03 ppm1      8.573 ppm2      8.997 CV     1
 ASSI {  834}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      3.700     1.700     1.700 peak   834 spectrum    1 weight  0.10000E+01 volume  0.10372E-02 ppm1      8.572 ppm2      8.052 CV     1
 ASSI {  835}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 99   and name HD% )
      3.400     1.400     1.400 peak   835 spectrum    1 weight  0.10000E+01 volume  0.14501E-02 ppm1      8.568 ppm2      6.809 CV     1
 ASSI {  839}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      2.700     2.700     3.300 peak   839 spectrum    1 weight  0.10000E+01 volume  0.31502E-02 ppm1      8.570 ppm2      0.297 CV     1
 ASSI {  844}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      4.100     2.100     1.900 peak   844 spectrum    1 weight  0.10000E+01 volume  0.10664E-02 ppm1      8.357 ppm2      8.987 CV     1
 ASSI {  847}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
      2.600     0.800     0.800 peak   847 spectrum    1 weight  0.10000E+01 volume  0.52861E-02 ppm1      8.364 ppm2      1.183 CV     1
 ASSI {  848}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 28   and name HG1%)
      2.800     1.000     1.000 peak   848 spectrum    1 weight  0.10000E+01 volume  0.52680E-02 ppm1      8.365 ppm2      0.660 CV     1
 OR {  848}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 28   and name HG2%)
 ASSI {  851}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 128  and name HN  ))
      4.500     2.500     1.500 peak   851 spectrum    1 weight  0.10000E+01 volume  0.49992E-03 ppm1      8.292 ppm2      7.379 CV     1
 ASSI {  853}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 121  and name HD1 ))
      3.600     1.600     1.600 peak   853 spectrum    1 weight  0.10000E+01 volume  0.94477E-03 ppm1      8.276 ppm2      6.383 CV     1
 ASSI {  855}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      3.900     1.900     1.900 peak   855 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      8.288 ppm2      2.641 CV     1
 ASSI {  856}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
      2.800     1.000     1.000 peak   856 spectrum    1 weight  0.10000E+01 volume  0.42438E-02 ppm1      8.286 ppm2      1.057 CV     1
 OR {  856}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HD1 ))
 ASSI {  858}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.100     1.200     1.200 peak   858 spectrum    1 weight  0.10000E+01 volume  0.36865E-02 ppm1      8.280 ppm2      0.655 CV     1
 OR {  858}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI {  859}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HG2 ))
      4.600     2.600     1.400 peak   859 spectrum    1 weight  0.10000E+01 volume  0.59908E-03 ppm1      8.275 ppm2     -0.144 CV     1
 ASSI {  860}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      4.400     2.400     1.600 peak   860 spectrum    1 weight  0.10000E+01 volume  0.73118E-03 ppm1      8.213 ppm2      9.558 CV     1
 ASSI {  861}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      4.400     2.400     1.600 peak   861 spectrum    1 weight  0.10000E+01 volume  0.59206E-03 ppm1      8.213 ppm2      9.232 CV     1
 ASSI {  863}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 84   and name HD% )
      4.500     2.500     1.500 peak   863 spectrum    1 weight  0.10000E+01 volume  0.48510E-03 ppm1      8.205 ppm2      6.934 CV     1
 ASSI {  864}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HB  ))
      2.300     0.700     0.700 peak   864 spectrum    1 weight  0.10000E+01 volume  0.13038E-01 ppm1      8.206 ppm2      4.136 CV     1
 ASSI {  865}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 79   and name HG2%)
      2.700     0.900     0.900 peak   865 spectrum    1 weight  0.10000E+01 volume  0.24314E-02 ppm1      8.206 ppm2      1.255 CV     1
 ASSI {  866}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      2.600     2.600     3.400 peak   866 spectrum    1 weight  0.10000E+01 volume  0.80095E-02 ppm1      8.204 ppm2      0.811 CV     1
 ASSI {  868}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      4.900     3.000     1.100 peak   868 spectrum    1 weight  0.10000E+01 volume  0.49848E-03 ppm1      7.565 ppm2      9.437 CV     1
 ASSI {  869}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      2.500     0.800     0.800 peak   869 spectrum    1 weight  0.10000E+01 volume  0.33295E-02 ppm1      7.561 ppm2      8.412 CV     1
 ASSI {  872}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      4.500     2.600     1.500 peak   872 spectrum    1 weight  0.10000E+01 volume  0.53187E-03 ppm1      7.569 ppm2      5.102 CV     1
 ASSI {  873}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      2.800     1.000     1.000 peak   873 spectrum    1 weight  0.10000E+01 volume  0.13557E-02 ppm1      7.565 ppm2      4.729 CV     1
 ASSI {  874}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HA1 ))
      3.800     1.800     1.800 peak   874 spectrum    1 weight  0.10000E+01 volume  0.12247E-02 ppm1      7.561 ppm2      4.048 CV     1
 ASSI {  875}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HA2 ))
      3.200     1.300     1.300 peak   875 spectrum    1 weight  0.10000E+01 volume  0.16077E-02 ppm1      7.563 ppm2      3.796 CV     1
 ASSI {  876}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      4.400     2.500     1.600 peak   876 spectrum    1 weight  0.10000E+01 volume  0.69349E-03 ppm1      7.563 ppm2      2.789 CV     1
 ASSI {  877}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      4.800     2.900     1.200 peak   877 spectrum    1 weight  0.10000E+01 volume  0.43721E-03 ppm1      7.569 ppm2      2.629 CV     1
 ASSI {  879}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.300     0.700     0.700 peak   879 spectrum    1 weight  0.10000E+01 volume  0.56663E-02 ppm1      7.563 ppm2      1.992 CV     1
 ASSI {  880}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HD2 ))
      2.700     2.700     3.300 peak   880 spectrum    1 weight  0.10000E+01 volume  0.64164E-02 ppm1      7.563 ppm2      1.433 CV     1
 OR {  880}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HD1 ))
 ASSI {  885}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 116  and name HD2%)
      3.700     1.700     1.700 peak   885 spectrum    1 weight  0.10000E+01 volume  0.25800E-02 ppm1      9.056 ppm2      0.502 CV     1
 OR {  885}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI {  886}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      3.500     1.500     1.500 peak   886 spectrum    1 weight  0.10000E+01 volume  0.14961E-02 ppm1      9.050 ppm2      5.318 CV     1
 ASSI {  889}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
      4.000     2.000     2.000 peak   889 spectrum    1 weight  0.10000E+01 volume  0.37954E-03 ppm1      9.050 ppm2     -0.387 CV     1
 ASSI {  892}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HB1 ))
      3.400     1.500     1.500 peak   892 spectrum    1 weight  0.10000E+01 volume  0.16891E-02 ppm1      8.719 ppm2      1.876 CV     1
 ASSI {  894}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      2.600     2.600     3.400 peak   894 spectrum    1 weight  0.10000E+01 volume  0.49736E-02 ppm1      8.721 ppm2      0.645 CV     1
 ASSI {  896}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
      3.400     1.400     1.400 peak   896 spectrum    1 weight  0.10000E+01 volume  0.96488E-03 ppm1      8.721 ppm2      4.898 CV     1
 ASSI {  900}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 2    and name HA  ))
      2.300     0.700     0.700 peak   900 spectrum    1 weight  0.10000E+01 volume  0.96438E-02 ppm1      8.302 ppm2      4.242 CV     1
 ASSI {  902}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 2    and name HB1 ))
      3.000     1.200     1.200 peak   902 spectrum    1 weight  0.10000E+01 volume  0.40510E-02 ppm1      8.303 ppm2      1.959 CV     1
 ASSI {  906}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
      4.500     2.500     1.500 peak   906 spectrum    1 weight  0.10000E+01 volume  0.49608E-03 ppm1      8.206 ppm2      7.382 CV     1
 ASSI {  907}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      4.100     2.100     1.900 peak   907 spectrum    1 weight  0.10000E+01 volume  0.48572E-03 ppm1      8.206 ppm2      6.628 CV     1
 ASSI {  909}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      4.300     2.300     1.700 peak   909 spectrum    1 weight  0.10000E+01 volume  0.65807E-03 ppm1      8.208 ppm2      3.033 CV     1
 ASSI {  911}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      3.000     1.200     1.200 peak   911 spectrum    1 weight  0.10000E+01 volume  0.19330E-02 ppm1      8.205 ppm2      2.448 CV     1
 OR {  911}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
 ASSI {  913}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      3.800     1.800     1.800 peak   913 spectrum    1 weight  0.10000E+01 volume  0.16244E-02 ppm1      8.201 ppm2      1.635 CV     1
 OR {  913}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI {  914}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      3.300     1.400     1.400 peak   914 spectrum    1 weight  0.10000E+01 volume  0.92570E-03 ppm1      7.907 ppm2      4.675 CV     1
 ASSI {  915}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      2.000     0.500     0.500 peak   915 spectrum    1 weight  0.10000E+01 volume  0.10451E-01 ppm1      7.914 ppm2      8.519 CV     1
 ASSI {  918}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      2.800     1.000     1.000 peak   918 spectrum    1 weight  0.10000E+01 volume  0.29268E-02 ppm1      7.908 ppm2      3.514 CV     1
 ASSI {  919}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HD2 ))
      2.700     2.700     3.300 peak   919 spectrum    1 weight  0.10000E+01 volume  0.10839E-02 ppm1      7.907 ppm2      3.166 CV     1
 OR {  919}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HD1 ))
 ASSI {  920}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
      3.500     1.600     1.600 peak   920 spectrum    1 weight  0.10000E+01 volume  0.23698E-02 ppm1      7.908 ppm2      2.944 CV     1
 ASSI {  921}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      2.600     0.900     0.900 peak   921 spectrum    1 weight  0.10000E+01 volume  0.25762E-02 ppm1      7.908 ppm2      2.663 CV     1
 ASSI {  922}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HG1 ))
      2.600     0.900     0.900 peak   922 spectrum    1 weight  0.10000E+01 volume  0.57559E-02 ppm1      7.908 ppm2      1.591 CV     1
 OR {  922}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
 OR {  922}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
 ASSI {  927}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      3.200     1.300     1.300 peak   927 spectrum    1 weight  0.10000E+01 volume  0.27950E-02 ppm1      7.431 ppm2      9.551 CV     1
 ASSI {  930}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
      2.200     0.600     0.600 peak   930 spectrum    1 weight  0.10000E+01 volume  0.41026E-02 ppm1      7.433 ppm2      5.654 CV     1
 ASSI {  932}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HA1 ))
      2.900     1.100     1.100 peak   932 spectrum    1 weight  0.10000E+01 volume  0.21671E-02 ppm1      7.431 ppm2      3.134 CV     1
 ASSI {  933}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      2.800     1.000     1.000 peak   933 spectrum    1 weight  0.10000E+01 volume  0.11687E-02 ppm1      7.427 ppm2      2.649 CV     1
 ASSI {  935}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 83   and name HG1%)
      2.900     1.000     1.000 peak   935 spectrum    1 weight  0.10000E+01 volume  0.22681E-02 ppm1      7.431 ppm2      1.092 CV     1
 ASSI {  936}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 83   and name HG2%)
      2.400     2.400     3.600 peak   936 spectrum    1 weight  0.10000E+01 volume  0.74889E-02 ppm1      7.429 ppm2      0.877 CV     1
 ASSI {  937}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      5.000     3.100     1.000 peak   937 spectrum    1 weight  0.10000E+01 volume  0.65283E-03 ppm1      7.425 ppm2      5.269 CV     1
 ASSI {  938}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 41   and name HB% )
      4.000     2.000     2.000 peak   938 spectrum    1 weight  0.10000E+01 volume  0.59508E-03 ppm1      7.429 ppm2      1.483 CV     1
 ASSI {  946}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      4.100     2.100     1.900 peak   946 spectrum    1 weight  0.10000E+01 volume  0.14520E-02 ppm1      8.918 ppm2      2.694 CV     1
 ASSI {  947}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HB1 ))
      3.700     1.700     1.700 peak   947 spectrum    1 weight  0.10000E+01 volume  0.12200E-02 ppm1      8.919 ppm2      1.735 CV     1
 ASSI {  953}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      3.500     1.600     1.600 peak   953 spectrum    1 weight  0.10000E+01 volume  0.45806E-03 ppm1      8.913 ppm2      4.596 CV     1
 ASSI {  954}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      2.700     0.900     0.900 peak   954 spectrum    1 weight  0.10000E+01 volume  0.35428E-02 ppm1      8.611 ppm2      8.294 CV     1
 ASSI {  958}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      2.800     1.000     1.000 peak   958 spectrum    1 weight  0.10000E+01 volume  0.39413E-02 ppm1      8.615 ppm2      2.771 CV     1
 ASSI {  959}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
      3.800     1.800     1.800 peak   959 spectrum    1 weight  0.10000E+01 volume  0.71525E-03 ppm1      8.614 ppm2      1.584 CV     1
 OR {  959}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  960}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 37   and name HB% )
      2.500     2.500     3.500 peak   960 spectrum    1 weight  0.10000E+01 volume  0.84776E-02 ppm1      8.611 ppm2      1.306 CV     1
 ASSI {  964}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      3.600     1.600     1.600 peak   964 spectrum    1 weight  0.10000E+01 volume  0.10608E-02 ppm1      8.539 ppm2      8.131 CV     1
 ASSI {  967}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 112  and name HE% )
      4.100     2.100     1.900 peak   967 spectrum    1 weight  0.10000E+01 volume  0.64746E-03 ppm1      8.539 ppm2      6.341 CV     1
 ASSI {  968}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HA1 ))
      2.400     0.700     0.700 peak   968 spectrum    1 weight  0.10000E+01 volume  0.60614E-02 ppm1      8.541 ppm2      4.284 CV     1
 ASSI {  970}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HB1 ))
      2.600     0.800     0.800 peak   970 spectrum    1 weight  0.10000E+01 volume  0.57526E-02 ppm1      8.537 ppm2      2.713 CV     1
 ASSI {  971}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HB2 ))
      3.000     1.100     1.100 peak   971 spectrum    1 weight  0.10000E+01 volume  0.35511E-02 ppm1      8.537 ppm2      2.530 CV     1
 ASSI {  974}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 54   and name HD% )
      2.600     0.900     0.900 peak   974 spectrum    1 weight  0.10000E+01 volume  0.31481E-02 ppm1      8.382 ppm2      7.300 CV     1
 ASSI {  975}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      4.000     2.000     2.000 peak   975 spectrum    1 weight  0.10000E+01 volume  0.91831E-03 ppm1      8.374 ppm2      8.064 CV     1
 ASSI {  976}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      3.800     1.800     1.800 peak   976 spectrum    1 weight  0.10000E+01 volume  0.97664E-03 ppm1      8.374 ppm2      7.576 CV     1
 ASSI {  977}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      3.100     1.200     1.200 peak   977 spectrum    1 weight  0.10000E+01 volume  0.12441E-02 ppm1      8.370 ppm2      5.308 CV     1
 ASSI {  978}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      2.300     0.700     0.700 peak   978 spectrum    1 weight  0.10000E+01 volume  0.46207E-02 ppm1      8.374 ppm2      4.752 CV     1
 ASSI {  979}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HB1 ))
      3.000     1.100     1.100 peak   979 spectrum    1 weight  0.10000E+01 volume  0.28292E-02 ppm1      8.375 ppm2      3.031 CV     1
 ASSI {  980}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      3.000     1.100     1.100 peak   980 spectrum    1 weight  0.10000E+01 volume  0.23576E-02 ppm1      8.374 ppm2      2.764 CV     1
 ASSI {  982}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      3.600     1.700     1.700 peak   982 spectrum    1 weight  0.10000E+01 volume  0.16910E-02 ppm1      8.372 ppm2      1.985 CV     1
 ASSI {  983}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 44   and name HB% )
      3.700     1.700     1.700 peak   983 spectrum    1 weight  0.10000E+01 volume  0.20798E-02 ppm1      8.372 ppm2      1.492 CV     1
 ASSI {  987}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
      5.400     3.700     0.600 peak   987 spectrum    1 weight  0.10000E+01 volume  0.45195E-03 ppm1      9.170 ppm2      2.347 CV     1
 ASSI {  990}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 84   and name HD% )
      4.500     2.500     1.500 peak   990 spectrum    1 weight  0.10000E+01 volume  0.92033E-03 ppm1      9.167 ppm2      6.937 CV     1
 ASSI {  991}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      2.300     0.600     0.600 peak   991 spectrum    1 weight  0.10000E+01 volume  0.54335E-02 ppm1      9.170 ppm2      5.658 CV     1
 ASSI {  992}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      3.600     1.600     1.600 peak   992 spectrum    1 weight  0.10000E+01 volume  0.87051E-03 ppm1      9.168 ppm2      3.066 CV     1
 ASSI {  994}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HG  ))
      2.700     0.900     0.900 peak   994 spectrum    1 weight  0.10000E+01 volume  0.26533E-02 ppm1      9.168 ppm2      1.857 CV     1
 OR {  994}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
 ASSI {  995}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 41   and name HB% )
      2.600     2.600     3.400 peak   995 spectrum    1 weight  0.10000E+01 volume  0.35992E-02 ppm1      9.167 ppm2      1.501 CV     1
 ASSI {  996}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 42   and name HD2%)
      3.600     1.600     1.600 peak   996 spectrum    1 weight  0.10000E+01 volume  0.19495E-02 ppm1      9.168 ppm2      0.921 CV     1
 OR {  996}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 42   and name HD1%)
 ASSI {  997}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 77   and name HH2 ))
      4.400     2.500     1.600 peak   997 spectrum    1 weight  0.10000E+01 volume  0.72235E-03 ppm1      9.165 ppm2      6.627 CV     1
 ASSI { 1001}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      3.000     1.100     1.100 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.25552E-02 ppm1      8.085 ppm2      8.792 CV     1
 ASSI { 1002}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.400     1.400     1.400 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.12547E-02 ppm1      8.089 ppm2      4.809 CV     1
 ASSI { 1005}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HA  ))
      2.700     0.900     0.900 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.60065E-02 ppm1      8.083 ppm2      3.896 CV     1
 ASSI { 1006}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      3.500     1.600     1.600 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.15069E-02 ppm1      8.085 ppm2      3.347 CV     1
 ASSI { 1007}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HB2 ))
      2.000     0.500     0.500 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.60424E-02 ppm1      8.083 ppm2      1.800 CV     1
 OR { 1007}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI { 1013}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.900     1.900     1.900 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.10067E-02 ppm1      8.047 ppm2      9.449 CV     1
 ASSI { 1016}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      4.200     2.200     1.800 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.44275E-03 ppm1      8.049 ppm2      9.011 CV     1
 ASSI { 1020}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HG11))
      2.200     0.600     0.600 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.26779E-02 ppm1      8.044 ppm2      0.324 CV     1
 ASSI { 1021}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HG12))
      2.700     0.900     0.900 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.30341E-02 ppm1      8.046 ppm2      0.102 CV     1
 ASSI { 1023}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 69   and name HD1%)
      4.400     2.400     1.600 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.13012E-02 ppm1      8.044 ppm2     -0.588 CV     1
 ASSI { 1027}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 128  and name HN  ))
      2.500     0.800     0.800 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.48902E-02 ppm1      7.953 ppm2      7.382 CV     1
 ASSI { 1031}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HB2 ))
      2.400     2.400     3.600 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.10607E-01 ppm1      7.961 ppm2      1.907 CV     1
 OR { 1031}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HB1 ))
 ASSI { 1034}
   (( segid "    " and resid 16   and name HE  ))
   (  segid "    " and resid 112  and name HD% )
      2.300     0.700     0.700 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.54021E-02 ppm1      7.293 ppm2      6.752 CV     1
 ASSI { 1037}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 109  and name HA  ))
      5.100     3.200     0.900 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.47094E-03 ppm1      7.295 ppm2      4.195 CV     1
 ASSI { 1041}
   (( segid "    " and resid 16   and name HE  ))
   (  segid "    " and resid 140  and name HD2%)
      2.900     1.000     1.000 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.18598E-02 ppm1      7.294 ppm2      0.711 CV     1
 OR { 1041}
   (( segid "    " and resid 16   and name HE  ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 1044}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      2.900     1.000     1.000 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.19330E-02 ppm1      9.429 ppm2      8.990 CV     1
 ASSI { 1046}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      2.700     0.900     0.900 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.43424E-02 ppm1      9.428 ppm2      2.551 CV     1
 OR { 1046}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI { 1047}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      2.500     0.800     0.800 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.49629E-02 ppm1      9.436 ppm2      2.123 CV     1
 ASSI { 1052}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 99   and name HD% )
      4.300     2.300     1.700 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.48312E-03 ppm1      9.426 ppm2      6.815 CV     1
 ASSI { 1054}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.400     0.700     0.700 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.55041E-02 ppm1      9.429 ppm2      5.267 CV     1
 ASSI { 1060}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      2.800     1.000     1.000 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.26133E-02 ppm1      8.498 ppm2      4.480 CV     1
 ASSI { 1061}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HG1 ))
      3.000     1.100     1.100 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.36072E-02 ppm1      8.498 ppm2      1.639 CV     1
 OR { 1061}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
 ASSI { 1064}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.600     0.800     0.800 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.25038E-02 ppm1      8.497 ppm2      4.327 CV     1
 ASSI { 1066}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      3.500     1.500     1.500 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.97284E-03 ppm1      8.497 ppm2      3.512 CV     1
 OR { 1066}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 58   and name HB2 ))
 ASSI { 1068}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      4.700     2.800     1.300 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.82510E-03 ppm1      8.490 ppm2      2.695 CV     1
 ASSI { 1086}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HA1 ))
      3.200     1.300     1.300 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.90964E-03 ppm1      9.405 ppm2      4.525 CV     1
 ASSI { 1087}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HA2 ))
      3.300     1.400     1.400 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.16436E-02 ppm1      9.401 ppm2      3.448 CV     1
 ASSI { 1088}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 7    and name HB  ))
      3.100     1.200     1.200 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.18357E-02 ppm1      9.399 ppm2      1.888 CV     1
 ASSI { 1089}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      4.200     2.200     1.800 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.10365E-02 ppm1      8.342 ppm2      6.936 CV     1
 ASSI { 1090}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      2.400     0.700     0.700 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.44526E-02 ppm1      8.342 ppm2      7.828 CV     1
 ASSI { 1091}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.200     1.300     1.300 peak  1091 spectrum    1 weight  0.10000E+01 volume  0.18886E-02 ppm1      8.338 ppm2      4.736 CV     1
 ASSI { 1092}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HB  ))
      3.300     1.300     1.300 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.27487E-02 ppm1      8.336 ppm2      4.233 CV     1
 ASSI { 1093}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.300     1.300     1.300 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.15692E-02 ppm1      8.338 ppm2      4.075 CV     1
 ASSI { 1094}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
      4.500     2.600     1.500 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.43854E-03 ppm1      8.336 ppm2      3.582 CV     1
 ASSI { 1095}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
      2.900     1.100     1.100 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.10449E-01 ppm1      8.338 ppm2      2.883 CV     1
 ASSI { 1096}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.700     1.700     1.700 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.11473E-02 ppm1      8.336 ppm2      1.374 CV     1
 ASSI { 1097}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HD22))
      4.700     2.700     1.300 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.78720E-03 ppm1      8.279 ppm2      6.930 CV     1
 ASSI { 1102}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      2.400     0.700     0.700 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.59858E-02 ppm1      8.278 ppm2      7.718 CV     1
 ASSI { 1104}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
      3.900     1.900     1.900 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.82964E-03 ppm1      8.276 ppm2      3.321 CV     1
 ASSI { 1107}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      2.900     1.000     1.000 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.15647E-02 ppm1      8.275 ppm2      4.864 CV     1
 ASSI { 1109}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 100  and name HG1%)
      3.100     1.200     1.200 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.14685E-02 ppm1      8.271 ppm2      0.868 CV     1
 OR { 1109}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 1114}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 103  and name HB1 ))
      3.100     1.200     1.200 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.25030E-02 ppm1      8.258 ppm2      2.196 CV     1
 OR { 1114}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI { 1116}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 102  and name HA2 ))
      4.600     2.600     1.400 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.47387E-03 ppm1      8.246 ppm2      3.462 CV     1
 ASSI { 1119}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      2.400     0.700     0.700 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.66340E-02 ppm1      7.379 ppm2      8.622 CV     1
 ASSI { 1120}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      2.800     1.000     1.000 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.20875E-02 ppm1      7.379 ppm2      8.279 CV     1
 ASSI { 1123}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      4.200     2.200     1.800 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.11317E-02 ppm1      7.374 ppm2      4.300 CV     1
 ASSI { 1127}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 86   and name HE2 ))
      4.700     2.800     1.300 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.44357E-03 ppm1      7.372 ppm2      2.234 CV     1
 ASSI { 1128}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      3.000     1.200     1.200 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.17781E-02 ppm1      7.374 ppm2      1.880 CV     1
 ASSI { 1129}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      2.700     0.900     0.900 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.26916E-02 ppm1      7.372 ppm2      1.591 CV     1
 ASSI { 1132}
   (( segid "    " and resid 6    and name HE  ))
   (( segid "    " and resid 6    and name HN  ))
      4.300     2.300     1.700 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.42520E-03 ppm1      7.294 ppm2      8.941 CV     1
 ASSI { 1133}
   (( segid "    " and resid 6    and name HE  ))
   (( segid "    " and resid 6    and name HD2 ))
      2.300     0.600     0.600 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.11936E-01 ppm1      7.287 ppm2      3.197 CV     1
 OR { 1133}
   (( segid "    " and resid 6    and name HE  ))
   (( segid "    " and resid 6    and name HD1 ))
 ASSI { 1142}
   (  segid "    " and resid 43   and name HZ% )
   (( segid "    " and resid 121  and name HB2 ))
      3.700     1.700     1.700 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.77572E-03 ppm1      6.822 ppm2      2.571 CV     1
 ASSI { 1145}
   (  segid "    " and resid 43   and name HZ% )
   (  segid "    " and resid 41   and name HB% )
      2.400     2.400     3.600 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.43523E-02 ppm1      6.824 ppm2      1.461 CV     1
 ASSI { 1146}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HB  ))
      4.200     2.200     1.800 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.77758E-03 ppm1      9.395 ppm2      3.895 CV     1
 ASSI { 1148}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      3.500     1.500     1.500 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.12415E-02 ppm1      7.807 ppm2      8.607 CV     1
 ASSI { 1149}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      2.500     0.800     0.800 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.33555E-02 ppm1      7.805 ppm2      8.287 CV     1
 ASSI { 1153}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HA2 ))
      2.900     1.100     1.100 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.29007E-02 ppm1      7.803 ppm2      3.769 CV     1
 OR { 1153}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HA1 ))
 ASSI { 1154}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
      2.500     0.800     0.800 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.63421E-02 ppm1      7.805 ppm2      2.369 CV     1
 OR { 1154}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 1157}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      3.800     1.800     1.800 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.21917E-02 ppm1      7.803 ppm2      1.162 CV     1
 ASSI { 1160}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 89   and name HN  ))
      4.100     2.100     1.900 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.95811E-03 ppm1      7.288 ppm2      8.184 CV     1
 ASSI { 1163}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      3.600     1.600     1.600 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.10466E-02 ppm1      7.282 ppm2      3.973 CV     1
 ASSI { 1166}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      4.200     2.200     1.800 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.15918E-02 ppm1      7.287 ppm2      1.313 CV     1
 OR { 1166}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 86   and name HD1 ))
 ASSI { 1168}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 86   and name HG2 ))
      4.100     2.100     1.900 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.12032E-02 ppm1      7.286 ppm2     -0.579 CV     1
 ASSI { 1169}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      3.500     1.500     1.500 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.48118E-03 ppm1      7.280 ppm2     -0.822 CV     1
 ASSI { 1171}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      4.500     2.600     1.500 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.80148E-03 ppm1      6.904 ppm2      4.710 CV     1
 ASSI { 1174}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
      4.200     2.300     1.800 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.84128E-03 ppm1      6.904 ppm2      3.600 CV     1
 ASSI { 1175}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
      3.700     1.700     1.700 peak  1175 spectrum    1 weight  0.10000E+01 volume  0.11525E-02 ppm1      6.904 ppm2      2.300 CV     1
 OR { 1175}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
 OR { 1175}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI { 1178}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
      3.000     3.000     3.000 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.25501E-02 ppm1      6.902 ppm2      7.209 CV     1
 ASSI { 1179}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      3.700     1.700     1.700 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      6.904 ppm2      6.575 CV     1
 ASSI { 1180}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      2.800     1.000     1.000 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.21692E-02 ppm1      6.902 ppm2      5.120 CV     1
 ASSI { 1181}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
      2.500     0.800     0.800 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.38453E-02 ppm1      6.902 ppm2      2.682 CV     1
 ASSI { 1182}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 44   and name HB% )
      4.000     2.000     2.000 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.10042E-02 ppm1      6.905 ppm2      1.533 CV     1
 ASSI { 1184}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
      4.500     2.600     1.500 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.57856E-03 ppm1      8.482 ppm2      9.432 CV     1
 ASSI { 1185}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HA  ))
      2.800     1.000     1.000 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.34471E-02 ppm1      8.481 ppm2      5.012 CV     1
 ASSI { 1186}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HB  ))
      3.000     1.100     1.100 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.24409E-02 ppm1      8.483 ppm2      4.706 CV     1
 ASSI { 1187}
   (( segid "    " and resid 135  and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
      3.100     1.200     1.200 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.41311E-02 ppm1      8.492 ppm2      1.269 CV     1
 ASSI { 1194}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 136  and name HA2 ))
      4.100     2.100     1.900 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.37793E-03 ppm1      7.879 ppm2      3.490 CV     1
 ASSI { 1196}
   (( segid "    " and resid 135  and name HN  ))
   (  segid "    " and resid 135  and name HG2%)
      3.400     1.400     1.400 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.26734E-02 ppm1      8.480 ppm2      1.107 CV     1
 ASSI { 1198}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      2.500     0.800     0.800 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.53881E-02 ppm1      8.431 ppm2      4.558 CV     1
 ASSI { 1200}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.500     0.800     0.800 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.50785E-02 ppm1      8.431 ppm2      4.046 CV     1
 ASSI { 1202}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      2.500     2.500     3.500 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.61497E-02 ppm1      8.435 ppm2      1.367 CV     1
 ASSI { 1203}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 132  and name HB1 ))
      3.700     1.700     1.700 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.14590E-02 ppm1      8.375 ppm2      3.967 CV     1
 ASSI { 1204}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
      3.800     1.800     1.800 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.90370E-03 ppm1      8.373 ppm2      2.004 CV     1
 OR { 1204}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 1206}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 132  and name HN  ))
      3.500     1.600     1.600 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.15230E-02 ppm1      8.376 ppm2      9.034 CV     1
 ASSI { 1207}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HA1 ))
      3.400     1.400     1.400 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.16997E-02 ppm1      8.376 ppm2      5.224 CV     1
 ASSI { 1209}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HA2 ))
      2.700     0.900     0.900 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.29127E-02 ppm1      8.371 ppm2      3.800 CV     1
 ASSI { 1211}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      2.300     0.700     0.700 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.83154E-02 ppm1      8.189 ppm2      4.007 CV     1
 ASSI { 1213}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      3.600     1.600     1.600 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.21957E-02 ppm1      8.177 ppm2      1.853 CV     1
 ASSI { 1217}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      2.800     1.000     1.000 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.26071E-02 ppm1      8.177 ppm2      2.686 CV     1
 ASSI { 1219}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HN  ))
      3.900     1.900     1.900 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.16194E-02 ppm1      7.881 ppm2      8.802 CV     1
 ASSI { 1220}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      4.200     2.200     1.800 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.13636E-02 ppm1      7.890 ppm2      8.405 CV     1
 ASSI { 1223}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HA1 ))
      2.900     1.000     1.000 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.61415E-02 ppm1      7.890 ppm2      4.191 CV     1
 ASSI { 1224}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HA2 ))
      2.500     0.800     0.800 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.51862E-02 ppm1      7.881 ppm2      3.894 CV     1
 ASSI { 1226}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HB2 ))
      2.800     1.000     1.000 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.42735E-02 ppm1      7.890 ppm2      2.537 CV     1
 ASSI { 1248}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 112  and name HD% )
      4.000     2.000     2.000 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.67293E-03 ppm1      8.716 ppm2      6.770 CV     1
 ASSI { 1249}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      4.400     2.400     1.600 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.67760E-03 ppm1      8.723 ppm2      9.493 CV     1
 ASSI { 1252}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      3.100     1.200     1.200 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.12576E-02 ppm1      8.716 ppm2      5.830 CV     1
 ASSI { 1256}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      3.100     1.200     1.200 peak  1256 spectrum    1 weight  0.10000E+01 volume  0.17880E-02 ppm1      8.720 ppm2      2.686 CV     1
 OR { 1256}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI { 1260}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      3.800     1.800     1.800 peak  1260 spectrum    1 weight  0.10000E+01 volume  0.19915E-02 ppm1      8.713 ppm2      1.182 CV     1
 ASSI { 1261}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      4.100     2.100     1.900 peak  1261 spectrum    1 weight  0.10000E+01 volume  0.80929E-03 ppm1      8.470 ppm2      9.217 CV     1
 ASSI { 1262}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      4.000     2.000     2.000 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.74414E-03 ppm1      8.463 ppm2      8.004 CV     1
 ASSI { 1263}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.000     1.100     1.100 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.16584E-02 ppm1      8.464 ppm2      5.180 CV     1
 ASSI { 1264}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HA1 ))
      2.300     0.700     0.700 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.61175E-02 ppm1      8.469 ppm2      3.670 CV     1
 ASSI { 1265}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HA2 ))
      3.100     1.200     1.200 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.65993E-02 ppm1      8.460 ppm2      3.237 CV     1
 ASSI { 1267}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 92   and name HH2 ))
      3.100     1.200     1.200 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.12536E-02 ppm1      8.460 ppm2      6.788 CV     1
 ASSI { 1269}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HA1 ))
      3.200     1.300     1.300 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.14269E-02 ppm1      8.231 ppm2      4.684 CV     1
 ASSI { 1270}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.900     1.100     1.100 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.26642E-02 ppm1      8.225 ppm2      4.284 CV     1
 ASSI { 1274}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      2.400     0.700     0.700 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.59603E-02 ppm1      8.094 ppm2      8.480 CV     1
 ASSI { 1275}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      3.100     1.200     1.200 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.18708E-02 ppm1      8.093 ppm2      4.515 CV     1
 ASSI { 1277}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      3.100     1.200     1.200 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.19350E-02 ppm1      8.093 ppm2      3.512 CV     1
 ASSI { 1278}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HB1 ))
      3.500     1.600     1.600 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.20219E-02 ppm1      8.094 ppm2      3.219 CV     1
 ASSI { 1279}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HB2 ))
      2.600     0.900     0.900 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.37102E-02 ppm1      8.093 ppm2      2.789 CV     1
 ASSI { 1284}
   (( segid "    " and resid 111  and name HD21))
   (( segid "    " and resid 111  and name HN  ))
      3.800     1.800     1.800 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.17897E-02 ppm1      7.742 ppm2      8.555 CV     1
 ASSI { 1285}
   (( segid "    " and resid 111  and name HD21))
   (( segid "    " and resid 112  and name HN  ))
      4.600     2.700     1.400 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.41789E-03 ppm1      7.733 ppm2      9.467 CV     1
 ASSI { 1287}
   (( segid "    " and resid 111  and name HD21))
   (( segid "    " and resid 111  and name HA  ))
      3.900     1.900     1.900 peak  1287 spectrum    1 weight  0.10000E+01 volume  0.56812E-03 ppm1      7.734 ppm2      5.606 CV     1
 ASSI { 1288}
   (( segid "    " and resid 111  and name HD21))
   (( segid "    " and resid 111  and name HB2 ))
      2.800     1.000     1.000 peak  1288 spectrum    1 weight  0.10000E+01 volume  0.31155E-02 ppm1      7.734 ppm2      2.529 CV     1
 ASSI { 1289}
   (( segid "    " and resid 111  and name HD21))
   (( segid "    " and resid 139  and name HD1 ))
      4.600     2.600     1.400 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.53472E-03 ppm1      7.735 ppm2      1.677 CV     1
 ASSI { 1290}
   (( segid "    " and resid 111  and name HD21))
   (  segid "    " and resid 141  and name HG2%)
      3.600     1.600     1.600 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.12343E-02 ppm1      7.734 ppm2      1.196 CV     1
 ASSI { 1291}
   (( segid "    " and resid 111  and name HD21))
   (( segid "    " and resid 111  and name HD22))
      1.500     0.300     0.700 peak  1291 spectrum    1 weight  0.10000E+01 volume  0.54731E-01 ppm1      7.724 ppm2      6.776 CV     1
 ASSI { 1292}
   (( segid "    " and resid 111  and name HD21))
   (( segid "    " and resid 111  and name HB1 ))
      2.600     0.900     0.900 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.48477E-02 ppm1      7.726 ppm2      2.711 CV     1
 ASSI { 1293}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 132  and name HN  ))
      3.900     1.900     1.900 peak  1293 spectrum    1 weight  0.10000E+01 volume  0.16411E-02 ppm1      7.663 ppm2      9.054 CV     1
 ASSI { 1297}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      3.000     1.100     1.100 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.22128E-02 ppm1      7.662 ppm2      6.628 CV     1
 ASSI { 1298}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      3.000     1.200     1.200 peak  1298 spectrum    1 weight  0.10000E+01 volume  0.13701E-02 ppm1      7.654 ppm2      5.749 CV     1
 ASSI { 1300}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HA1 ))
      2.700     0.900     0.900 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.30934E-02 ppm1      7.654 ppm2      4.275 CV     1
 ASSI { 1302}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 132  and name HB2 ))
      4.100     2.100     1.900 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.52861E-03 ppm1      7.654 ppm2      3.690 CV     1
 ASSI { 1303}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      3.900     1.900     1.900 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.48626E-03 ppm1      7.656 ppm2      3.042 CV     1
 ASSI { 1314}
   (( segid "    " and resid 111  and name HD22))
   (( segid "    " and resid 112  and name HN  ))
      4.700     2.700     1.300 peak  1314 spectrum    1 weight  0.10000E+01 volume  0.41690E-03 ppm1      6.791 ppm2      9.400 CV     1
 ASSI { 1315}
   (( segid "    " and resid 111  and name HD22))
   (( segid "    " and resid 111  and name HN  ))
      4.700     2.700     1.300 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.10027E-02 ppm1      6.790 ppm2      8.557 CV     1
 ASSI { 1316}
   (( segid "    " and resid 111  and name HD22))
   (( segid "    " and resid 111  and name HA  ))
      4.600     2.600     1.400 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.44828E-03 ppm1      6.792 ppm2      5.621 CV     1
 ASSI { 1317}
   (( segid "    " and resid 111  and name HD22))
   (( segid "    " and resid 111  and name HB2 ))
      3.800     1.800     1.800 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.23512E-02 ppm1      6.790 ppm2      2.547 CV     1
 ASSI { 1318}
   (( segid "    " and resid 111  and name HD22))
   (  segid "    " and resid 141  and name HG2%)
      3.700     1.700     1.700 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.13843E-02 ppm1      6.793 ppm2      1.194 CV     1
 ASSI { 1320}
   (( segid "    " and resid 111  and name HD22))
   (( segid "    " and resid 111  and name HB1 ))
      3.500     1.600     1.600 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.32396E-02 ppm1      6.786 ppm2      2.710 CV     1
 ASSI { 1321}
   (( segid "    " and resid 111  and name HD22))
   (( segid "    " and resid 139  and name HD1 ))
      3.700     1.700     1.700 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.49526E-03 ppm1      6.783 ppm2      1.672 CV     1
 ASSI { 1323}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
      4.400     2.500     1.600 peak  1323 spectrum    1 weight  0.10000E+01 volume  0.11123E-02 ppm1      9.080 ppm2      8.891 CV     1
 ASSI { 1324}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      3.400     1.400     1.400 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.13031E-02 ppm1      9.069 ppm2      5.268 CV     1
 ASSI { 1325}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      2.800     1.000     1.000 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.19780E-02 ppm1      9.069 ppm2      4.958 CV     1
 ASSI { 1327}
   (( segid "    " and resid 118  and name HN  ))
   (  segid "    " and resid 117  and name HG2%)
      2.900     2.900     3.100 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.30831E-02 ppm1      9.068 ppm2      1.438 CV     1
 ASSI { 1329}
   (( segid "    " and resid 118  and name HN  ))
   (  segid "    " and resid 7    and name HG1%)
      3.000     3.000     3.000 peak  1329 spectrum    1 weight  0.10000E+01 volume  0.40311E-02 ppm1      9.068 ppm2      0.898 CV     1
 ASSI { 1330}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
      4.200     2.200     1.800 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.83703E-03 ppm1      9.069 ppm2      9.385 CV     1
 ASSI { 1331}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HA1 ))
      3.200     1.300     1.300 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.90271E-03 ppm1      9.068 ppm2      4.698 CV     1
 ASSI { 1333}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 7    and name HB  ))
      3.700     1.700     1.700 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.69861E-03 ppm1      9.072 ppm2      1.899 CV     1
 ASSI { 1337}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HA1 ))
      2.800     1.000     1.000 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.28918E-02 ppm1      8.791 ppm2      4.174 CV     1
 ASSI { 1338}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HA2 ))
      3.100     1.200     1.200 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.31895E-02 ppm1      8.795 ppm2      3.888 CV     1
 ASSI { 1339}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HB  ))
      4.100     2.100     1.900 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.88731E-03 ppm1      8.797 ppm2      1.905 CV     1
 ASSI { 1340}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 7    and name HG2%)
      3.400     1.500     1.500 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.46264E-02 ppm1      8.795 ppm2      1.046 CV     1
 ASSI { 1341}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 28   and name HG1%)
      2.900     1.100     1.100 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.32220E-02 ppm1      8.793 ppm2      0.694 CV     1
 ASSI { 1342}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB1 ))
      3.600     1.600     1.600 peak  1342 spectrum    1 weight  0.10000E+01 volume  0.12352E-02 ppm1      8.749 ppm2      3.488 CV     1
 ASSI { 1343}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      4.300     2.300     1.700 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.67017E-03 ppm1      8.752 ppm2      9.452 CV     1
 ASSI { 1348}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      4.100     2.100     1.900 peak  1348 spectrum    1 weight  0.10000E+01 volume  0.14733E-02 ppm1      8.750 ppm2      2.196 CV     1
 ASSI { 1349}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
      2.600     0.800     0.800 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.62856E-02 ppm1      8.750 ppm2      0.488 CV     1
 ASSI { 1352}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 55   and name HD% )
      2.800     2.800     3.200 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.71388E-03 ppm1      8.745 ppm2      6.667 CV     1
 ASSI { 1357}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      4.600     2.600     1.400 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.11288E-02 ppm1      8.443 ppm2      7.942 CV     1
 ASSI { 1359}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HB1 ))
      3.600     1.600     1.600 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.21698E-02 ppm1      8.449 ppm2      3.073 CV     1
 ASSI { 1360}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HB2 ))
      3.200     1.300     1.300 peak  1360 spectrum    1 weight  0.10000E+01 volume  0.22073E-02 ppm1      8.444 ppm2      2.945 CV     1
 ASSI { 1362}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 57   and name HD1%)
      3.800     1.800     1.800 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.25049E-02 ppm1      8.440 ppm2      0.999 CV     1
 ASSI { 1370}
   (( segid "    " and resid 81   and name HD21))
   (( segid "    " and resid 54   and name HB2 ))
      2.700     2.700     3.300 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.54764E-02 ppm1      7.740 ppm2      2.771 CV     1
 ASSI { 1383}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      4.300     2.300     1.700 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.82287E-03 ppm1      9.257 ppm2      4.833 CV     1
 ASSI { 1384}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      2.400     0.700     0.700 peak  1384 spectrum    1 weight  0.10000E+01 volume  0.43713E-02 ppm1      9.259 ppm2      4.465 CV     1
 ASSI { 1387}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.300     1.400     1.400 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.18290E-02 ppm1      9.259 ppm2      1.546 CV     1
 ASSI { 1388}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HG11))
      3.500     1.500     1.500 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.12240E-02 ppm1      9.259 ppm2      1.120 CV     1
 ASSI { 1389}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      3.500     1.500     1.500 peak  1389 spectrum    1 weight  0.10000E+01 volume  0.25880E-02 ppm1      9.261 ppm2      0.285 CV     1
 ASSI { 1391}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      4.800     2.900     1.200 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.45315E-03 ppm1      9.263 ppm2      8.999 CV     1
 ASSI { 1394}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      4.100     2.100     1.900 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.66715E-03 ppm1      9.254 ppm2      5.134 CV     1
 ASSI { 1396}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      4.000     2.000     2.000 peak  1396 spectrum    1 weight  0.10000E+01 volume  0.57402E-03 ppm1      9.267 ppm2      1.862 CV     1
 OR { 1396}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI { 1398}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      4.000     2.000     2.000 peak  1398 spectrum    1 weight  0.10000E+01 volume  0.47722E-03 ppm1      9.254 ppm2     -0.141 CV     1
 ASSI { 1399}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      4.400     2.400     1.600 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.14293E-02 ppm1      8.458 ppm2      2.222 CV     1
 ASSI { 1402}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      3.000     1.100     1.100 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.19947E-02 ppm1      8.460 ppm2      3.850 CV     1
 ASSI { 1406}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      3.900     1.900     1.900 peak  1406 spectrum    1 weight  0.10000E+01 volume  0.94725E-03 ppm1      8.061 ppm2      8.921 CV     1
 ASSI { 1409}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      3.200     1.300     1.300 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.23716E-02 ppm1      8.067 ppm2      7.872 CV     1
 ASSI { 1412}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 55   and name HD% )
      3.000     1.200     1.200 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.18734E-02 ppm1      8.066 ppm2      6.651 CV     1
 ASSI { 1413}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      2.300     0.600     0.600 peak  1413 spectrum    1 weight  0.10000E+01 volume  0.77746E-02 ppm1      8.065 ppm2      5.286 CV     1
 ASSI { 1414}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.400     1.500     1.500 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.11682E-02 ppm1      8.065 ppm2      4.812 CV     1
 ASSI { 1415}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      2.900     1.000     1.000 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.33458E-02 ppm1      8.070 ppm2      4.603 CV     1
 ASSI { 1416}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      3.700     1.700     1.700 peak  1416 spectrum    1 weight  0.10000E+01 volume  0.10115E-02 ppm1      8.066 ppm2      4.316 CV     1
 ASSI { 1417}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
      4.100     2.100     1.900 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.11970E-02 ppm1      8.066 ppm2      3.596 CV     1
 ASSI { 1418}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      3.800     1.800     1.800 peak  1418 spectrum    1 weight  0.10000E+01 volume  0.16964E-02 ppm1      8.067 ppm2      3.363 CV     1
 ASSI { 1419}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HB1 ))
      3.400     1.400     1.400 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.36545E-02 ppm1      8.065 ppm2      3.109 CV     1
 ASSI { 1422}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.100     1.200     1.200 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.11755E-02 ppm1      8.065 ppm2      2.447 CV     1
 ASSI { 1425}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 71   and name HG1 ))
      4.100     2.100     1.900 peak  1425 spectrum    1 weight  0.10000E+01 volume  0.77684E-03 ppm1      8.065 ppm2      1.861 CV     1
 OR { 1425}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI { 1430}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.600     1.600     1.600 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.87530E-03 ppm1      7.831 ppm2      3.832 CV     1
 ASSI { 1432}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 71   and name HG1 ))
      3.800     1.800     1.800 peak  1432 spectrum    1 weight  0.10000E+01 volume  0.79034E-03 ppm1      7.830 ppm2      1.833 CV     1
 OR { 1432}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI { 1434}
   (( segid "    " and resid 81   and name HD21))
   (( segid "    " and resid 81   and name HD22))
      1.300     0.200     0.900 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.75273E-01 ppm1      7.740 ppm2      6.904 CV     1
 ASSI { 1436}
   (( segid "    " and resid 81   and name HD21))
   (( segid "    " and resid 81   and name HA  ))
      3.400     1.500     1.500 peak  1436 spectrum    1 weight  0.10000E+01 volume  0.90853E-03 ppm1      7.748 ppm2      4.080 CV     1
 ASSI { 1438}
   (( segid "    " and resid 81   and name HD21))
   (( segid "    " and resid 81   and name HB2 ))
      3.000     1.100     1.100 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.47701E-02 ppm1      7.742 ppm2      2.607 CV     1
 ASSI { 1439}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 74   and name HD22))
      1.300     0.200     0.900 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.12417E+00 ppm1      7.617 ppm2      6.897 CV     1
 ASSI { 1440}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 74   and name HB1 ))
      3.100     1.200     1.200 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.31343E-02 ppm1      7.612 ppm2      3.127 CV     1
 ASSI { 1441}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 74   and name HB2 ))
      2.300     0.700     0.700 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.51809E-02 ppm1      7.612 ppm2      2.946 CV     1
 ASSI { 1463}
   (( segid "    " and resid 81   and name HD22))
   (( segid "    " and resid 81   and name HB2 ))
      3.300     1.300     1.300 peak  1463 spectrum    1 weight  0.10000E+01 volume  0.40539E-02 ppm1      6.898 ppm2      2.613 CV     1
 ASSI { 1465}
   (( segid "    " and resid 81   and name HD22))
   (( segid "    " and resid 81   and name HA  ))
      3.800     1.800     1.800 peak  1465 spectrum    1 weight  0.10000E+01 volume  0.10672E-02 ppm1      6.888 ppm2      4.077 CV     1
 ASSI { 1478}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
      3.900     1.900     1.900 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.99832E-03 ppm1      7.824 ppm2      7.216 CV     1
 ASSI { 1481}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.700     1.700     1.700 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.13128E-02 ppm1      7.824 ppm2      4.053 CV     1
 ASSI { 1482}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
      3.100     1.200     1.200 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.20257E-02 ppm1      7.824 ppm2      3.593 CV     1
 ASSI { 1485}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 44   and name HB% )
      3.900     1.900     1.900 peak  1485 spectrum    1 weight  0.10000E+01 volume  0.17783E-02 ppm1      7.825 ppm2      1.534 CV     1
 ASSI { 1487}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      1.800     0.400     0.400 peak  1487 spectrum    1 weight  0.10000E+01 volume  0.68536E-02 ppm1      7.818 ppm2      6.921 CV     1
 ASSI { 1492}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 72   and name HN  ))
      3.300     1.400     1.400 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.10615E-02 ppm1      7.626 ppm2      8.768 CV     1
 ASSI { 1494}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 92   and name HZ3 ))
      2.000     2.000     4.000 peak  1494 spectrum    1 weight  0.10000E+01 volume  0.67537E-01 ppm1      7.618 ppm2      6.671 CV     1
 ASSI { 1497}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 72   and name HB2 ))
      2.700     2.700     3.300 peak  1497 spectrum    1 weight  0.10000E+01 volume  0.76772E-02 ppm1      7.618 ppm2      2.209 CV     1
 OR { 1497}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 72   and name HB1 ))
 ASSI { 1508}
   (( segid "    " and resid 106  and name HD21))
   (( segid "    " and resid 106  and name HD22))
      1.300     0.200     0.900 peak  1508 spectrum    1 weight  0.10000E+01 volume  0.14262E+00 ppm1      7.532 ppm2      6.867 CV     1
 ASSI { 1523}
   (( segid "    " and resid 106  and name HD22))
   (  segid "    " and resid 15   and name HG2%)
      3.400     3.400     2.600 peak  1523 spectrum    1 weight  0.10000E+01 volume  0.15256E-02 ppm1      6.885 ppm2      1.176 CV     1
 ASSI { 1528}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
      3.400     1.400     1.400 peak  1528 spectrum    1 weight  0.10000E+01 volume  0.42239E-02 ppm1      6.805 ppm2      2.938 CV     1
 ASSI { 1544}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      3.700     1.700     1.700 peak  1544 spectrum    1 weight  0.10000E+01 volume  0.63784E-03 ppm1      8.843 ppm2      5.350 CV     1
 ASSI { 1545}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HA2 ))
      2.900     1.100     1.100 peak  1545 spectrum    1 weight  0.10000E+01 volume  0.19904E-02 ppm1      8.839 ppm2      4.042 CV     1
 ASSI { 1546}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 5    and name HB  ))
      3.200     1.300     1.300 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.22374E-02 ppm1      8.839 ppm2      2.276 CV     1
 ASSI { 1548}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 5    and name HG2%)
      2.900     2.900     3.100 peak  1548 spectrum    1 weight  0.10000E+01 volume  0.32670E-02 ppm1      8.842 ppm2      1.068 CV     1
 ASSI { 1549}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 42   and name HD2%)
      2.900     2.900     3.100 peak  1549 spectrum    1 weight  0.10000E+01 volume  0.30953E-02 ppm1      8.843 ppm2      0.928 CV     1
 ASSI { 1552}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      4.300     2.300     1.700 peak  1552 spectrum    1 weight  0.10000E+01 volume  0.59966E-03 ppm1      8.613 ppm2      8.362 CV     1
 ASSI { 1554}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      3.000     1.200     1.200 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.16336E-02 ppm1      8.615 ppm2      5.051 CV     1
 ASSI { 1555}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
      2.800     1.000     1.000 peak  1555 spectrum    1 weight  0.10000E+01 volume  0.32015E-02 ppm1      8.615 ppm2      4.887 CV     1
 ASSI { 1556}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
      3.200     1.200     1.200 peak  1556 spectrum    1 weight  0.10000E+01 volume  0.19040E-02 ppm1      8.613 ppm2      2.351 CV     1
 OR { 1556}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 1558}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      2.500     2.500     3.500 peak  1558 spectrum    1 weight  0.10000E+01 volume  0.67116E-02 ppm1      8.613 ppm2      1.189 CV     1
 ASSI { 1559}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      3.900     1.900     1.900 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.81915E-03 ppm1      8.614 ppm2      0.668 CV     1
 ASSI { 1594}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      2.900     1.100     1.100 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.49092E-02 ppm1      6.856 ppm2      4.545 CV     1
 ASSI { 1595}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HA2 ))
      2.500     0.800     0.800 peak  1595 spectrum    1 weight  0.10000E+01 volume  0.27723E-02 ppm1      6.856 ppm2      3.453 CV     1
 ASSI { 1596}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HB1 ))
      2.800     1.000     1.000 peak  1596 spectrum    1 weight  0.10000E+01 volume  0.15077E-02 ppm1      6.849 ppm2      3.184 CV     1
 ASSI { 1597}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      1.300     0.200     0.900 peak  1597 spectrum    1 weight  0.10000E+01 volume  0.14681E+00 ppm1      6.836 ppm2      7.585 CV     1
 ASSI { 1598}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      3.800     1.800     1.800 peak  1598 spectrum    1 weight  0.10000E+01 volume  0.13435E-02 ppm1      6.822 ppm2      3.805 CV     1
 ASSI { 1611}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HA  ))
      2.600     0.900     0.900 peak  1611 spectrum    1 weight  0.10000E+01 volume  0.37441E-02 ppm1      8.821 ppm2      4.691 CV     1
 ASSI { 1613}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB2 ))
      3.400     1.500     1.500 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.26886E-02 ppm1      8.820 ppm2      1.648 CV     1
 OR { 1613}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
 OR { 1613}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HG  ))
 ASSI { 1616}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
      2.500     0.800     0.800 peak  1616 spectrum    1 weight  0.10000E+01 volume  0.42429E-02 ppm1      7.708 ppm2      8.607 CV     1
 ASSI { 1620}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      3.500     1.500     1.500 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.16388E-02 ppm1      7.704 ppm2      4.053 CV     1
 ASSI { 1621}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 17   and name HA1 ))
      4.000     2.000     2.000 peak  1621 spectrum    1 weight  0.10000E+01 volume  0.56482E-03 ppm1      7.704 ppm2      3.778 CV     1
 OR { 1621}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 17   and name HA2 ))
 ASSI { 1622}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      4.600     2.600     1.400 peak  1622 spectrum    1 weight  0.10000E+01 volume  0.75079E-03 ppm1      7.706 ppm2      2.829 CV     1
 ASSI { 1623}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
      2.700     2.700     3.300 peak  1623 spectrum    1 weight  0.10000E+01 volume  0.39046E-02 ppm1      7.704 ppm2      2.522 CV     1
 ASSI { 1624}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 103  and name HB1 ))
      3.600     1.600     1.600 peak  1624 spectrum    1 weight  0.10000E+01 volume  0.19727E-02 ppm1      7.702 ppm2      2.221 CV     1
 ASSI { 1626}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 105  and name HG2%)
      3.000     3.000     3.000 peak  1626 spectrum    1 weight  0.10000E+01 volume  0.87026E-02 ppm1      7.710 ppm2      1.138 CV     1
 ASSI { 1627}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 100  and name HG2%)
      3.700     1.700     1.700 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.13798E-02 ppm1      7.713 ppm2      0.910 CV     1
 ASSI { 1641}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
      3.500     1.600     1.600 peak  1641 spectrum    1 weight  0.10000E+01 volume  0.11403E-02 ppm1      8.282 ppm2      3.272 CV     1
 ASSI { 1643}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HA1 ))
      3.700     1.700     1.700 peak  1643 spectrum    1 weight  0.10000E+01 volume  0.82118E-03 ppm1      8.294 ppm2      4.706 CV     1
 ASSI { 1644}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      2.600     0.800     0.800 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.31146E-02 ppm1      8.296 ppm2      4.046 CV     1
 ASSI { 1645}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      3.100     1.200     1.200 peak  1645 spectrum    1 weight  0.10000E+01 volume  0.27935E-02 ppm1      8.300 ppm2      1.876 CV     1
 ASSI { 1647}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 89   and name HG1%)
      3.400     1.500     1.500 peak  1647 spectrum    1 weight  0.10000E+01 volume  0.43858E-02 ppm1      8.301 ppm2      0.854 CV     1
 OR { 1647}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
 ASSI { 1678}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HD2 ))
      4.400     2.400     1.600 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.83401E-03 ppm1      8.701 ppm2      3.710 CV     1
 ASSI { 1679}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 112  and name HD% )
      3.700     1.700     1.700 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.61250E-03 ppm1      8.699 ppm2      6.776 CV     1
 ASSI { 1682}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      5.100     3.300     0.900 peak  1682 spectrum    1 weight  0.10000E+01 volume  0.77506E-03 ppm1      7.969 ppm2      8.731 CV     1
 ASSI { 1686}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      4.300     2.300     1.700 peak  1686 spectrum    1 weight  0.10000E+01 volume  0.75265E-03 ppm1      7.964 ppm2      4.772 CV     1
 ASSI { 1688}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HA1 ))
      2.700     0.900     0.900 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.29240E-02 ppm1      7.966 ppm2      3.645 CV     1
 ASSI { 1690}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HA2 ))
      2.900     1.100     1.100 peak  1690 spectrum    1 weight  0.10000E+01 volume  0.28169E-02 ppm1      7.966 ppm2      3.237 CV     1
 ASSI { 1691}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 30   and name HB  ))
      2.800     0.900     0.900 peak  1691 spectrum    1 weight  0.10000E+01 volume  0.20127E-02 ppm1      7.967 ppm2      2.176 CV     1
 ASSI { 1694}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      3.500     1.600     1.600 peak  1694 spectrum    1 weight  0.10000E+01 volume  0.12516E-02 ppm1      7.588 ppm2      8.222 CV     1
 ASSI { 1695}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      2.500     0.800     0.800 peak  1695 spectrum    1 weight  0.10000E+01 volume  0.54583E-02 ppm1      7.575 ppm2      4.393 CV     1
 ASSI { 1697}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
      2.600     2.600     3.400 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.75013E-02 ppm1      7.575 ppm2      1.535 CV     1
 ASSI { 1699}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 100  and name HG1%)
      2.900     1.000     1.000 peak  1699 spectrum    1 weight  0.10000E+01 volume  0.37392E-02 ppm1      7.575 ppm2      0.901 CV     1
 ASSI { 1700}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 19   and name HD2%)
      3.800     1.800     1.800 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.21535E-02 ppm1      7.575 ppm2      0.416 CV     1
 ASSI { 1701}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.500     1.600     1.600 peak  1701 spectrum    1 weight  0.10000E+01 volume  0.70550E-03 ppm1      7.581 ppm2      1.879 CV     1
 ASSI { 1704}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HA2 ))
      3.000     1.100     1.100 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.21999E-02 ppm1      8.701 ppm2      3.879 CV     1
 ASSI { 1705}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 142  and name HB  ))
      3.000     1.100     1.100 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.46479E-02 ppm1      8.701 ppm2      2.163 CV     1
 ASSI { 1706}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HB2 ))
      2.300     0.600     0.600 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.23982E-02 ppm1      8.701 ppm2      1.973 CV     1
 ASSI { 1707}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      3.400     3.400     2.600 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.31744E-02 ppm1      8.699 ppm2      0.683 CV     1
 OR { 1707}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
 ASSI { 1709}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 121  and name HH2 ))
      3.800     1.800     1.800 peak  1709 spectrum    1 weight  0.10000E+01 volume  0.65886E-03 ppm1      7.370 ppm2      6.896 CV     1
 OR { 1709}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 121  and name HE3 ))
 ASSI { 1715}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 128  and name HA1 ))
      2.400     0.700     0.700 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.36316E-02 ppm1      7.368 ppm2      3.330 CV     1
 ASSI { 1716}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 128  and name HA2 ))
      2.800     1.000     1.000 peak  1716 spectrum    1 weight  0.10000E+01 volume  0.49435E-02 ppm1      7.372 ppm2      2.374 CV     1
 ASSI { 1717}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 127  and name HB1 ))
      3.400     1.500     1.500 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.30119E-02 ppm1      7.370 ppm2      1.917 CV     1
 OR { 1717}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI { 1724}
   (( segid "    " and resid 87   and name HD21))
   (( segid "    " and resid 87   and name HD22))
      1.900     0.400     0.400 peak  1724 spectrum    1 weight  0.10000E+01 volume  0.15848E-01 ppm1      7.154 ppm2      6.313 CV     1
 ASSI { 1729}
   (( segid "    " and resid 87   and name HD21))
   (( segid "    " and resid 87   and name HN  ))
      4.600     2.600     1.400 peak  1729 spectrum    1 weight  0.10000E+01 volume  0.38668E-03 ppm1      7.153 ppm2      7.980 CV     1
 ASSI { 1732}
   (( segid "    " and resid 87   and name HD22))
   (( segid "    " and resid 87   and name HB1 ))
      3.900     1.900     1.900 peak  1732 spectrum    1 weight  0.10000E+01 volume  0.21911E-02 ppm1      6.299 ppm2      2.693 CV     1
 ASSI { 1733}
   (( segid "    " and resid 87   and name HD22))
   (( segid "    " and resid 87   and name HB2 ))
      3.900     1.900     1.900 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.18711E-02 ppm1      6.295 ppm2      2.329 CV     1
 ASSI { 1740}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      2.800     1.000     1.000 peak  1740 spectrum    1 weight  0.10000E+01 volume  0.21916E-02 ppm1      7.546 ppm2      9.448 CV     1
 ASSI { 1741}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 49   and name HZ  ))
      3.800     1.800     1.800 peak  1741 spectrum    1 weight  0.10000E+01 volume  0.17340E-02 ppm1      7.546 ppm2      7.143 CV     1
 ASSI { 1747}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HD2 ))
      4.300     2.400     1.700 peak  1747 spectrum    1 weight  0.10000E+01 volume  0.79133E-03 ppm1      7.551 ppm2      1.406 CV     1
 OR { 1747}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HD1 ))
 ASSI { 1756}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HD1 ))
      5.000     3.100     1.000 peak  1756 spectrum    1 weight  0.10000E+01 volume  0.45810E-03 ppm1      8.280 ppm2      3.248 CV     1
 ASSI { 1760}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      4.400     2.400     1.600 peak  1760 spectrum    1 weight  0.10000E+01 volume  0.50706E-03 ppm1      8.282 ppm2      5.111 CV     1
 ASSI { 1761}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
      2.900     1.100     1.100 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.15345E-02 ppm1      8.282 ppm2      4.443 CV     1
 ASSI { 1762}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HA2 ))
      2.200     0.600     0.600 peak  1762 spectrum    1 weight  0.10000E+01 volume  0.10135E-01 ppm1      8.282 ppm2      3.780 CV     1
 OR { 1762}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HA1 ))
 ASSI { 1763}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HB1 ))
      3.800     1.800     1.800 peak  1763 spectrum    1 weight  0.10000E+01 volume  0.11802E-02 ppm1      8.283 ppm2      2.075 CV     1
 ASSI { 1764}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HB2 ))
      2.700     0.900     0.900 peak  1764 spectrum    1 weight  0.10000E+01 volume  0.30708E-02 ppm1      8.277 ppm2      1.741 CV     1
 OR { 1764}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 1765}
   (( segid "    " and resid 17   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      4.000     2.000     2.000 peak  1765 spectrum    1 weight  0.10000E+01 volume  0.18510E-02 ppm1      8.282 ppm2      1.163 CV     1
 ASSI { 1766}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 19   and name HG  ))
      3.900     1.900     1.900 peak  1766 spectrum    1 weight  0.10000E+01 volume  0.78840E-03 ppm1      8.282 ppm2      0.746 CV     1
 ASSI { 1771}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA2 ))
      3.000     1.200     1.200 peak  1771 spectrum    1 weight  0.10000E+01 volume  0.25281E-02 ppm1      6.863 ppm2      3.722 CV     1
 ASSI { 1774}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HG12))
      3.600     1.600     1.600 peak  1774 spectrum    1 weight  0.10000E+01 volume  0.26769E-02 ppm1      6.863 ppm2      1.013 CV     1
 ASSI { 1775}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
      3.000     3.000     3.000 peak  1775 spectrum    1 weight  0.10000E+01 volume  0.71607E-02 ppm1      6.867 ppm2      0.528 CV     1
 ASSI { 1783}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 49   and name HE% )
      4.300     2.300     1.700 peak  1783 spectrum    1 weight  0.10000E+01 volume  0.91377E-03 ppm1      5.636 ppm2      6.930 CV     1
 ASSI { 1784}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      4.700     2.800     1.300 peak  1784 spectrum    1 weight  0.10000E+01 volume  0.58859E-03 ppm1      5.636 ppm2      6.569 CV     1
 ASSI { 1789}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      3.600     1.600     1.600 peak  1789 spectrum    1 weight  0.10000E+01 volume  0.81247E-03 ppm1      5.638 ppm2      2.612 CV     1
 ASSI { 1790}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 83   and name HG2%)
      5.000     3.200     1.000 peak  1790 spectrum    1 weight  0.10000E+01 volume  0.62513E-03 ppm1      5.640 ppm2      0.864 CV     1
 ASSI { 1802}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      2.700     0.900     0.900 peak  1802 spectrum    1 weight  0.10000E+01 volume  0.25971E-02 ppm1      9.199 ppm2      9.010 CV     1
 ASSI { 1803}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 137  and name HG2%)
      3.200     1.300     1.300 peak  1803 spectrum    1 weight  0.10000E+01 volume  0.25971E-02 ppm1      9.536 ppm2      1.104 CV     1
 ASSI { 1804}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 138  and name HG2%)
      3.700     1.700     1.700 peak  1804 spectrum    1 weight  0.10000E+01 volume  0.13707E-02 ppm1      9.538 ppm2      0.789 CV     1
 ASSI { 1805}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      3.800     1.800     1.800 peak  1805 spectrum    1 weight  0.10000E+01 volume  0.14428E-02 ppm1      9.541 ppm2      9.249 CV     1
 ASSI { 1806}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      3.800     1.800     1.800 peak  1806 spectrum    1 weight  0.10000E+01 volume  0.57712E-03 ppm1      9.494 ppm2      8.848 CV     1
 ASSI { 1807}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 140  and name HN  ))
      3.000     1.100     1.100 peak  1807 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      9.466 ppm2      9.310 CV     1
 ASSI { 1809}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 99   and name HD% )
      6.000     4.500     0.000 peak  1809 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.449 ppm2      6.833 CV     1
 ASSI { 1810}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HB  ))
      2.400     0.700     0.700 peak  1810 spectrum    1 weight  0.10000E+01 volume  0.57712E-02 ppm1      9.453 ppm2      2.467 CV     1
 ASSI { 1811}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.700     1.700     1.700 peak  1811 spectrum    1 weight  0.10000E+01 volume  0.14428E-02 ppm1      9.428 ppm2      3.510 CV     1
 ASSI { 1816}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HB1 ))
      3.600     1.600     1.600 peak  1816 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      9.270 ppm2      1.847 CV     1
 ASSI { 1817}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HA1 ))
      2.600     0.800     0.800 peak  1817 spectrum    1 weight  0.10000E+01 volume  0.25971E-02 ppm1      9.263 ppm2      4.329 CV     1
 ASSI { 1818}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 86   and name HE2 ))
      4.100     2.100     1.900 peak  1818 spectrum    1 weight  0.10000E+01 volume  0.10100E-02 ppm1      9.173 ppm2      2.148 CV     1
 ASSI { 1821}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      6.000     4.500     0.000 peak  1821 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.011 ppm2      4.938 CV     1
 ASSI { 1822}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 33   and name HB2 ))
      4.400     2.400     1.600 peak  1822 spectrum    1 weight  0.10000E+01 volume  0.36071E-03 ppm1      8.950 ppm2      1.601 CV     1
 OR { 1822}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 33   and name HG  ))
 ASSI { 1825}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      3.200     1.300     1.300 peak  1825 spectrum    1 weight  0.10000E+01 volume  0.12986E-02 ppm1      9.000 ppm2      1.632 CV     1
 OR { 1825}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HB2 ))
 ASSI { 1830}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HB  ))
      3.400     1.500     1.500 peak  1830 spectrum    1 weight  0.10000E+01 volume  0.28857E-02 ppm1      8.902 ppm2      2.186 CV     1
 ASSI { 1832}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HA1 ))
      3.400     1.500     1.500 peak  1832 spectrum    1 weight  0.10000E+01 volume  0.20200E-02 ppm1      8.838 ppm2      4.695 CV     1
 ASSI { 1833}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      4.100     2.100     1.900 peak  1833 spectrum    1 weight  0.10000E+01 volume  0.57712E-03 ppm1      8.821 ppm2      4.032 CV     1
 ASSI { 1834}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HA1 ))
      3.400     1.400     1.400 peak  1834 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      8.820 ppm2      4.295 CV     1
 ASSI { 1836}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HB  ))
      3.900     1.900     1.900 peak  1836 spectrum    1 weight  0.10000E+01 volume  0.14428E-02 ppm1      8.818 ppm2      3.950 CV     1
 ASSI { 1837}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      4.300     2.300     1.700 peak  1837 spectrum    1 weight  0.10000E+01 volume  0.57712E-03 ppm1      8.769 ppm2      8.548 CV     1
 ASSI { 1839}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB1 ))
      3.700     1.700     1.700 peak  1839 spectrum    1 weight  0.10000E+01 volume  0.15871E-02 ppm1      8.744 ppm2      2.013 CV     1
 OR { 1839}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
 ASSI { 1840}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 106  and name HD22))
      4.100     2.100     1.900 peak  1840 spectrum    1 weight  0.10000E+01 volume  0.72144E-03 ppm1      8.571 ppm2      6.858 CV     1
 ASSI { 1841}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
      4.100     2.100     1.900 peak  1841 spectrum    1 weight  0.10000E+01 volume  0.67813E-03 ppm1      8.613 ppm2      4.426 CV     1
 ASSI { 1843}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      3.200     3.200     2.800 peak  1843 spectrum    1 weight  0.10000E+01 volume  0.16448E-02 ppm1      8.590 ppm2      0.644 CV     1
 ASSI { 1845}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
      4.000     2.000     2.000 peak  1845 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      8.547 ppm2      0.457 CV     1
 ASSI { 1846}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.200     1.300     1.300 peak  1846 spectrum    1 weight  0.10000E+01 volume  0.17314E-02 ppm1      8.576 ppm2      5.051 CV     1
 ASSI { 1850}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 92   and name HZ3 ))
      4.400     2.400     1.600 peak  1850 spectrum    1 weight  0.10000E+01 volume  0.72144E-03 ppm1      8.546 ppm2      6.712 CV     1
 OR { 1850}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 92   and name HH2 ))
 ASSI { 1851}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.100     1.200     1.200 peak  1851 spectrum    1 weight  0.10000E+01 volume  0.12986E-02 ppm1      8.544 ppm2      5.188 CV     1
 ASSI { 1854}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HG1 ))
      2.900     1.100     1.100 peak  1854 spectrum    1 weight  0.10000E+01 volume  0.36071E-02 ppm1      8.492 ppm2      1.521 CV     1
 OR { 1854}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 1855}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      3.300     1.400     1.400 peak  1855 spectrum    1 weight  0.10000E+01 volume  0.96669E-03 ppm1      8.479 ppm2      5.239 CV     1
 ASSI { 1856}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      4.400     2.400     1.600 peak  1856 spectrum    1 weight  0.10000E+01 volume  0.57712E-03 ppm1      8.438 ppm2      6.926 CV     1
 ASSI { 1859}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      3.300     1.400     1.400 peak  1859 spectrum    1 weight  0.10000E+01 volume  0.17314E-02 ppm1      8.442 ppm2      4.510 CV     1
 ASSI { 1860}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
      4.200     2.200     1.800 peak  1860 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      8.390 ppm2      9.313 CV     1
 ASSI { 1861}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 118  and name HN  ))
      3.200     1.300     1.300 peak  1861 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      8.383 ppm2      9.047 CV     1
 ASSI { 1863}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HA1 ))
      2.800     0.900     0.900 peak  1863 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      8.379 ppm2      5.229 CV     1
 ASSI { 1865}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HA2 ))
      3.700     1.800     1.800 peak  1865 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      8.381 ppm2      3.799 CV     1
 ASSI { 1866}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 7    and name HB  ))
      3.400     1.500     1.500 peak  1866 spectrum    1 weight  0.10000E+01 volume  0.10100E-02 ppm1      8.383 ppm2      1.916 CV     1
 ASSI { 1868}
   (( segid "    " and resid 134  and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
      3.500     1.500     1.500 peak  1868 spectrum    1 weight  0.10000E+01 volume  0.16593E-02 ppm1      8.383 ppm2      1.265 CV     1
 ASSI { 1874}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HG1 ))
      3.400     1.400     1.400 peak  1874 spectrum    1 weight  0.10000E+01 volume  0.72144E-03 ppm1      8.201 ppm2      1.395 CV     1
 ASSI { 1877}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HA1 ))
      6.000     4.500     0.000 peak  1877 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.543 ppm2      4.052 CV     1
 ASSI { 1878}
   (( segid "    " and resid 128  and name HN  ))
   (  segid "    " and resid 122  and name HB% )
      6.000     4.500     0.000 peak  1878 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.372 ppm2      1.255 CV     1
 ASSI { 1879}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HD1 ))
      6.000     4.500     0.000 peak  1879 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.865 ppm2      3.535 CV     1
 OR { 1879}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HD2 ))
 ASSI {    1}
   (( segid "    " and resid 129  and name HB1 ))
   (  segid "    " and resid 41   and name HB% )
      4.600     2.600     1.400 peak     1 spectrum    1 weight  0.10000E+01 volume  0.96616E-03 ppm1      3.157 ppm2      1.524 CV     1
 ASSI {   21}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 38   and name HG2 ))
      2.700     0.900     0.900 peak    21 spectrum    1 weight  0.10000E+01 volume  0.30947E-02 ppm1      3.035 ppm2      0.879 CV     1
 ASSI {   26}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 120  and name HB2 ))
      2.000     0.500     0.500 peak    26 spectrum    1 weight  0.10000E+01 volume  0.55763E-02 ppm1      3.009 ppm2      2.754 CV     1
 ASSI {   32}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 127  and name HG1 ))
      4.300     2.300     1.700 peak    32 spectrum    1 weight  0.10000E+01 volume  0.76251E-03 ppm1      2.996 ppm2      2.227 CV     1
 OR {   32}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 127  and name HG2 ))
 ASSI {   34}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 38   and name HG1 ))
      2.500     0.800     0.800 peak    34 spectrum    1 weight  0.10000E+01 volume  0.71417E-02 ppm1      2.981 ppm2      1.348 CV     1
 ASSI {   63}
   (( segid "    " and resid 120  and name HB2 ))
   (( segid "    " and resid 120  and name HN  ))
      2.700     0.900     0.900 peak    63 spectrum    1 weight  0.10000E+01 volume  0.47693E-02 ppm1      2.819 ppm2      7.673 CV     1
 ASSI {   70}
   (( segid "    " and resid 120  and name HB2 ))
   (( segid "    " and resid 130  and name HN  ))
      3.900     1.900     1.900 peak    70 spectrum    1 weight  0.10000E+01 volume  0.75888E-03 ppm1      2.799 ppm2      8.025 CV     1
 ASSI {   73}
   (( segid "    " and resid 120  and name HB2 ))
   (( segid "    " and resid 41   and name HN  ))
      5.000     3.100     1.000 peak    73 spectrum    1 weight  0.10000E+01 volume  0.65696E-03 ppm1      2.765 ppm2      8.728 CV     1
 ASSI {   98}
   (( segid "    " and resid 101  and name HB1 ))
   (  segid "    " and resid 66   and name HD% )
      3.500     1.500     1.500 peak    98 spectrum    1 weight  0.10000E+01 volume  0.99097E-03 ppm1      2.668 ppm2      7.263 CV     1
 ASSI {  138}
   (( segid "    " and resid 129  and name HB1 ))
   (( segid "    " and resid 43   and name HG2 ))
      3.200     1.300     1.300 peak   138 spectrum    1 weight  0.10000E+01 volume  0.24296E-02 ppm1      3.144 ppm2      0.832 CV     1
 ASSI {  141}
   (( segid "    " and resid 129  and name HB1 ))
   (( segid "    " and resid 129  and name HA  ))
      2.900     1.100     1.100 peak   141 spectrum    1 weight  0.10000E+01 volume  0.16649E-02 ppm1      3.129 ppm2      4.688 CV     1
 ASSI {  142}
   (( segid "    " and resid 129  and name HB1 ))
   (( segid "    " and resid 129  and name HB2 ))
      2.000     0.500     0.500 peak   142 spectrum    1 weight  0.10000E+01 volume  0.53390E-02 ppm1      3.128 ppm2      2.934 CV     1
 ASSI {  149}
   (( segid "    " and resid 120  and name HB2 ))
   (( segid "    " and resid 121  and name HN  ))
      3.000     1.100     1.100 peak   149 spectrum    1 weight  0.10000E+01 volume  0.16964E-02 ppm1      2.786 ppm2      9.081 CV     1
 ASSI {  150}
   (( segid "    " and resid 120  and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
      2.800     1.000     1.000 peak   150 spectrum    1 weight  0.10000E+01 volume  0.29102E-02 ppm1      2.788 ppm2      6.624 CV     1
 ASSI {  165}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HA  ))
      2.600     0.900     0.900 peak   165 spectrum    1 weight  0.10000E+01 volume  0.59825E-02 ppm1      3.343 ppm2      4.810 CV     1
 ASSI {  167}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HB2 ))
      2.000     0.500     0.500 peak   167 spectrum    1 weight  0.10000E+01 volume  0.11222E-01 ppm1      3.341 ppm2      2.877 CV     1
 ASSI {  170}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
      2.600     0.900     0.900 peak   170 spectrum    1 weight  0.10000E+01 volume  0.56217E-02 ppm1      2.876 ppm2      4.810 CV     1
 ASSI {  173}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 112  and name HN  ))
      3.900     1.900     1.900 peak   173 spectrum    1 weight  0.10000E+01 volume  0.15256E-02 ppm1      2.693 ppm2      9.440 CV     1
 ASSI {  181}
   (( segid "    " and resid 101  and name HB1 ))
   (  segid "    " and resid 100  and name HG2%)
      4.100     2.100     1.900 peak   181 spectrum    1 weight  0.10000E+01 volume  0.77172E-03 ppm1      2.629 ppm2      0.896 CV     1
 ASSI {  184}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 68   and name HN  ))
      5.100     3.200     0.900 peak   184 spectrum    1 weight  0.10000E+01 volume  0.28730E-03 ppm1      2.628 ppm2      9.428 CV     1
 ASSI {  185}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 68   and name HN  ))
      3.500     1.500     1.500 peak   185 spectrum    1 weight  0.10000E+01 volume  0.10321E-02 ppm1      2.224 ppm2      9.419 CV     1
 ASSI {  193}
   (( segid "    " and resid 101  and name HB2 ))
   (  segid "    " and resid 100  and name HG2%)
      5.300     3.500     0.700 peak   193 spectrum    1 weight  0.10000E+01 volume  0.33226E-03 ppm1      2.221 ppm2      0.894 CV     1
 OR {  193}
   (( segid "    " and resid 101  and name HB2 ))
   (  segid "    " and resid 100  and name HG1%)
 ASSI {  200}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 111  and name HB2 ))
      1.800     0.400     0.400 peak   200 spectrum    1 weight  0.10000E+01 volume  0.17286E-01 ppm1      2.697 ppm2      2.546 CV     1
 ASSI {  202}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 126  and name HG2 ))
      4.000     2.000     2.000 peak   202 spectrum    1 weight  0.10000E+01 volume  0.90787E-03 ppm1      2.609 ppm2      1.425 CV     1
 OR {  202}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 126  and name HG1 ))
 ASSI {  209}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 112  and name HN  ))
      4.200     2.200     1.800 peak   209 spectrum    1 weight  0.10000E+01 volume  0.13855E-02 ppm1      2.516 ppm2      9.457 CV     1
 ASSI {  213}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 141  and name HA  ))
      4.600     2.600     1.400 peak   213 spectrum    1 weight  0.10000E+01 volume  0.55417E-03 ppm1      2.514 ppm2      5.120 CV     1
 ASSI {  214}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 112  and name HA  ))
      4.800     2.900     1.200 peak   214 spectrum    1 weight  0.10000E+01 volume  0.39206E-03 ppm1      2.505 ppm2      4.996 CV     1
 ASSI {  218}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HA  ))
      3.000     1.100     1.100 peak   218 spectrum    1 weight  0.10000E+01 volume  0.41571E-02 ppm1      2.857 ppm2      4.370 CV     1
 ASSI {  221}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HA  ))
      2.700     0.900     0.900 peak   221 spectrum    1 weight  0.10000E+01 volume  0.44617E-02 ppm1      2.715 ppm2      4.383 CV     1
 ASSI {  226}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 67   and name HN  ))
      4.200     2.200     1.800 peak   226 spectrum    1 weight  0.10000E+01 volume  0.10554E-02 ppm1      2.686 ppm2      8.717 CV     1
 ASSI {  228}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HA  ))
      2.500     0.800     0.800 peak   228 spectrum    1 weight  0.10000E+01 volume  0.30291E-02 ppm1      2.687 ppm2      5.260 CV     1
 ASSI {  230}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 66   and name HA  ))
      2.700     0.900     0.900 peak   230 spectrum    1 weight  0.10000E+01 volume  0.20375E-02 ppm1      2.683 ppm2      4.847 CV     1
 ASSI {  231}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HB2 ))
      1.900     0.500     0.500 peak   231 spectrum    1 weight  0.10000E+01 volume  0.47313E-02 ppm1      2.685 ppm2      2.211 CV     1
 ASSI {  238}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      2.600     0.800     0.800 peak   238 spectrum    1 weight  0.10000E+01 volume  0.16861E-02 ppm1      2.232 ppm2      8.894 CV     1
 ASSI {  243}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 64   and name HA  ))
      4.100     2.100     1.900 peak   243 spectrum    1 weight  0.10000E+01 volume  0.60474E-03 ppm1      2.227 ppm2      5.086 CV     1
 ASSI {  244}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 66   and name HA  ))
      3.400     1.500     1.500 peak   244 spectrum    1 weight  0.10000E+01 volume  0.15361E-02 ppm1      2.227 ppm2      4.853 CV     1
 ASSI {  254}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 48   and name HN  ))
      3.900     1.900     1.900 peak   254 spectrum    1 weight  0.10000E+01 volume  0.71145E-03 ppm1      2.865 ppm2      7.789 CV     1
 ASSI {  255}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HA  ))
      2.500     0.800     0.800 peak   255 spectrum    1 weight  0.10000E+01 volume  0.76132E-02 ppm1      2.853 ppm2      4.736 CV     1
 OR {  255}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  256}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 46   and name HB  ))
      4.400     2.400     1.600 peak   256 spectrum    1 weight  0.10000E+01 volume  0.76470E-03 ppm1      2.859 ppm2      4.214 CV     1
 OR {  256}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 46   and name HB  ))
 ASSI {  257}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 57   and name HB  ))
      4.300     2.300     1.700 peak   257 spectrum    1 weight  0.10000E+01 volume  0.45232E-03 ppm1      2.861 ppm2      2.047 CV     1
 OR {  257}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 57   and name HB  ))
 ASSI {  269}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 70   and name HN  ))
      3.200     1.300     1.300 peak   269 spectrum    1 weight  0.10000E+01 volume  0.18722E-02 ppm1      0.685 ppm2      8.575 CV     1
 ASSI {  270}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 84   and name HD% )
      4.300     2.300     1.700 peak   270 spectrum    1 weight  0.10000E+01 volume  0.39912E-03 ppm1      0.695 ppm2      6.905 CV     1
 ASSI {  272}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 69   and name HN  ))
      3.100     1.200     1.200 peak   272 spectrum    1 weight  0.10000E+01 volume  0.33454E-02 ppm1      0.683 ppm2      8.013 CV     1
 ASSI {  273}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 54   and name HE% )
      4.900     3.000     1.100 peak   273 spectrum    1 weight  0.10000E+01 volume  0.40226E-03 ppm1      0.673 ppm2      7.299 CV     1
 OR {  273}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 54   and name HD% )
 ASSI {  274}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 84   and name HE% )
      4.400     2.500     1.600 peak   274 spectrum    1 weight  0.10000E+01 volume  0.38486E-03 ppm1      0.680 ppm2      6.201 CV     1
 ASSI {  276}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 69   and name HA  ))
      2.600     0.800     0.800 peak   276 spectrum    1 weight  0.10000E+01 volume  0.37951E-02 ppm1      0.686 ppm2      4.913 CV     1
 ASSI {  278}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 68   and name HB2 ))
      4.800     2.800     1.200 peak   278 spectrum    1 weight  0.10000E+01 volume  0.51214E-03 ppm1      0.678 ppm2      2.524 CV     1
 OR {  278}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI {  282}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 69   and name HD1%)
      2.500     0.800     0.800 peak   282 spectrum    1 weight  0.10000E+01 volume  0.47181E-02 ppm1      0.678 ppm2     -0.597 CV     1
 ASSI {  283}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 96   and name HB  ))
      3.500     1.600     1.600 peak   283 spectrum    1 weight  0.10000E+01 volume  0.58703E-03 ppm1      0.680 ppm2      1.506 CV     1
 ASSI {  288}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HN  ))
      3.700     1.700     1.700 peak   288 spectrum    1 weight  0.10000E+01 volume  0.18027E-02 ppm1      3.460 ppm2      9.615 CV     1
 ASSI {  290}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 101  and name HN  ))
      4.500     2.500     1.500 peak   290 spectrum    1 weight  0.10000E+01 volume  0.49158E-03 ppm1      3.457 ppm2      8.544 CV     1
 ASSI {  291}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 81   and name HD21))
      3.200     1.300     1.300 peak   291 spectrum    1 weight  0.10000E+01 volume  0.11007E-02 ppm1      3.465 ppm2      7.720 CV     1
 ASSI {  294}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 66   and name HE% )
      4.800     2.900     1.200 peak   294 spectrum    1 weight  0.10000E+01 volume  0.48060E-03 ppm1      3.462 ppm2      6.602 CV     1
 ASSI {  295}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 55   and name HA  ))
      4.200     2.200     1.800 peak   295 spectrum    1 weight  0.10000E+01 volume  0.77486E-03 ppm1      3.460 ppm2      5.263 CV     1
 ASSI {  296}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HA  ))
      2.700     0.900     0.900 peak   296 spectrum    1 weight  0.10000E+01 volume  0.15281E-02 ppm1      3.457 ppm2      4.849 CV     1
 ASSI {  297}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HB2 ))
      1.900     0.500     0.500 peak   297 spectrum    1 weight  0.10000E+01 volume  0.68713E-02 ppm1      3.460 ppm2      3.033 CV     1
 ASSI {  305}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
      4.200     2.200     1.800 peak   305 spectrum    1 weight  0.10000E+01 volume  0.86225E-03 ppm1      3.065 ppm2      8.707 CV     1
 ASSI {  306}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HN  ))
      2.800     1.000     1.000 peak   306 spectrum    1 weight  0.10000E+01 volume  0.17466E-02 ppm1      3.050 ppm2      9.591 CV     1
 ASSI {  313}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 125  and name HA  ))
      2.600     0.800     0.800 peak   313 spectrum    1 weight  0.10000E+01 volume  0.54793E-02 ppm1      2.770 ppm2      4.517 CV     1
 ASSI {  322}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 126  and name HN  ))
      3.100     1.200     1.200 peak   322 spectrum    1 weight  0.10000E+01 volume  0.17708E-02 ppm1      2.699 ppm2      8.328 CV     1
 ASSI {  325}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 125  and name HA  ))
      2.600     0.900     0.900 peak   325 spectrum    1 weight  0.10000E+01 volume  0.50805E-02 ppm1      2.696 ppm2      4.519 CV     1
 ASSI {  335}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 61   and name HA  ))
      2.300     0.700     0.700 peak   335 spectrum    1 weight  0.10000E+01 volume  0.64218E-02 ppm1      3.052 ppm2      4.286 CV     1
 ASSI {  336}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 81   and name HA  ))
      2.300     0.700     0.700 peak   336 spectrum    1 weight  0.10000E+01 volume  0.61819E-02 ppm1      3.054 ppm2      4.024 CV     1
 ASSI {  338}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 81   and name HB2 ))
      1.400     0.200     0.800 peak   338 spectrum    1 weight  0.10000E+01 volume  0.33968E-01 ppm1      3.055 ppm2      2.558 CV     1
 ASSI {  339}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 82   and name HN  ))
      3.400     1.400     1.400 peak   339 spectrum    1 weight  0.10000E+01 volume  0.12252E-02 ppm1      3.038 ppm2      5.611 CV     1
 ASSI {  340}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HA  ))
      3.200     1.300     1.300 peak   340 spectrum    1 weight  0.10000E+01 volume  0.18884E-02 ppm1      3.033 ppm2      4.877 CV     1
 ASSI {  341}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 53   and name HB2 ))
      5.200     3.400     0.800 peak   341 spectrum    1 weight  0.10000E+01 volume  0.32244E-03 ppm1      3.036 ppm2      2.000 CV     1
 ASSI {  342}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 57   and name HG12))
      3.600     1.600     1.600 peak   342 spectrum    1 weight  0.10000E+01 volume  0.11196E-02 ppm1      3.037 ppm2      1.758 CV     1
 ASSI {  344}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 17   and name HA2 ))
      4.600     2.700     1.400 peak   344 spectrum    1 weight  0.10000E+01 volume  0.27428E-03 ppm1      2.960 ppm2      3.755 CV     1
 OR {  344}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 17   and name HA1 ))
 ASSI {  345}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 35   and name HB1 ))
      4.400     2.400     1.600 peak   345 spectrum    1 weight  0.10000E+01 volume  0.48849E-03 ppm1      2.945 ppm2      3.343 CV     1
 ASSI {  346}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 4    and name HN  ))
      3.900     1.900     1.900 peak   346 spectrum    1 weight  0.10000E+01 volume  0.72198E-03 ppm1      2.930 ppm2      8.961 CV     1
 ASSI {  347}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 3    and name HN  ))
      3.100     1.200     1.200 peak   347 spectrum    1 weight  0.10000E+01 volume  0.28749E-02 ppm1      2.934 ppm2      8.256 CV     1
 ASSI {  349}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 3    and name HB2 ))
      2.100     0.500     0.500 peak   349 spectrum    1 weight  0.10000E+01 volume  0.67640E-02 ppm1      2.934 ppm2      2.342 CV     1
 ASSI {  360}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 106  and name HD21))
      2.800     1.000     1.000 peak   360 spectrum    1 weight  0.10000E+01 volume  0.22806E-02 ppm1      2.846 ppm2      7.497 CV     1
 ASSI {  372}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 83   and name HN  ))
      5.000     3.200     1.000 peak   372 spectrum    1 weight  0.10000E+01 volume  0.50987E-03 ppm1      2.610 ppm2      7.413 CV     1
 ASSI {  376}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 80   and name HA  ))
      4.700     2.800     1.300 peak   376 spectrum    1 weight  0.10000E+01 volume  0.89338E-03 ppm1      2.594 ppm2      4.659 CV     1
 ASSI {  377}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HA  ))
      2.500     0.800     0.800 peak   377 spectrum    1 weight  0.10000E+01 volume  0.61394E-02 ppm1      2.601 ppm2      4.025 CV     1
 ASSI {  379}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HN  ))
      2.800     1.000     1.000 peak   379 spectrum    1 weight  0.10000E+01 volume  0.27589E-02 ppm1      2.363 ppm2      8.256 CV     1
 ASSI {  380}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 38   and name HG2 ))
      3.900     1.900     1.900 peak   380 spectrum    1 weight  0.10000E+01 volume  0.69234E-03 ppm1      2.359 ppm2      0.849 CV     1
 ASSI {  381}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 4    and name HN  ))
      4.500     2.600     1.500 peak   381 spectrum    1 weight  0.10000E+01 volume  0.47557E-03 ppm1      2.343 ppm2      8.968 CV     1
 ASSI {  382}
   (( segid "    " and resid 3    and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
      4.000     2.000     2.000 peak   382 spectrum    1 weight  0.10000E+01 volume  0.11504E-02 ppm1      2.349 ppm2      6.614 CV     1
 ASSI {  386}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 4    and name HB2 ))
      4.300     2.300     1.700 peak   386 spectrum    1 weight  0.10000E+01 volume  0.39840E-03 ppm1      2.344 ppm2      1.981 CV     1
 OR {  386}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  389}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HA  ))
      2.700     0.900     0.900 peak   389 spectrum    1 weight  0.10000E+01 volume  0.15235E-02 ppm1      1.922 ppm2      4.380 CV     1
 ASSI {  391}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HB2 ))
      1.900     0.400     0.400 peak   391 spectrum    1 weight  0.10000E+01 volume  0.49476E-02 ppm1      1.924 ppm2      1.049 CV     1
 ASSI {  393}
   (( segid "    " and resid 19   and name HB1 ))
   (  segid "    " and resid 19   and name HD2%)
      2.900     1.100     1.100 peak   393 spectrum    1 weight  0.10000E+01 volume  0.22887E-02 ppm1      1.923 ppm2      0.400 CV     1
 ASSI {  398}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 71   and name HA  ))
      4.700     2.800     1.300 peak   398 spectrum    1 weight  0.10000E+01 volume  0.51433E-03 ppm1      1.542 ppm2      4.813 CV     1
 ASSI {  401}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 96   and name HG12))
      2.500     0.800     0.800 peak   401 spectrum    1 weight  0.10000E+01 volume  0.56581E-02 ppm1      1.542 ppm2      1.119 CV     1
 OR {  401}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 96   and name HG11))
 ASSI {  402}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 42   and name HD1%)
      3.800     1.800     1.800 peak   402 spectrum    1 weight  0.10000E+01 volume  0.11813E-02 ppm1      1.546 ppm2      0.888 CV     1
 OR {  402}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 42   and name HD2%)
 ASSI {  404}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 96   and name HD1%)
      2.800     1.000     1.000 peak   404 spectrum    1 weight  0.10000E+01 volume  0.28235E-02 ppm1      1.542 ppm2      0.123 CV     1
 ASSI {  406}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 69   and name HD1%)
      4.800     2.900     1.200 peak   406 spectrum    1 weight  0.10000E+01 volume  0.31815E-03 ppm1      1.542 ppm2     -0.582 CV     1
 ASSI {  408}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 26   and name HA2 ))
      4.900     3.000     1.100 peak   408 spectrum    1 weight  0.10000E+01 volume  0.50710E-03 ppm1      1.527 ppm2      3.758 CV     1
 ASSI {  412}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 26   and name HN  ))
      2.900     1.100     1.100 peak   412 spectrum    1 weight  0.10000E+01 volume  0.22226E-02 ppm1      1.513 ppm2      6.867 CV     1
 ASSI {  413}
   (( segid "    " and resid 98   and name HB  ))
   (  segid "    " and resid 98   and name HG2%)
      2.200     0.600     0.600 peak   413 spectrum    1 weight  0.10000E+01 volume  0.93433E-02 ppm1      1.507 ppm2      0.542 CV     1
 ASSI {  416}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 16   and name HA  ))
      4.000     2.000     2.000 peak   416 spectrum    1 weight  0.10000E+01 volume  0.41373E-03 ppm1      1.064 ppm2      3.685 CV     1
 ASSI {  419}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HG  ))
      2.500     0.800     0.800 peak   419 spectrum    1 weight  0.10000E+01 volume  0.30021E-02 ppm1      1.058 ppm2      0.817 CV     1
 ASSI {  420}
   (( segid "    " and resid 19   and name HB2 ))
   (  segid "    " and resid 19   and name HD2%)
      3.200     1.300     1.300 peak   420 spectrum    1 weight  0.10000E+01 volume  0.30259E-02 ppm1      1.059 ppm2      0.404 CV     1
 ASSI {  422}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 75   and name HN  ))
      4.000     2.000     2.000 peak   422 spectrum    1 weight  0.10000E+01 volume  0.34180E-03 ppm1      3.120 ppm2      7.848 CV     1
 ASSI {  424}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HD22))
      3.900     1.900     1.900 peak   424 spectrum    1 weight  0.10000E+01 volume  0.16754E-02 ppm1      3.125 ppm2      6.853 CV     1
 ASSI {  425}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HA  ))
      2.400     0.700     0.700 peak   425 spectrum    1 weight  0.10000E+01 volume  0.64164E-02 ppm1      3.123 ppm2      4.628 CV     1
 ASSI {  426}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HB2 ))
      1.500     0.300     0.700 peak   426 spectrum    1 weight  0.10000E+01 volume  0.44275E-01 ppm1      3.123 ppm2      2.930 CV     1
 ASSI {  431}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 15   and name HA  ))
      5.500     3.800     0.500 peak   431 spectrum    1 weight  0.10000E+01 volume  0.31176E-03 ppm1      2.996 ppm2      5.138 CV     1
 ASSI {  432}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
      4.100     2.100     1.900 peak   432 spectrum    1 weight  0.10000E+01 volume  0.35820E-03 ppm1      2.946 ppm2      7.866 CV     1
 ASSI {  435}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HD22))
      3.600     1.600     1.600 peak   435 spectrum    1 weight  0.10000E+01 volume  0.21492E-02 ppm1      2.934 ppm2      6.859 CV     1
 ASSI {  436}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HA  ))
      2.800     1.000     1.000 peak   436 spectrum    1 weight  0.10000E+01 volume  0.57126E-02 ppm1      2.933 ppm2      4.626 CV     1
 ASSI {  439}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 37   and name HN  ))
      3.100     1.200     1.200 peak   439 spectrum    1 weight  0.10000E+01 volume  0.25105E-02 ppm1      2.753 ppm2      8.615 CV     1
 OR {  439}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 37   and name HN  ))
 ASSI {  443}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 36   and name HA  ))
      2.400     0.700     0.700 peak   443 spectrum    1 weight  0.10000E+01 volume  0.91456E-02 ppm1      2.758 ppm2      4.281 CV     1
 OR {  443}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  444}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 62   and name HG1 ))
      4.300     2.300     1.700 peak   444 spectrum    1 weight  0.10000E+01 volume  0.39458E-03 ppm1      2.755 ppm2      1.565 CV     1
 OR {  444}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 62   and name HB1 ))
 OR {  444}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  453}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 88   and name HA  ))
      4.100     2.100     1.900 peak   453 spectrum    1 weight  0.10000E+01 volume  0.46112E-03 ppm1      2.681 ppm2      5.004 CV     1
 ASSI {  454}
   (( segid "    " and resid 81   and name HB2 ))
   (  segid "    " and resid 54   and name HE% )
      4.800     2.900     1.200 peak   454 spectrum    1 weight  0.10000E+01 volume  0.39983E-03 ppm1      2.611 ppm2      7.170 CV     1
 ASSI {  458}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 18   and name HB1 ))
      4.700     2.800     1.300 peak   458 spectrum    1 weight  0.10000E+01 volume  0.35224E-03 ppm1      1.924 ppm2      2.342 CV     1
 OR {  458}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI {  460}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 15   and name HN  ))
      2.900     1.000     1.000 peak   460 spectrum    1 weight  0.10000E+01 volume  0.19491E-02 ppm1      1.866 ppm2      8.555 CV     1
 ASSI {  461}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 13   and name HA  ))
      5.600     3.900     0.400 peak   461 spectrum    1 weight  0.10000E+01 volume  0.24405E-03 ppm1      1.863 ppm2      5.522 CV     1
 ASSI {  463}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 14   and name HA  ))
      2.800     1.000     1.000 peak   463 spectrum    1 weight  0.10000E+01 volume  0.24883E-02 ppm1      1.862 ppm2      4.864 CV     1
 ASSI {  464}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 18   and name HB1 ))
      3.200     1.300     1.300 peak   464 spectrum    1 weight  0.10000E+01 volume  0.12191E-02 ppm1      1.865 ppm2      2.347 CV     1
 OR {  464}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI {  467}
   (( segid "    " and resid 14   and name HB1 ))
   (  segid "    " and resid 140  and name HD1%)
      3.200     1.300     1.300 peak   467 spectrum    1 weight  0.10000E+01 volume  0.21274E-02 ppm1      1.862 ppm2      0.650 CV     1
 ASSI {  470}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 14   and name HN  ))
      3.000     1.200     1.200 peak   470 spectrum    1 weight  0.10000E+01 volume  0.14533E-02 ppm1      1.321 ppm2      8.732 CV     1
 ASSI {  471}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 15   and name HN  ))
      3.600     1.700     1.700 peak   471 spectrum    1 weight  0.10000E+01 volume  0.14455E-02 ppm1      1.324 ppm2      8.557 CV     1
 ASSI {  473}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 14   and name HA  ))
      3.100     1.200     1.200 peak   473 spectrum    1 weight  0.10000E+01 volume  0.20246E-02 ppm1      1.320 ppm2      4.867 CV     1
 ASSI {  474}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 18   and name HB1 ))
      3.900     1.900     1.900 peak   474 spectrum    1 weight  0.10000E+01 volume  0.84586E-03 ppm1      1.326 ppm2      2.347 CV     1
 OR {  474}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI {  475}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 14   and name HB1 ))
      1.900     0.400     0.400 peak   475 spectrum    1 weight  0.10000E+01 volume  0.80623E-02 ppm1      1.319 ppm2      1.880 CV     1
 ASSI {  476}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 25   and name HB  ))
      3.600     1.600     1.600 peak   476 spectrum    1 weight  0.10000E+01 volume  0.89342E-03 ppm1      1.318 ppm2      1.525 CV     1
 ASSI {  478}
   (( segid "    " and resid 14   and name HB2 ))
   (  segid "    " and resid 12   and name HG1%)
      3.600     1.600     1.600 peak   478 spectrum    1 weight  0.10000E+01 volume  0.79488E-03 ppm1      1.321 ppm2      0.885 CV     1
 ASSI {  481}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 13   and name HA  ))
      4.700     2.800     1.300 peak   481 spectrum    1 weight  0.10000E+01 volume  0.37718E-03 ppm1      1.310 ppm2      5.515 CV     1
 ASSI {  483}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 14   and name HE1 ))
      4.100     2.100     1.900 peak   483 spectrum    1 weight  0.10000E+01 volume  0.40965E-03 ppm1      1.308 ppm2      2.999 CV     1
 ASSI {  484}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 14   and name HE2 ))
      4.300     2.300     1.700 peak   484 spectrum    1 weight  0.10000E+01 volume  0.35238E-03 ppm1      1.303 ppm2      2.704 CV     1
 ASSI {  486}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 61   and name HN  ))
      4.200     2.200     1.800 peak   486 spectrum    1 weight  0.10000E+01 volume  0.77754E-03 ppm1      3.229 ppm2      8.450 CV     1
 ASSI {  489}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 60   and name HA  ))
      2.500     0.800     0.800 peak   489 spectrum    1 weight  0.10000E+01 volume  0.60292E-02 ppm1      3.229 ppm2      4.527 CV     1
 ASSI {  491}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 62   and name HB1 ))
      4.400     2.400     1.600 peak   491 spectrum    1 weight  0.10000E+01 volume  0.46496E-03 ppm1      3.219 ppm2      1.653 CV     1
 ASSI {  492}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 61   and name HN  ))
      3.700     1.700     1.700 peak   492 spectrum    1 weight  0.10000E+01 volume  0.78159E-03 ppm1      2.788 ppm2      8.450 CV     1
 ASSI {  495}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HA  ))
      2.800     1.000     1.000 peak   495 spectrum    1 weight  0.10000E+01 volume  0.57786E-02 ppm1      2.790 ppm2      4.520 CV     1
 ASSI {  496}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HB1 ))
      1.900     0.400     0.400 peak   496 spectrum    1 weight  0.10000E+01 volume  0.11014E-01 ppm1      2.787 ppm2      3.232 CV     1
 ASSI {  497}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 88   and name HN  ))
      3.700     1.700     1.700 peak   497 spectrum    1 weight  0.10000E+01 volume  0.64565E-03 ppm1      2.698 ppm2      7.331 CV     1
 ASSI {  499}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 87   and name HD21))
      3.300     1.300     1.300 peak   499 spectrum    1 weight  0.10000E+01 volume  0.21346E-02 ppm1      2.691 ppm2      7.106 CV     1
 ASSI {  503}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 87   and name HB2 ))
      2.000     0.500     0.500 peak   503 spectrum    1 weight  0.10000E+01 volume  0.85957E-02 ppm1      2.677 ppm2      2.363 CV     1
 ASSI {  505}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      3.100     1.200     1.200 peak   505 spectrum    1 weight  0.10000E+01 volume  0.13810E-02 ppm1      2.666 ppm2      7.986 CV     1
 ASSI {  506}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 77   and name HA  ))
      4.300     2.300     1.700 peak   506 spectrum    1 weight  0.10000E+01 volume  0.88785E-03 ppm1      2.674 ppm2      4.693 CV     1
 ASSI {  508}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 88   and name HN  ))
      4.500     2.500     1.500 peak   508 spectrum    1 weight  0.10000E+01 volume  0.58298E-03 ppm1      2.314 ppm2      7.344 CV     1
 ASSI {  509}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 87   and name HD21))
      2.900     1.000     1.000 peak   509 spectrum    1 weight  0.10000E+01 volume  0.16614E-02 ppm1      2.312 ppm2      7.167 CV     1
 ASSI {  511}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 77   and name HA  ))
      4.000     2.000     2.000 peak   511 spectrum    1 weight  0.10000E+01 volume  0.10827E-02 ppm1      2.321 ppm2      4.698 CV     1
 ASSI {  515}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      4.400     2.400     1.600 peak   515 spectrum    1 weight  0.10000E+01 volume  0.54859E-03 ppm1      2.303 ppm2      4.941 CV     1
 ASSI {  518}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 99   and name HN  ))
      3.200     1.300     1.300 peak   518 spectrum    1 weight  0.10000E+01 volume  0.12229E-02 ppm1      2.130 ppm2      8.946 CV     1
 ASSI {  519}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 67   and name HA  ))
      2.400     0.700     0.700 peak   519 spectrum    1 weight  0.10000E+01 volume  0.38323E-02 ppm1      2.128 ppm2      5.256 CV     1
 ASSI {  521}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 100  and name HA  ))
      4.100     2.100     1.900 peak   521 spectrum    1 weight  0.10000E+01 volume  0.65902E-03 ppm1      2.126 ppm2      3.497 CV     1
 ASSI {  522}
   (( segid "    " and resid 67   and name HB  ))
   (  segid "    " and resid 67   and name HG1%)
      2.200     0.600     0.600 peak   522 spectrum    1 weight  0.10000E+01 volume  0.88644E-02 ppm1      2.133 ppm2      0.454 CV     1
 ASSI {  523}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 12   and name HN  ))
      2.900     1.100     1.100 peak   523 spectrum    1 weight  0.10000E+01 volume  0.21431E-02 ppm1      1.943 ppm2      8.773 CV     1
 ASSI {  524}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 13   and name HN  ))
      3.100     1.200     1.200 peak   524 spectrum    1 weight  0.10000E+01 volume  0.49612E-02 ppm1      1.936 ppm2      8.305 CV     1
 ASSI {  525}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 140  and name HA  ))
      3.300     1.400     1.400 peak   525 spectrum    1 weight  0.10000E+01 volume  0.96690E-03 ppm1      1.935 ppm2      5.387 CV     1
 ASSI {  526}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 11   and name HA  ))
      4.400     2.400     1.600 peak   526 spectrum    1 weight  0.10000E+01 volume  0.90027E-03 ppm1      1.938 ppm2      5.298 CV     1
 ASSI {  528}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 12   and name HA  ))
      2.500     0.800     0.800 peak   528 spectrum    1 weight  0.10000E+01 volume  0.71170E-02 ppm1      1.932 ppm2      4.636 CV     1
 ASSI {  529}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 14   and name HE2 ))
      4.400     2.400     1.600 peak   529 spectrum    1 weight  0.10000E+01 volume  0.50351E-03 ppm1      1.940 ppm2      2.684 CV     1
 ASSI {  532}
   (( segid "    " and resid 12   and name HB  ))
   (  segid "    " and resid 12   and name HG1%)
      2.200     0.600     0.600 peak   532 spectrum    1 weight  0.10000E+01 volume  0.13355E-01 ppm1      1.942 ppm2      0.867 CV     1
 OR {  532}
   (( segid "    " and resid 12   and name HB  ))
   (  segid "    " and resid 12   and name HG2%)
 ASSI {  534}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 139  and name HN  ))
      4.300     2.300     1.700 peak   534 spectrum    1 weight  0.10000E+01 volume  0.38085E-03 ppm1      1.927 ppm2      9.140 CV     1
 ASSI {  535}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HN  ))
      3.100     1.200     1.200 peak   535 spectrum    1 weight  0.10000E+01 volume  0.18045E-02 ppm1      1.053 ppm2      8.233 CV     1
 ASSI {  536}
   (( segid "    " and resid 64   and name HB1 ))
   (  segid "    " and resid 55   and name HE% )
      4.200     2.200     1.800 peak   536 spectrum    1 weight  0.10000E+01 volume  0.46169E-03 ppm1      1.059 ppm2      7.231 CV     1
 ASSI {  537}
   (( segid "    " and resid 64   and name HB1 ))
   (  segid "    " and resid 55   and name HD% )
      3.700     1.700     1.700 peak   537 spectrum    1 weight  0.10000E+01 volume  0.11819E-02 ppm1      1.057 ppm2      6.641 CV     1
 ASSI {  541}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HB2 ))
      1.800     0.400     0.400 peak   541 spectrum    1 weight  0.10000E+01 volume  0.92401E-02 ppm1      1.064 ppm2      0.640 CV     1
 ASSI {  543}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
      4.100     2.100     1.900 peak   543 spectrum    1 weight  0.10000E+01 volume  0.91484E-03 ppm1      1.045 ppm2      8.491 CV     1
 ASSI {  544}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 57   and name HA  ))
      4.200     2.300     1.800 peak   544 spectrum    1 weight  0.10000E+01 volume  0.31285E-03 ppm1      1.046 ppm2      5.385 CV     1
 ASSI {  546}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 55   and name HB1 ))
      5.000     3.100     1.000 peak   546 spectrum    1 weight  0.10000E+01 volume  0.48663E-03 ppm1      1.043 ppm2      2.693 CV     1
 ASSI {  550}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      3.300     1.400     1.400 peak   550 spectrum    1 weight  0.10000E+01 volume  0.12328E-02 ppm1      0.664 ppm2      8.491 CV     1
 ASSI {  551}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HN  ))
      3.600     1.600     1.600 peak   551 spectrum    1 weight  0.10000E+01 volume  0.12782E-02 ppm1      0.660 ppm2      8.251 CV     1
 ASSI {  552}
   (( segid "    " and resid 64   and name HB2 ))
   (  segid "    " and resid 55   and name HE% )
      4.200     2.200     1.800 peak   552 spectrum    1 weight  0.10000E+01 volume  0.40340E-03 ppm1      0.669 ppm2      7.224 CV     1
 ASSI {  553}
   (( segid "    " and resid 64   and name HB2 ))
   (  segid "    " and resid 55   and name HD% )
      3.000     1.100     1.100 peak   553 spectrum    1 weight  0.10000E+01 volume  0.12952E-02 ppm1      0.669 ppm2      6.641 CV     1
 ASSI {  555}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HA  ))
      2.800     1.000     1.000 peak   555 spectrum    1 weight  0.10000E+01 volume  0.19761E-02 ppm1      0.662 ppm2      5.095 CV     1
 ASSI {  556}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 66   and name HA  ))
      4.800     2.900     1.200 peak   556 spectrum    1 weight  0.10000E+01 volume  0.44654E-03 ppm1      0.660 ppm2      4.863 CV     1
 ASSI {  558}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 55   and name HB1 ))
      4.300     2.300     1.700 peak   558 spectrum    1 weight  0.10000E+01 volume  0.62224E-03 ppm1      0.660 ppm2      2.691 CV     1
 ASSI {  559}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 55   and name HB2 ))
      3.000     1.200     1.200 peak   559 spectrum    1 weight  0.10000E+01 volume  0.10432E-02 ppm1      0.668 ppm2      2.224 CV     1
 ASSI {  561}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HG2 ))
      3.100     1.200     1.200 peak   561 spectrum    1 weight  0.10000E+01 volume  0.15677E-02 ppm1      0.671 ppm2     -0.178 CV     1
 ASSI {  562}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 57   and name HB  ))
      4.100     2.100     1.900 peak   562 spectrum    1 weight  0.10000E+01 volume  0.49938E-03 ppm1      0.623 ppm2      2.089 CV     1
 ASSI {  565}
   (( segid "    " and resid 2    and name HG1 ))
   (( segid "    " and resid 2    and name HA  ))
      3.000     1.100     1.100 peak   565 spectrum    1 weight  0.10000E+01 volume  0.25767E-02 ppm1      2.338 ppm2      4.205 CV     1
 ASSI {  569}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HN  ))
      2.900     1.000     1.000 peak   569 spectrum    1 weight  0.10000E+01 volume  0.28569E-02 ppm1      2.282 ppm2      8.427 CV     1
 ASSI {  571}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 2    and name HA  ))
      2.600     0.900     0.900 peak   571 spectrum    1 weight  0.10000E+01 volume  0.93631E-02 ppm1      2.273 ppm2      4.268 CV     1
 ASSI {  581}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 96   and name HN  ))
      4.500     2.600     1.500 peak   581 spectrum    1 weight  0.10000E+01 volume  0.40736E-03 ppm1      2.168 ppm2      9.189 CV     1
 ASSI {  583}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 30   and name HN  ))
      2.600     0.800     0.800 peak   583 spectrum    1 weight  0.10000E+01 volume  0.31458E-02 ppm1      2.171 ppm2      8.541 CV     1
 ASSI {  584}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 92   and name HZ3 ))
      2.600     0.800     0.800 peak   584 spectrum    1 weight  0.10000E+01 volume  0.41674E-02 ppm1      2.178 ppm2      6.713 CV     1
 ASSI {  587}
   (( segid "    " and resid 30   and name HB  ))
   (  segid "    " and resid 30   and name HG2%)
      2.100     0.600     0.600 peak   587 spectrum    1 weight  0.10000E+01 volume  0.11208E-01 ppm1      2.167 ppm2      1.103 CV     1
 ASSI {  588}
   (( segid "    " and resid 30   and name HB  ))
   (  segid "    " and resid 96   and name HD1%)
      4.500     2.600     1.500 peak   588 spectrum    1 weight  0.10000E+01 volume  0.48646E-03 ppm1      2.171 ppm2      0.106 CV     1
 ASSI {  610}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
      3.100     1.200     1.200 peak   610 spectrum    1 weight  0.10000E+01 volume  0.22886E-02 ppm1      1.519 ppm2      8.527 CV     1
 ASSI {  611}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 98   and name HN  ))
      4.700     2.700     1.300 peak   611 spectrum    1 weight  0.10000E+01 volume  0.62752E-03 ppm1      1.506 ppm2      7.656 CV     1
 ASSI {  612}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 26   and name HN  ))
      2.900     1.100     1.100 peak   612 spectrum    1 weight  0.10000E+01 volume  0.27349E-02 ppm1      1.513 ppm2      6.833 CV     1
 ASSI {  613}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 24   and name HA  ))
      4.500     2.600     1.500 peak   613 spectrum    1 weight  0.10000E+01 volume  0.98362E-03 ppm1      1.514 ppm2      4.137 CV     1
 ASSI {  615}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HG12))
      2.800     1.000     1.000 peak   615 spectrum    1 weight  0.10000E+01 volume  0.39944E-02 ppm1      1.508 ppm2      1.034 CV     1
 ASSI {  616}
   (( segid "    " and resid 25   and name HB  ))
   (  segid "    " and resid 25   and name HG2%)
      2.400     0.700     0.700 peak   616 spectrum    1 weight  0.10000E+01 volume  0.78547E-02 ppm1      1.511 ppm2      0.506 CV     1
 ASSI {  619}
   (( segid "    " and resid 18   and name HG1 ))
   (( segid "    " and resid 18   and name HN  ))
      3.700     1.700     1.700 peak   619 spectrum    1 weight  0.10000E+01 volume  0.19009E-02 ppm1      2.524 ppm2      7.770 CV     1
 ASSI {  620}
   (( segid "    " and resid 18   and name HG1 ))
   (( segid "    " and resid 19   and name HN  ))
      3.600     1.600     1.600 peak   620 spectrum    1 weight  0.10000E+01 volume  0.13192E-02 ppm1      2.520 ppm2      7.594 CV     1
 ASSI {  625}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 18   and name HN  ))
      3.400     1.500     1.500 peak   625 spectrum    1 weight  0.10000E+01 volume  0.18537E-02 ppm1      2.363 ppm2      7.772 CV     1
 ASSI {  626}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 15   and name HN  ))
      3.600     1.600     1.600 peak   626 spectrum    1 weight  0.10000E+01 volume  0.76941E-03 ppm1      2.356 ppm2      8.567 CV     1
 ASSI {  627}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 19   and name HN  ))
      3.500     1.500     1.500 peak   627 spectrum    1 weight  0.10000E+01 volume  0.18116E-02 ppm1      2.354 ppm2      7.599 CV     1
 ASSI {  628}
   (( segid "    " and resid 50   and name HG1 ))
   (  segid "    " and resid 55   and name HE% )
      2.900     1.000     1.000 peak   628 spectrum    1 weight  0.10000E+01 volume  0.19845E-02 ppm1      2.346 ppm2      7.212 CV     1
 ASSI {  629}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 55   and name HZ  ))
      3.500     1.500     1.500 peak   629 spectrum    1 weight  0.10000E+01 volume  0.12437E-02 ppm1      2.345 ppm2      6.906 CV     1
 ASSI {  632}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 25   and name HG11))
      4.200     2.200     1.800 peak   632 spectrum    1 weight  0.10000E+01 volume  0.71966E-03 ppm1      2.353 ppm2      1.451 CV     1
 ASSI {  641}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 51   and name HN  ))
      4.400     2.400     1.600 peak   641 spectrum    1 weight  0.10000E+01 volume  0.11858E-02 ppm1      2.281 ppm2      9.385 CV     1
 ASSI {  643}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 38   and name HN  ))
      3.200     1.300     1.300 peak   643 spectrum    1 weight  0.10000E+01 volume  0.10593E-02 ppm1      1.588 ppm2      7.355 CV     1
 OR {  643}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI {  644}
   (( segid "    " and resid 38   and name HB1 ))
   (  segid "    " and resid 120  and name HD% )
      4.100     2.200     1.900 peak   644 spectrum    1 weight  0.10000E+01 volume  0.82774E-03 ppm1      1.581 ppm2      6.628 CV     1
 OR {  644}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
 ASSI {  647}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 120  and name HA  ))
      4.800     2.900     1.200 peak   647 spectrum    1 weight  0.10000E+01 volume  0.42450E-03 ppm1      1.571 ppm2      5.745 CV     1
 OR {  647}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 120  and name HA  ))
 ASSI {  654}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 38   and name HG1 ))
      2.900     1.000     1.000 peak   654 spectrum    1 weight  0.10000E+01 volume  0.25229E-02 ppm1      1.574 ppm2      1.339 CV     1
 OR {  654}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 38   and name HG1 ))
 ASSI {  656}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 35   and name HA  ))
      3.800     1.800     1.800 peak   656 spectrum    1 weight  0.10000E+01 volume  0.67706E-03 ppm1      1.581 ppm2      4.310 CV     1
 OR {  656}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  658}
   (( segid "    " and resid 18   and name HG1 ))
   (( segid "    " and resid 15   and name HN  ))
      4.000     2.000     2.000 peak   658 spectrum    1 weight  0.10000E+01 volume  0.80586E-03 ppm1      2.525 ppm2      8.577 CV     1
 ASSI {  666}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HA  ))
      2.300     0.700     0.700 peak   666 spectrum    1 weight  0.10000E+01 volume  0.34376E-02 ppm1      2.215 ppm2      4.764 CV     1
 ASSI {  668}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HB2 ))
      1.800     0.400     0.400 peak   668 spectrum    1 weight  0.10000E+01 volume  0.87827E-02 ppm1      2.210 ppm2      2.010 CV     1
 ASSI {  674}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HA  ))
      2.800     1.000     1.000 peak   674 spectrum    1 weight  0.10000E+01 volume  0.27407E-02 ppm1      1.965 ppm2      4.759 CV     1
 ASSI {  675}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 54   and name HB2 ))
      4.200     2.200     1.800 peak   675 spectrum    1 weight  0.10000E+01 volume  0.87530E-03 ppm1      1.964 ppm2      2.834 CV     1
 ASSI {  677}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HD2 ))
      3.000     1.100     1.100 peak   677 spectrum    1 weight  0.10000E+01 volume  0.50438E-02 ppm1      1.969 ppm2      1.423 CV     1
 OR {  677}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HD1 ))
 ASSI {  685}
   (( segid "    " and resid 51   and name HG1 ))
   (( segid "    " and resid 51   and name HB2 ))
      2.100     0.600     0.600 peak   685 spectrum    1 weight  0.10000E+01 volume  0.15957E-01 ppm1      2.379 ppm2      1.976 CV     1
 ASSI {  690}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 113  and name HA  ))
      5.300     3.600     0.700 peak   690 spectrum    1 weight  0.10000E+01 volume  0.32210E-03 ppm1      1.879 ppm2      5.815 CV     1
 ASSI {  693}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 139  and name HB2 ))
      1.600     0.300     0.600 peak   693 spectrum    1 weight  0.10000E+01 volume  0.23912E-01 ppm1      1.879 ppm2      1.666 CV     1
 ASSI {  694}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 139  and name HG1 ))
      2.400     0.700     0.700 peak   694 spectrum    1 weight  0.10000E+01 volume  0.55330E-02 ppm1      1.876 ppm2      1.316 CV     1
 OR {  694}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 139  and name HG2 ))
 ASSI {  695}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 139  and name HE1 ))
      4.100     2.100     1.900 peak   695 spectrum    1 weight  0.10000E+01 volume  0.72012E-03 ppm1      1.861 ppm2      2.894 CV     1
 ASSI {  700}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 28   and name HN  ))
      2.500     0.800     0.800 peak   700 spectrum    1 weight  0.10000E+01 volume  0.42235E-02 ppm1      1.692 ppm2      8.961 CV     1
 ASSI {  701}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 27   and name HA  ))
      4.000     2.000     2.000 peak   701 spectrum    1 weight  0.10000E+01 volume  0.14329E-02 ppm1      1.684 ppm2      5.154 CV     1
 ASSI {  702}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 28   and name HA  ))
      3.000     1.100     1.100 peak   702 spectrum    1 weight  0.10000E+01 volume  0.19898E-02 ppm1      1.691 ppm2      4.041 CV     1
 ASSI {  703}
   (( segid "    " and resid 28   and name HB  ))
   (  segid "    " and resid 28   and name HG1%)
      2.200     0.600     0.600 peak   703 spectrum    1 weight  0.10000E+01 volume  0.10719E-01 ppm1      1.686 ppm2      0.645 CV     1
 OR {  703}
   (( segid "    " and resid 28   and name HB  ))
   (  segid "    " and resid 28   and name HG2%)
 ASSI {  705}
   (( segid "    " and resid 28   and name HB  ))
   (  segid "    " and resid 96   and name HD1%)
      3.600     1.700     1.700 peak   705 spectrum    1 weight  0.10000E+01 volume  0.11068E-02 ppm1      1.688 ppm2      0.115 CV     1
 ASSI {  706}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 29   and name HN  ))
      4.200     2.200     1.800 peak   706 spectrum    1 weight  0.10000E+01 volume  0.62711E-03 ppm1      1.680 ppm2      8.313 CV     1
 ASSI {  711}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 139  and name HA  ))
      2.600     0.800     0.800 peak   711 spectrum    1 weight  0.10000E+01 volume  0.26128E-02 ppm1      1.650 ppm2      4.945 CV     1
 ASSI {  713}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 137  and name HB  ))
      4.000     2.000     2.000 peak   713 spectrum    1 weight  0.10000E+01 volume  0.27862E-03 ppm1      1.648 ppm2      3.811 CV     1
 ASSI {  714}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 139  and name HE1 ))
      3.300     1.400     1.400 peak   714 spectrum    1 weight  0.10000E+01 volume  0.84334E-03 ppm1      1.645 ppm2      2.896 CV     1
 ASSI {  720}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HB2 ))
      2.100     0.500     0.500 peak   720 spectrum    1 weight  0.10000E+01 volume  0.44097E-02 ppm1      0.821 ppm2     -0.384 CV     1
 ASSI {  721}
   (( segid "    " and resid 43   and name HB1 ))
   (  segid "    " and resid 49   and name HE% )
      3.500     1.500     1.500 peak   721 spectrum    1 weight  0.10000E+01 volume  0.11300E-02 ppm1      0.816 ppm2      6.941 CV     1
 ASSI {  723}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HA  ))
      2.900     1.100     1.100 peak   723 spectrum    1 weight  0.10000E+01 volume  0.15412E-02 ppm1      0.804 ppm2      4.880 CV     1
 ASSI {  724}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 117  and name HB  ))
      3.700     1.700     1.700 peak   724 spectrum    1 weight  0.10000E+01 volume  0.94234E-03 ppm1      0.808 ppm2      3.941 CV     1
 ASSI {  726}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HG1 ))
      2.400     0.700     0.700 peak   726 spectrum    1 weight  0.10000E+01 volume  0.46669E-02 ppm1      0.813 ppm2      1.198 CV     1
 ASSI {  729}
   (( segid "    " and resid 43   and name HB2 ))
   (  segid "    " and resid 49   and name HE% )
      4.300     2.300     1.700 peak   729 spectrum    1 weight  0.10000E+01 volume  0.93718E-03 ppm1     -0.415 ppm2      6.933 CV     1
 ASSI {  730}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
      3.300     1.400     1.400 peak   730 spectrum    1 weight  0.10000E+01 volume  0.13975E-02 ppm1     -0.425 ppm2      4.886 CV     1
 ASSI {  731}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HG1 ))
      2.900     1.100     1.100 peak   731 spectrum    1 weight  0.10000E+01 volume  0.37847E-02 ppm1     -0.418 ppm2      1.194 CV     1
 ASSI {  732}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HB1 ))
      1.900     0.500     0.500 peak   732 spectrum    1 weight  0.10000E+01 volume  0.78613E-02 ppm1     -0.420 ppm2      0.845 CV     1
 OR {  732}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI {  759}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 33   and name HB1 ))
      3.200     1.300     1.300 peak   759 spectrum    1 weight  0.10000E+01 volume  0.20078E-02 ppm1      2.319 ppm2      1.680 CV     1
 OR {  759}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 33   and name HB1 ))
 OR {  759}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 33   and name HB2 ))
 OR {  759}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 33   and name HB2 ))
 ASSI {  765}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.800     1.000     1.000 peak   765 spectrum    1 weight  0.10000E+01 volume  0.46797E-02 ppm1      2.311 ppm2      4.665 CV     1
 OR {  765}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 4    and name HA  ))
 ASSI {  767}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 4    and name HB2 ))
      2.200     0.600     0.600 peak   767 spectrum    1 weight  0.10000E+01 volume  0.13615E-01 ppm1      2.301 ppm2      1.964 CV     1
 OR {  767}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HB1 ))
 OR {  767}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {  767}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  770}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 118  and name HA2 ))
      3.800     1.800     1.800 peak   770 spectrum    1 weight  0.10000E+01 volume  0.17431E-02 ppm1      2.285 ppm2      4.197 CV     1
 ASSI {  773}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 128  and name HN  ))
      3.500     1.500     1.500 peak   773 spectrum    1 weight  0.10000E+01 volume  0.26338E-02 ppm1      2.248 ppm2      7.428 CV     1
 OR {  773}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 128  and name HN  ))
 ASSI {  774}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name HA  ))
      2.600     0.800     0.800 peak   774 spectrum    1 weight  0.10000E+01 volume  0.36047E-02 ppm1      2.243 ppm2      4.092 CV     1
 OR {  774}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 127  and name HA  ))
 ASSI {  775}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name HN  ))
      3.700     1.700     1.700 peak   775 spectrum    1 weight  0.10000E+01 volume  0.29447E-02 ppm1      2.224 ppm2      7.961 CV     1
 OR {  775}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  782}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 127  and name HB1 ))
      2.100     0.500     0.500 peak   782 spectrum    1 weight  0.10000E+01 volume  0.20480E-01 ppm1      2.220 ppm2      1.924 CV     1
 OR {  782}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name HB2 ))
 OR {  782}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name HB1 ))
 OR {  782}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  791}
   (( segid "    " and resid 7    and name HB  ))
   (( segid "    " and resid 7    and name HN  ))
      2.800     1.000     1.000 peak   791 spectrum    1 weight  0.10000E+01 volume  0.22068E-02 ppm1      1.872 ppm2      7.648 CV     1
 ASSI {  799}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 5    and name HN  ))
      2.800     1.000     1.000 peak   799 spectrum    1 weight  0.10000E+01 volume  0.20666E-02 ppm1      2.254 ppm2      9.331 CV     1
 ASSI {  802}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 133  and name HA1 ))
      3.500     1.600     1.600 peak   802 spectrum    1 weight  0.10000E+01 volume  0.70604E-03 ppm1      2.261 ppm2      5.240 CV     1
 ASSI {  804}
   (( segid "    " and resid 5    and name HB  ))
   (  segid "    " and resid 5    and name HG1%)
      2.500     0.800     0.800 peak   804 spectrum    1 weight  0.10000E+01 volume  0.51511E-02 ppm1      2.258 ppm2      1.430 CV     1
 ASSI {  806}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 142  and name HN  ))
      2.500     0.800     0.800 peak   806 spectrum    1 weight  0.10000E+01 volume  0.35566E-02 ppm1      2.138 ppm2      9.438 CV     1
 ASSI {  843}
   (( segid "    " and resid 83   and name HB  ))
   (  segid "    " and resid 85   and name HD% )
      3.600     1.600     1.600 peak   843 spectrum    1 weight  0.10000E+01 volume  0.79290E-03 ppm1      2.240 ppm2      6.022 CV     1
 ASSI {  845}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 43   and name HE2 ))
      3.900     1.900     1.900 peak   845 spectrum    1 weight  0.10000E+01 volume  0.42541E-03 ppm1      2.246 ppm2      2.932 CV     1
 OR {  845}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI {  849}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 27   and name HD1 ))
      3.600     1.700     1.700 peak   849 spectrum    1 weight  0.10000E+01 volume  0.15795E-02 ppm1      1.942 ppm2      3.518 CV     1
 OR {  849}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 27   and name HD2 ))
 ASSI {  850}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 27   and name HB2 ))
      1.900     0.400     0.400 peak   850 spectrum    1 weight  0.10000E+01 volume  0.88285E-02 ppm1      1.945 ppm2      1.641 CV     1
 ASSI {  854}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 84   and name HZ  ))
      3.800     1.800     1.800 peak   854 spectrum    1 weight  0.10000E+01 volume  0.42801E-03 ppm1      1.864 ppm2      6.374 CV     1
 OR {  854}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 84   and name HZ  ))
 ASSI {  858}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 70   and name HN  ))
      3.100     1.200     1.200 peak   858 spectrum    1 weight  0.10000E+01 volume  0.14622E-02 ppm1      1.856 ppm2      8.535 CV     1
 OR {  858}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI {  859}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 99   and name HD% )
      3.500     1.500     1.500 peak   859 spectrum    1 weight  0.10000E+01 volume  0.13435E-02 ppm1      1.860 ppm2      6.811 CV     1
 OR {  859}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 99   and name HD% )
 ASSI {  860}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 99   and name HE% )
      3.100     1.200     1.200 peak   860 spectrum    1 weight  0.10000E+01 volume  0.17306E-02 ppm1      1.855 ppm2      6.612 CV     1
 OR {  860}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 99   and name HE% )
 ASSI {  862}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HD2 ))
      3.300     1.300     1.300 peak   862 spectrum    1 weight  0.10000E+01 volume  0.13330E-02 ppm1      1.844 ppm2      3.087 CV     1
 OR {  862}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 71   and name HD2 ))
 ASSI {  868}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 121  and name HH2 ))
      4.900     3.000     1.100 peak   868 spectrum    1 weight  0.10000E+01 volume  0.55553E-03 ppm1      1.793 ppm2      6.902 CV     1
 OR {  868}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 121  and name HH2 ))
 ASSI {  870}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 121  and name HD1 ))
      4.500     2.600     1.500 peak   870 spectrum    1 weight  0.10000E+01 volume  0.39840E-03 ppm1      1.792 ppm2      6.375 CV     1
 OR {  870}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 121  and name HD1 ))
 ASSI {  872}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 123  and name HA  ))
      2.200     0.600     0.600 peak   872 spectrum    1 weight  0.10000E+01 volume  0.95377E-02 ppm1      1.787 ppm2      3.913 CV     1
 OR {  872}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HA  ))
 ASSI {  873}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 126  and name HG2 ))
      2.000     0.500     0.500 peak   873 spectrum    1 weight  0.10000E+01 volume  0.12724E-01 ppm1      1.793 ppm2      1.437 CV     1
 OR {  873}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 126  and name HG1 ))
 OR {  873}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 126  and name HG2 ))
 OR {  873}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 126  and name HG1 ))
 ASSI {  874}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 121  and name HE1 ))
      3.700     1.700     1.700 peak   874 spectrum    1 weight  0.10000E+01 volume  0.83344E-03 ppm1      1.770 ppm2      9.540 CV     1
 OR {  874}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 121  and name HE1 ))
 ASSI {  877}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 28   and name HN  ))
      3.700     1.700     1.700 peak   877 spectrum    1 weight  0.10000E+01 volume  0.13061E-02 ppm1      1.662 ppm2      8.968 CV     1
 ASSI {  878}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 27   and name HA  ))
      3.000     1.100     1.100 peak   878 spectrum    1 weight  0.10000E+01 volume  0.23938E-02 ppm1      1.652 ppm2      5.168 CV     1
 ASSI {  883}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 63   and name HN  ))
      3.400     1.400     1.400 peak   883 spectrum    1 weight  0.10000E+01 volume  0.21371E-02 ppm1      1.644 ppm2      7.900 CV     1
 ASSI {  884}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HA  ))
      2.500     0.800     0.800 peak   884 spectrum    1 weight  0.10000E+01 volume  0.49761E-02 ppm1      1.637 ppm2      4.444 CV     1
 ASSI {  885}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 27   and name HD2 ))
      3.900     1.900     1.900 peak   885 spectrum    1 weight  0.10000E+01 volume  0.13316E-02 ppm1      1.640 ppm2      3.515 CV     1
 OR {  885}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 27   and name HD1 ))
 ASSI {  886}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HD1 ))
      2.700     0.900     0.900 peak   886 spectrum    1 weight  0.10000E+01 volume  0.37736E-02 ppm1      1.641 ppm2      3.153 CV     1
 OR {  886}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HD2 ))
 ASSI {  889}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HA  ))
      2.900     1.000     1.000 peak   889 spectrum    1 weight  0.10000E+01 volume  0.37303E-02 ppm1      1.520 ppm2      4.425 CV     1
 ASSI {  890}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HN  ))
      3.000     1.100     1.100 peak   890 spectrum    1 weight  0.10000E+01 volume  0.27476E-02 ppm1      1.507 ppm2      8.486 CV     1
 ASSI {  891}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 63   and name HN  ))
      3.000     1.100     1.100 peak   891 spectrum    1 weight  0.10000E+01 volume  0.18939E-02 ppm1      1.523 ppm2      7.904 CV     1
 ASSI {  892}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HD1 ))
      3.100     1.200     1.200 peak   892 spectrum    1 weight  0.10000E+01 volume  0.29000E-02 ppm1      1.512 ppm2      3.151 CV     1
 OR {  892}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HD2 ))
 ASSI {  893}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 58   and name HB1 ))
      4.700     2.700     1.300 peak   893 spectrum    1 weight  0.10000E+01 volume  0.27513E-03 ppm1      1.501 ppm2      3.451 CV     1
 OR {  893}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 58   and name HB2 ))
 ASSI {  897}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 105  and name HB  ))
      4.500     2.500     1.500 peak   897 spectrum    1 weight  0.10000E+01 volume  0.43230E-03 ppm1      1.403 ppm2      4.396 CV     1
 ASSI {  900}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 121  and name HN  ))
      2.700     0.900     0.900 peak   900 spectrum    1 weight  0.10000E+01 volume  0.17696E-02 ppm1      2.758 ppm2      9.089 CV     1
 ASSI {  905}
   (( segid "    " and resid 121  and name HB1 ))
   (  segid "    " and resid 85   and name HD% )
      3.600     1.600     1.600 peak   905 spectrum    1 weight  0.10000E+01 volume  0.36202E-03 ppm1      2.754 ppm2      6.041 CV     1
 ASSI {  907}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 121  and name HA  ))
      3.500     1.600     1.600 peak   907 spectrum    1 weight  0.10000E+01 volume  0.10930E-02 ppm1      2.753 ppm2      4.871 CV     1
 ASSI {  908}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 121  and name HB2 ))
      1.900     0.400     0.400 peak   908 spectrum    1 weight  0.10000E+01 volume  0.58459E-02 ppm1      2.753 ppm2      2.528 CV     1
 ASSI {  909}
   (( segid "    " and resid 121  and name HB1 ))
   (  segid "    " and resid 41   and name HB% )
      3.200     1.300     1.300 peak   909 spectrum    1 weight  0.10000E+01 volume  0.16353E-02 ppm1      2.761 ppm2      1.477 CV     1
 ASSI {  914}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 121  and name HD1 ))
      4.000     2.000     2.000 peak   914 spectrum    1 weight  0.10000E+01 volume  0.77696E-03 ppm1      2.521 ppm2      6.397 CV     1
 ASSI {  915}
   (( segid "    " and resid 121  and name HB2 ))
   (  segid "    " and resid 85   and name HD% )
      4.400     2.500     1.600 peak   915 spectrum    1 weight  0.10000E+01 volume  0.40284E-03 ppm1      2.518 ppm2      6.042 CV     1
 ASSI {  920}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 121  and name HA  ))
      2.800     1.000     1.000 peak   920 spectrum    1 weight  0.10000E+01 volume  0.15062E-02 ppm1      2.502 ppm2      4.870 CV     1
 ASSI {  923}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 107  and name HN  ))
      3.900     1.900     1.900 peak   923 spectrum    1 weight  0.10000E+01 volume  0.43527E-03 ppm1      2.493 ppm2      7.203 CV     1
 ASSI {  925}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 99   and name HA  ))
      3.500     1.500     1.500 peak   925 spectrum    1 weight  0.10000E+01 volume  0.26076E-02 ppm1      2.493 ppm2      5.035 CV     1
 ASSI {  929}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HB2 ))
      1.900     0.500     0.500 peak   929 spectrum    1 weight  0.10000E+01 volume  0.66282E-02 ppm1      2.500 ppm2      1.407 CV     1
 ASSI {  930}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 65   and name HB2 ))
      3.300     1.400     1.400 peak   930 spectrum    1 weight  0.10000E+01 volume  0.25095E-02 ppm1      2.495 ppm2      0.644 CV     1
 ASSI {  932}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 110  and name HN  ))
      2.700     0.900     0.900 peak   932 spectrum    1 weight  0.10000E+01 volume  0.27143E-02 ppm1      2.279 ppm2      8.671 CV     1
 ASSI {  933}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HA  ))
      2.200     0.600     0.600 peak   933 spectrum    1 weight  0.10000E+01 volume  0.62868E-02 ppm1      2.274 ppm2      4.224 CV     1
 ASSI {  934}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HD2 ))
      3.300     1.300     1.300 peak   934 spectrum    1 weight  0.10000E+01 volume  0.30194E-02 ppm1      2.253 ppm2      3.680 CV     1
 ASSI {  939}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 31   and name HN  ))
      3.300     1.300     1.300 peak   939 spectrum    1 weight  0.10000E+01 volume  0.23081E-02 ppm1      2.069 ppm2      8.883 CV     1
 ASSI {  940}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 32   and name HN  ))
      3.900     1.900     1.900 peak   940 spectrum    1 weight  0.10000E+01 volume  0.79579E-03 ppm1      2.071 ppm2      8.707 CV     1
 ASSI {  942}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 30   and name HA  ))
      4.400     2.500     1.600 peak   942 spectrum    1 weight  0.10000E+01 volume  0.93441E-03 ppm1      2.074 ppm2      4.937 CV     1
 ASSI {  943}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 31   and name HA  ))
      2.500     0.800     0.800 peak   943 spectrum    1 weight  0.10000E+01 volume  0.36334E-02 ppm1      2.070 ppm2      4.722 CV     1
 ASSI {  947}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 93   and name HA1 ))
      3.300     1.300     1.300 peak   947 spectrum    1 weight  0.10000E+01 volume  0.45827E-02 ppm1      2.040 ppm2      4.411 CV     1
 ASSI {  949}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 92   and name HB1 ))
      3.600     1.600     1.600 peak   949 spectrum    1 weight  0.10000E+01 volume  0.83199E-03 ppm1      2.027 ppm2      3.175 CV     1
 ASSI {  950}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 40   and name HN  ))
      2.600     0.800     0.800 peak   950 spectrum    1 weight  0.10000E+01 volume  0.32932E-02 ppm1      2.010 ppm2      9.081 CV     1
 ASSI {  954}
   (( segid "    " and resid 40   and name HB  ))
   (  segid "    " and resid 40   and name HG2%)
      2.200     0.600     0.600 peak   954 spectrum    1 weight  0.10000E+01 volume  0.12147E-01 ppm1      2.013 ppm2      1.234 CV     1
 OR {  954}
   (( segid "    " and resid 40   and name HB  ))
   (  segid "    " and resid 40   and name HG1%)
 ASSI {  965}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 124  and name HB1 ))
      4.500     2.500     1.500 peak   965 spectrum    1 weight  0.10000E+01 volume  0.46058E-03 ppm1      1.776 ppm2      2.645 CV     1
 OR {  965}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 124  and name HB1 ))
 ASSI {  968}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 63   and name HB2 ))
      4.500     2.500     1.500 peak   968 spectrum    1 weight  0.10000E+01 volume  0.24166E-03 ppm1      1.514 ppm2      2.655 CV     1
 ASSI {  971}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 65   and name HG  ))
      4.000     2.000     2.000 peak   971 spectrum    1 weight  0.10000E+01 volume  0.35839E-03 ppm1      1.441 ppm2      1.229 CV     1
 ASSI {  972}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HN  ))
      2.800     0.900     0.900 peak   972 spectrum    1 weight  0.10000E+01 volume  0.18289E-02 ppm1      1.428 ppm2      8.554 CV     1
 ASSI {  973}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 106  and name HN  ))
      4.000     2.000     2.000 peak   973 spectrum    1 weight  0.10000E+01 volume  0.76900E-03 ppm1      1.422 ppm2      8.285 CV     1
 ASSI {  974}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 105  and name HN  ))
      3.800     1.800     1.800 peak   974 spectrum    1 weight  0.10000E+01 volume  0.78699E-03 ppm1      1.420 ppm2      7.729 CV     1
 ASSI {  982}
   (( segid "    " and resid 104  and name HB2 ))
   (  segid "    " and resid 100  and name HG2%)
      2.800     1.000     1.000 peak   982 spectrum    1 weight  0.10000E+01 volume  0.20923E-02 ppm1      1.428 ppm2      0.880 CV     1
 ASSI {  984}
   (( segid "    " and resid 104  and name HB2 ))
   (  segid "    " and resid 65   and name HD2%)
      3.400     1.500     1.500 peak   984 spectrum    1 weight  0.10000E+01 volume  0.66133E-03 ppm1      1.422 ppm2      0.414 CV     1
 ASSI {  987}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      5.100     3.200     0.900 peak   987 spectrum    1 weight  0.10000E+01 volume  0.34089E-03 ppm1      1.273 ppm2      7.984 CV     1
 ASSI {  988}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
      4.400     2.400     1.600 peak   988 spectrum    1 weight  0.10000E+01 volume  0.47168E-03 ppm1      1.279 ppm2      5.690 CV     1
 ASSI {  989}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 77   and name HA  ))
      3.700     1.700     1.700 peak   989 spectrum    1 weight  0.10000E+01 volume  0.16020E-02 ppm1      1.277 ppm2      4.701 CV     1
 ASSI {  990}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
      3.000     1.200     1.200 peak   990 spectrum    1 weight  0.10000E+01 volume  0.10424E-02 ppm1      1.278 ppm2      2.710 CV     1
 OR {  990}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HE1 ))
 ASSI {  991}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 71   and name HG2 ))
      3.900     1.900     1.900 peak   991 spectrum    1 weight  0.10000E+01 volume  0.50108E-03 ppm1      1.284 ppm2      1.865 CV     1
 OR {  991}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI {  992}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HG1 ))
      3.600     1.600     1.600 peak   992 spectrum    1 weight  0.10000E+01 volume  0.91431E-03 ppm1      1.286 ppm2      0.948 CV     1
 ASSI {  993}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HD2 ))
      3.600     1.600     1.600 peak   993 spectrum    1 weight  0.10000E+01 volume  0.79410E-03 ppm1      1.274 ppm2      0.307 CV     1
 ASSI {  994}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HG2 ))
      3.100     1.200     1.200 peak   994 spectrum    1 weight  0.10000E+01 volume  0.94572E-03 ppm1      1.279 ppm2     -0.569 CV     1
 ASSI {  995}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HB2 ))
      2.000     0.500     0.500 peak   995 spectrum    1 weight  0.10000E+01 volume  0.37173E-02 ppm1      1.282 ppm2     -0.804 CV     1
 ASSI {  996}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
      4.300     2.300     1.700 peak   996 spectrum    1 weight  0.10000E+01 volume  0.59536E-03 ppm1      1.266 ppm2      9.091 CV     1
 ASSI {  997}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 88   and name HN  ))
      5.600     3.900     0.400 peak   997 spectrum    1 weight  0.10000E+01 volume  0.28629E-03 ppm1      1.260 ppm2      7.332 CV     1
 ASSI { 1000}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 77   and name HE1 ))
      4.700     2.700     1.300 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.33527E-03 ppm1     -0.780 ppm2      9.106 CV     1
 ASSI { 1001}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 77   and name HA  ))
      4.100     2.100     1.900 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.11054E-02 ppm1     -0.787 ppm2      4.703 CV     1
 ASSI { 1005}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 77   and name HH2 ))
      5.100     3.300     0.900 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.37684E-03 ppm1     -0.802 ppm2      6.636 CV     1
 ASSI { 1006}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
      4.900     3.000     1.100 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.57976E-03 ppm1     -0.804 ppm2      5.690 CV     1
 ASSI { 1007}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
      3.000     1.100     1.100 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.13062E-02 ppm1     -0.800 ppm2      2.712 CV     1
 OR { 1007}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HE1 ))
 ASSI { 1008}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
      2.100     0.500     0.500 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.40598E-02 ppm1     -0.805 ppm2      1.307 CV     1
 OR { 1008}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HD1 ))
 ASSI { 1017}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 19   and name HA  ))
      4.600     2.600     1.400 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.73692E-03 ppm1      2.466 ppm2      4.442 CV     1
 ASSI { 1018}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 103  and name HA  ))
      4.000     2.000     2.000 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.12030E-02 ppm1      2.465 ppm2      4.014 CV     1
 ASSI { 1021}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
      3.900     1.900     1.900 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.49513E-03 ppm1      2.404 ppm2      7.863 CV     1
 ASSI { 1024}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HD2 ))
      4.000     2.000     2.000 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.85486E-03 ppm1      2.412 ppm2      3.060 CV     1
 ASSI { 1025}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HB1 ))
      1.800     0.400     0.400 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.82307E-02 ppm1      2.406 ppm2      1.484 CV     1
 ASSI { 1026}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 96   and name HG11))
      5.100     3.200     0.900 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.42574E-03 ppm1      2.404 ppm2      1.132 CV     1
 OR { 1026}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 96   and name HG12))
 ASSI { 1028}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
      2.800     1.000     1.000 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.32051E-02 ppm1      2.395 ppm2      4.760 CV     1
 ASSI { 1029}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HD1 ))
      4.100     2.100     1.900 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.86465E-03 ppm1      2.394 ppm2      3.873 CV     1
 ASSI { 1030}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 96   and name HG2%)
      4.800     2.800     1.200 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.61506E-03 ppm1      2.392 ppm2      0.314 CV     1
 ASSI { 1034}
   (( segid "    " and resid 50   and name HB2 ))
   (  segid "    " and resid 55   and name HE% )
      2.900     1.000     1.000 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.28241E-02 ppm1      2.287 ppm2      7.199 CV     1
 OR { 1034}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 55   and name HE% )
 ASSI { 1037}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.000     1.100     1.100 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.21391E-02 ppm1      2.254 ppm2      8.444 CV     1
 OR { 1037}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 1038}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HA  ))
      2.200     0.600     0.600 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.13706E-01 ppm1      2.258 ppm2      4.409 CV     1
 OR { 1038}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 1040}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HB2 ))
      1.300     0.200     0.900 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.48597E-01 ppm1      2.263 ppm2      1.892 CV     1
 OR { 1040}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HG1 ))
 ASSI { 1051}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HB2 ))
      2.000     0.500     0.500 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.57126E-02 ppm1      2.052 ppm2      1.663 CV     1
 ASSI { 1054}
   (( segid "    " and resid 24   and name HB1 ))
   (  segid "    " and resid 99   and name HE% )
      2.700     0.900     0.900 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.22235E-02 ppm1      1.965 ppm2      6.619 CV     1
 ASSI { 1057}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 24   and name HB2 ))
      1.700     0.300     0.500 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.15964E-01 ppm1      1.972 ppm2      1.691 CV     1
 ASSI { 1064}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 126  and name HN  ))
      3.400     1.500     1.500 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.29937E-02 ppm1      1.745 ppm2      8.299 CV     1
 ASSI { 1066}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 126  and name HA  ))
      2.500     0.800     0.800 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.57918E-02 ppm1      1.744 ppm2      4.025 CV     1
 ASSI { 1067}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 126  and name HG2 ))
      2.500     0.800     0.800 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.62670E-02 ppm1      1.752 ppm2      1.334 CV     1
 OR { 1067}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 126  and name HG1 ))
 ASSI { 1071}
   (( segid "    " and resid 77   and name HB2 ))
   (  segid "    " and resid 84   and name HE% )
      3.400     1.400     1.400 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.75236E-03 ppm1      1.677 ppm2      6.237 CV     1
 ASSI { 1075}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 24   and name HA  ))
      2.500     0.800     0.800 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.56791E-02 ppm1      1.673 ppm2      4.156 CV     1
 ASSI { 1076}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 24   and name HD2 ))
      3.600     1.700     1.700 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.25666E-02 ppm1      1.672 ppm2      3.808 CV     1
 ASSI { 1083}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 86   and name HB2 ))
      5.400     3.600     0.600 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.32630E-03 ppm1      1.654 ppm2     -0.827 CV     1
 ASSI { 1086}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 72   and name HN  ))
      4.000     2.000     2.000 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.10048E-02 ppm1      1.471 ppm2      8.745 CV     1
 ASSI { 1091}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HA  ))
      2.400     0.700     0.700 peak  1091 spectrum    1 weight  0.10000E+01 volume  0.31272E-02 ppm1      1.463 ppm2      4.823 CV     1
 ASSI { 1096}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 96   and name HG2%)
      4.000     2.000     2.000 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.65683E-03 ppm1      1.469 ppm2      0.305 CV     1
 ASSI { 1100}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 92   and name HN  ))
      3.100     1.200     1.200 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.24106E-02 ppm1      3.136 ppm2      7.549 CV     1
 OR { 1100}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 92   and name HD1 ))
 ASSI { 1101}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 92   and name HE3 ))
      2.900     1.000     1.000 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.13907E-02 ppm1      3.132 ppm2      7.331 CV     1
 ASSI { 1103}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 92   and name HA  ))
      3.300     1.300     1.300 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.21321E-02 ppm1      3.136 ppm2      4.565 CV     1
 ASSI { 1104}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 91   and name HA  ))
      4.500     2.600     1.500 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.48184E-03 ppm1      3.136 ppm2      4.052 CV     1
 ASSI { 1105}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 92   and name HB2 ))
      2.000     0.500     0.500 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.62026E-02 ppm1      3.141 ppm2      2.922 CV     1
 ASSI { 1106}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 86   and name HE1 ))
      4.400     2.400     1.600 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.82035E-03 ppm1      3.136 ppm2      2.686 CV     1
 ASSI { 1107}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 86   and name HE2 ))
      4.500     2.600     1.500 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.47569E-03 ppm1      3.142 ppm2      2.158 CV     1
 ASSI { 1108}
   (( segid "    " and resid 92   and name HB1 ))
   (  segid "    " and resid 32   and name HB% )
      4.400     2.400     1.600 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.44085E-03 ppm1      3.144 ppm2      1.694 CV     1
 ASSI { 1109}
   (( segid "    " and resid 92   and name HB1 ))
   (  segid "    " and resid 40   and name HG2%)
      3.100     1.200     1.200 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.15754E-02 ppm1      3.138 ppm2      1.222 CV     1
 OR { 1109}
   (( segid "    " and resid 92   and name HB1 ))
   (  segid "    " and resid 40   and name HG1%)
 ASSI { 1111}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 91   and name HB2 ))
      4.200     2.200     1.800 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.40970E-03 ppm1      3.129 ppm2      3.871 CV     1
 ASSI { 1112}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 86   and name HE1 ))
      3.900     1.900     1.900 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.47701E-03 ppm1      2.975 ppm2      2.699 CV     1
 ASSI { 1113}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HD1 ))
      2.800     1.000     1.000 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.24023E-02 ppm1      2.961 ppm2      7.548 CV     1
 OR { 1113}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HN  ))
 ASSI { 1116}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HA  ))
      2.900     1.100     1.100 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.17103E-02 ppm1      2.961 ppm2      4.563 CV     1
 ASSI { 1117}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 91   and name HB2 ))
      4.400     2.400     1.600 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.26464E-03 ppm1      2.959 ppm2      3.856 CV     1
 ASSI { 1119}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 86   and name HE2 ))
      3.300     1.400     1.400 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.42731E-03 ppm1      2.963 ppm2      2.167 CV     1
 ASSI { 1120}
   (( segid "    " and resid 92   and name HB2 ))
   (  segid "    " and resid 32   and name HB% )
      4.400     2.400     1.600 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.94420E-03 ppm1      2.958 ppm2      1.755 CV     1
 ASSI { 1121}
   (( segid "    " and resid 92   and name HB2 ))
   (  segid "    " and resid 40   and name HG2%)
      3.400     1.400     1.400 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.20282E-02 ppm1      2.960 ppm2      1.221 CV     1
 OR { 1121}
   (( segid "    " and resid 92   and name HB2 ))
   (  segid "    " and resid 40   and name HG1%)
 ASSI { 1122}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 86   and name HD2 ))
      4.400     2.400     1.600 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.30408E-03 ppm1      2.960 ppm2      0.295 CV     1
 ASSI { 1123}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
      4.100     2.100     1.900 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.46202E-03 ppm1      2.946 ppm2      4.050 CV     1
 ASSI { 1126}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HN  ))
      3.100     1.200     1.200 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.38272E-02 ppm1      2.474 ppm2      8.161 CV     1
 ASSI { 1129}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 100  and name HA  ))
      2.800     1.000     1.000 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.14900E-02 ppm1      2.463 ppm2      3.535 CV     1
 ASSI { 1130}
   (( segid "    " and resid 100  and name HB  ))
   (  segid "    " and resid 100  and name HG2%)
      2.000     0.500     0.500 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.12345E-01 ppm1      2.468 ppm2      0.900 CV     1
 OR { 1130}
   (( segid "    " and resid 100  and name HB  ))
   (  segid "    " and resid 100  and name HG1%)
 ASSI { 1133}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 89   and name HA  ))
      3.800     1.800     1.800 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.15672E-02 ppm1      2.395 ppm2      4.047 CV     1
 ASSI { 1136}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HG1 ))
      2.500     0.800     0.800 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.43044E-02 ppm1      2.397 ppm2      1.890 CV     1
 OR { 1136}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI { 1141}
   (( segid "    " and resid 131  and name HB1 ))
   (  segid "    " and resid 117  and name HG2%)
      2.800     1.000     1.000 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.24156E-02 ppm1      2.237 ppm2      1.407 CV     1
 ASSI { 1142}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 131  and name HD2 ))
      4.300     2.300     1.700 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.98643E-03 ppm1      2.211 ppm2      3.682 CV     1
 ASSI { 1143}
   (( segid "    " and resid 77   and name HB1 ))
   (  segid "    " and resid 84   and name HD% )
      2.900     1.100     1.100 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.21969E-02 ppm1      2.009 ppm2      6.912 CV     1
 ASSI { 1145}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HB1 ))
      1.700     0.400     0.500 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.18195E-01 ppm1      2.006 ppm2      2.224 CV     1
 ASSI { 1147}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HD2 ))
      3.700     1.700     1.700 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.13257E-02 ppm1      1.991 ppm2      3.687 CV     1
 ASSI { 1156}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HA  ))
      2.900     1.000     1.000 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.13365E-02 ppm1      2.488 ppm2      4.650 CV     1
 ASSI { 1161}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 85   and name HD% )
      4.000     2.000     2.000 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.34008E-03 ppm1      2.402 ppm2      6.005 CV     1
 ASSI { 1165}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HE  ))
      3.900     1.900     1.900 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.46388E-03 ppm1      1.938 ppm2      7.265 CV     1
 ASSI { 1167}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 7    and name HN  ))
      4.100     2.100     1.900 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.92574E-03 ppm1      1.928 ppm2      7.618 CV     1
 ASSI { 1168}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HA  ))
      2.900     1.000     1.000 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.21265E-02 ppm1      1.916 ppm2      4.921 CV     1
 ASSI { 1170}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HD1 ))
      3.000     1.100     1.100 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.27290E-02 ppm1      1.927 ppm2      3.163 CV     1
 OR { 1170}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HD2 ))
 ASSI { 1176}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HN  ))
      2.700     0.900     0.900 peak  1176 spectrum    1 weight  0.10000E+01 volume  0.26402E-02 ppm1      1.846 ppm2      9.019 CV     1
 ASSI { 1177}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HD1 ))
      2.800     1.000     1.000 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.51536E-02 ppm1      1.843 ppm2      3.220 CV     1
 OR { 1177}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HD2 ))
 ASSI { 1179}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HE  ))
      4.200     2.200     1.800 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.37208E-03 ppm1      1.836 ppm2      7.260 CV     1
 ASSI { 1185}
   (( segid "    " and resid 39   and name HB1 ))
   (  segid "    " and resid 85   and name HD% )
      3.500     1.500     1.500 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.48312E-03 ppm1      2.487 ppm2      6.000 CV     1
 ASSI { 1196}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 18   and name HN  ))
      3.000     1.100     1.100 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.17631E-02 ppm1      2.378 ppm2      7.765 CV     1
 ASSI { 1201}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 19   and name HN  ))
      3.600     1.600     1.600 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.77486E-03 ppm1      2.359 ppm2      7.586 CV     1
 ASSI { 1206}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HA  ))
      2.900     1.000     1.000 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.25726E-02 ppm1      2.249 ppm2      4.309 CV     1
 ASSI { 1209}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 16   and name HD2 ))
      3.800     1.800     1.800 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.13110E-02 ppm1      2.059 ppm2      3.112 CV     1
 ASSI { 1210}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 16   and name HB2 ))
      1.600     0.300     0.600 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.14524E-01 ppm1      2.061 ppm2      1.673 CV     1
 OR { 1210}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 1218}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
      4.800     2.900     1.200 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.54083E-03 ppm1      1.736 ppm2      5.047 CV     1
 ASSI { 1219}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HB1 ))
      1.700     0.300     0.500 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.10912E-01 ppm1      1.733 ppm2      2.031 CV     1
 ASSI { 1224}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 18   and name HA  ))
      3.200     1.200     1.200 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.20993E-02 ppm1      2.380 ppm2      4.361 CV     1
 ASSI { 1226}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 72   and name HN  ))
      2.900     1.000     1.000 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.19224E-02 ppm1      2.304 ppm2      8.732 CV     1
 ASSI { 1227}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 73   and name HN  ))
      3.900     1.900     1.900 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.41608E-03 ppm1      2.298 ppm2      8.088 CV     1
 ASSI { 1228}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 72   and name HA  ))
      3.100     1.200     1.200 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.28635E-02 ppm1      2.303 ppm2      4.628 CV     1
 ASSI { 1230}
   (( segid "    " and resid 72   and name HB1 ))
   (  segid "    " and resid 95   and name HG2%)
      4.800     2.900     1.200 peak  1230 spectrum    1 weight  0.10000E+01 volume  0.37975E-03 ppm1      2.309 ppm2      1.062 CV     1
 ASSI { 1231}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 95   and name HB  ))
      3.700     1.800     1.800 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.73671E-03 ppm1      2.287 ppm2      3.750 CV     1
 ASSI { 1232}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 95   and name HN  ))
      4.100     2.200     1.900 peak  1232 spectrum    1 weight  0.10000E+01 volume  0.65559E-03 ppm1      2.268 ppm2      8.509 CV     1
 ASSI { 1235}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 27   and name HB1 ))
      2.800     1.000     1.000 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.90097E-02 ppm1      2.278 ppm2      1.951 CV     1
 OR { 1235}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 27   and name HG2 ))
 ASSI { 1239}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 96   and name HG11))
      4.500     2.500     1.500 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.56275E-03 ppm1      2.264 ppm2      1.140 CV     1
 OR { 1239}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 96   and name HG12))
 ASSI { 1240}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HN  ))
      3.000     1.200     1.200 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.15280E-02 ppm1      2.246 ppm2      7.820 CV     1
 ASSI { 1241}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 14   and name HB2 ))
      4.600     2.700     1.400 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.39187E-03 ppm1      2.241 ppm2      1.317 CV     1
 ASSI { 1242}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 74   and name HD22))
      4.200     2.200     1.800 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.38872E-03 ppm1      2.235 ppm2      6.879 CV     1
 OR { 1242}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 74   and name HD22))
 ASSI { 1244}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
      4.400     2.500     1.600 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.56853E-03 ppm1      2.186 ppm2      8.085 CV     1
 ASSI { 1245}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 72   and name HA  ))
      2.700     0.900     0.900 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.26107E-02 ppm1      2.186 ppm2      4.632 CV     1
 ASSI { 1251}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 106  and name HA  ))
      4.900     3.000     1.100 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.51817E-03 ppm1      2.074 ppm2      4.805 CV     1
 ASSI { 1252}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 16   and name HN  ))
      3.100     1.200     1.200 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.39603E-02 ppm1      2.054 ppm2      8.510 CV     1
 ASSI { 1262}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 100  and name HA  ))
      4.000     2.000     2.000 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.75962E-03 ppm1      2.040 ppm2      3.524 CV     1
 ASSI { 1272}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HN  ))
      2.500     0.800     0.800 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.24003E-02 ppm1      1.728 ppm2      8.565 CV     1
 ASSI { 1273}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HA  ))
      2.900     1.100     1.100 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.33454E-02 ppm1      1.730 ppm2      3.698 CV     1
 ASSI { 1309}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 126  and name HD2 ))
      2.900     1.100     1.100 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.28927E-02 ppm1      1.913 ppm2      1.618 CV     1
 OR { 1309}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 126  and name HD2 ))
 OR { 1309}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 126  and name HD1 ))
 ASSI { 1317}
   (( segid "    " and resid 42   and name HG  ))
   (  segid "    " and resid 54   and name HE% )
      4.200     2.200     1.800 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.97747E-03 ppm1      1.774 ppm2      7.190 CV     1
 ASSI { 1318}
   (( segid "    " and resid 42   and name HG  ))
   (( segid "    " and resid 42   and name HA  ))
      3.000     1.100     1.100 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.23081E-02 ppm1      1.777 ppm2      5.368 CV     1
 ASSI { 1323}
   (( segid "    " and resid 42   and name HG  ))
   (  segid "    " and resid 42   and name HD1%)
      2.100     0.600     0.600 peak  1323 spectrum    1 weight  0.10000E+01 volume  0.99175E-02 ppm1      1.778 ppm2      0.971 CV     1
 OR { 1323}
   (( segid "    " and resid 42   and name HG  ))
   (  segid "    " and resid 42   and name HD2%)
 ASSI { 1326}
   (( segid "    " and resid 42   and name HG  ))
   (( segid "    " and resid 77   and name HZ3 ))
      3.600     1.700     1.700 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.46739E-03 ppm1      1.769 ppm2      6.326 CV     1
 ASSI { 1333}
   (( segid "    " and resid 126  and name HD2 ))
   (( segid "    " and resid 121  and name HZ2 ))
      4.300     2.300     1.700 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.85721E-03 ppm1      1.658 ppm2      7.188 CV     1
 OR { 1333}
   (( segid "    " and resid 126  and name HD1 ))
   (( segid "    " and resid 121  and name HZ2 ))
 ASSI { 1336}
   (( segid "    " and resid 139  and name HD1 ))
   (( segid "    " and resid 139  and name HA  ))
      3.800     1.800     1.800 peak  1336 spectrum    1 weight  0.10000E+01 volume  0.15034E-02 ppm1      1.651 ppm2      4.920 CV     1
 ASSI { 1344}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 106  and name HD21))
      4.000     2.000     2.000 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.58059E-03 ppm1      1.833 ppm2      7.601 CV     1
 ASSI { 1353}
   (( segid "    " and resid 42   and name HG  ))
   (( segid "    " and resid 43   and name HE1 ))
      4.300     2.300     1.700 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.67421E-03 ppm1      1.775 ppm2      2.881 CV     1
 OR { 1353}
   (( segid "    " and resid 42   and name HG  ))
   (( segid "    " and resid 43   and name HE2 ))
 ASSI { 1357}
   (( segid "    " and resid 126  and name HD2 ))
   (( segid "    " and resid 126  and name HA  ))
      3.700     1.700     1.700 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.24128E-02 ppm1      1.640 ppm2      4.045 CV     1
 OR { 1357}
   (( segid "    " and resid 126  and name HD1 ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 1358}
   (( segid "    " and resid 126  and name HD1 ))
   (( segid "    " and resid 126  and name HE2 ))
      2.300     0.600     0.600 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.78984E-02 ppm1      1.638 ppm2      2.992 CV     1
 OR { 1358}
   (( segid "    " and resid 126  and name HD2 ))
   (( segid "    " and resid 126  and name HE1 ))
 OR { 1358}
   (( segid "    " and resid 126  and name HD1 ))
   (( segid "    " and resid 126  and name HE1 ))
 OR { 1358}
   (( segid "    " and resid 126  and name HD2 ))
   (( segid "    " and resid 126  and name HE2 ))
 ASSI { 1391}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 63   and name HA  ))
      3.700     1.700     1.700 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.15993E-02 ppm1      0.766 ppm2      4.665 CV     1
 ASSI { 1392}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HE2 ))
      3.100     1.200     1.200 peak  1392 spectrum    1 weight  0.10000E+01 volume  0.31353E-02 ppm1      0.763 ppm2      2.377 CV     1
 OR { 1392}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HE1 ))
 ASSI { 1393}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HB1 ))
      2.700     0.900     0.900 peak  1393 spectrum    1 weight  0.10000E+01 volume  0.42355E-02 ppm1      0.772 ppm2      1.031 CV     1
 ASSI { 1394}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HG2 ))
      1.800     0.400     0.400 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.11153E-01 ppm1      0.773 ppm2     -0.199 CV     1
 ASSI { 1400}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HE1 ))
      3.000     1.100     1.100 peak  1400 spectrum    1 weight  0.10000E+01 volume  0.37173E-02 ppm1     -0.145 ppm2      2.378 CV     1
 OR { 1400}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HE2 ))
 ASSI { 1401}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HB1 ))
      2.400     0.700     0.700 peak  1401 spectrum    1 weight  0.10000E+01 volume  0.37998E-02 ppm1     -0.137 ppm2      1.032 CV     1
 ASSI { 1402}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HG1 ))
      1.700     0.400     0.500 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.14361E-01 ppm1     -0.146 ppm2      0.738 CV     1
 OR { 1402}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI { 1413}
   (( segid "    " and resid 86   and name HD1 ))
   (( segid "    " and resid 86   and name HE1 ))
      3.100     1.200     1.200 peak  1413 spectrum    1 weight  0.10000E+01 volume  0.12837E-02 ppm1      1.364 ppm2      2.676 CV     1
 OR { 1413}
   (( segid "    " and resid 86   and name HD1 ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 1414}
   (( segid "    " and resid 86   and name HD1 ))
   (( segid "    " and resid 86   and name HG1 ))
      3.800     1.800     1.800 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.75789E-03 ppm1      1.362 ppm2      0.975 CV     1
 ASSI { 1415}
   (( segid "    " and resid 86   and name HD1 ))
   (( segid "    " and resid 86   and name HD2 ))
      2.000     0.500     0.500 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.38470E-02 ppm1      1.361 ppm2      0.277 CV     1
 ASSI { 1416}
   (( segid "    " and resid 86   and name HD1 ))
   (( segid "    " and resid 86   and name HG2 ))
      2.900     1.100     1.100 peak  1416 spectrum    1 weight  0.10000E+01 volume  0.10401E-02 ppm1      1.366 ppm2     -0.605 CV     1
 ASSI { 1417}
   (( segid "    " and resid 86   and name HD1 ))
   (( segid "    " and resid 86   and name HB2 ))
      3.700     1.700     1.700 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.83240E-03 ppm1      1.369 ppm2     -0.835 CV     1
 ASSI { 1419}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HA  ))
      4.000     2.000     2.000 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.59821E-03 ppm1      0.765 ppm2      5.119 CV     1
 ASSI { 1422}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HN  ))
      5.300     3.500     0.700 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.36154E-03 ppm1      0.279 ppm2      8.482 CV     1
 ASSI { 1424}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 92   and name HB1 ))
      5.100     3.200     0.900 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.48617E-03 ppm1      0.279 ppm2      3.161 CV     1
 ASSI { 1425}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HE1 ))
      3.100     1.200     1.200 peak  1425 spectrum    1 weight  0.10000E+01 volume  0.15651E-02 ppm1      0.281 ppm2      2.680 CV     1
 OR { 1425}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 1427}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HD1 ))
      2.000     0.500     0.500 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.44758E-02 ppm1      0.285 ppm2      1.334 CV     1
 OR { 1427}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 1428}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HB2 ))
      3.100     1.200     1.200 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.10447E-02 ppm1      0.287 ppm2     -0.831 CV     1
 ASSI { 1429}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 92   and name HD1 ))
      3.900     1.900     1.900 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.43717E-03 ppm1      0.273 ppm2      7.539 CV     1
 ASSI { 1430}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 88   and name HN  ))
      4.400     2.500     1.600 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.37408E-03 ppm1      0.267 ppm2      7.319 CV     1
 ASSI { 1433}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HG1 ))
      3.100     1.200     1.200 peak  1433 spectrum    1 weight  0.10000E+01 volume  0.75814E-03 ppm1      0.265 ppm2      0.974 CV     1
 ASSI { 1435}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HG2 ))
      3.500     1.500     1.500 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.11383E-02 ppm1      0.268 ppm2     -0.603 CV     1
 ASSI { 1439}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 65   and name HN  ))
      5.000     3.100     1.000 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.31023E-03 ppm1     -0.157 ppm2      8.519 CV     1
 ASSI { 1441}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 21   and name HN  ))
      3.600     1.600     1.600 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.80070E-03 ppm1      2.209 ppm2      8.189 CV     1
 ASSI { 1442}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 21   and name HN  ))
      3.600     1.600     1.600 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.11271E-02 ppm1      2.142 ppm2      8.221 CV     1
 ASSI { 1448}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 109  and name HD2 ))
      1.900     0.500     0.500 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.13945E-01 ppm1      2.121 ppm2      3.689 CV     1
 ASSI { 1449}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 109  and name HG1 ))
      1.400     0.200     0.800 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.31340E-01 ppm1      2.128 ppm2      1.881 CV     1
 ASSI { 1453}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 16   and name HD2 ))
      3.300     1.300     1.300 peak  1453 spectrum    1 weight  0.10000E+01 volume  0.10042E-02 ppm1      2.115 ppm2      3.102 CV     1
 ASSI { 1455}
   (( segid "    " and resid 103  and name HB2 ))
   (  segid "    " and resid 100  and name HG1%)
      4.000     2.000     2.000 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.13636E-02 ppm1      2.115 ppm2      0.890 CV     1
 OR { 1455}
   (( segid "    " and resid 103  and name HB2 ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 1486}
   (( segid "    " and resid 109  and name HG1 ))
   (  segid "    " and resid 112  and name HE% )
      4.200     2.200     1.800 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.57592E-03 ppm1      1.817 ppm2      6.371 CV     1
 ASSI { 1488}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 109  and name HA  ))
      3.000     1.100     1.100 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.30191E-02 ppm1      1.820 ppm2      4.215 CV     1
 ASSI { 1493}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 18   and name HN  ))
      4.600     2.600     1.400 peak  1493 spectrum    1 weight  0.10000E+01 volume  0.41037E-03 ppm1      1.813 ppm2      7.784 CV     1
 ASSI { 1496}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 109  and name HD1 ))
      2.500     0.800     0.800 peak  1496 spectrum    1 weight  0.10000E+01 volume  0.28706E-02 ppm1      1.810 ppm2      3.853 CV     1
 ASSI { 1498}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 106  and name HA  ))
      3.700     1.700     1.700 peak  1498 spectrum    1 weight  0.10000E+01 volume  0.22018E-02 ppm1      1.736 ppm2      4.848 CV     1
 ASSI { 1503}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 16   and name HD2 ))
      2.600     0.800     0.800 peak  1503 spectrum    1 weight  0.10000E+01 volume  0.60709E-02 ppm1      1.723 ppm2      3.143 CV     1
 ASSI { 1506}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 109  and name HB1 ))
      4.600     2.600     1.400 peak  1506 spectrum    1 weight  0.10000E+01 volume  0.42190E-03 ppm1      1.675 ppm2      2.243 CV     1
 ASSI { 1516}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 140  and name HN  ))
      4.100     2.100     1.900 peak  1516 spectrum    1 weight  0.10000E+01 volume  0.51536E-03 ppm1      1.300 ppm2      9.299 CV     1
 ASSI { 1518}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 115  and name HA  ))
      3.900     1.900     1.900 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.63029E-03 ppm1      1.308 ppm2      5.081 CV     1
 ASSI { 1521}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 114  and name HN  ))
      2.900     1.100     1.100 peak  1521 spectrum    1 weight  0.10000E+01 volume  0.10737E-02 ppm1      1.299 ppm2      8.826 CV     1
 ASSI { 1525}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 114  and name HA  ))
      3.200     1.300     1.300 peak  1525 spectrum    1 weight  0.10000E+01 volume  0.23675E-02 ppm1      1.292 ppm2      4.675 CV     1
 ASSI { 1527}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 114  and name HB2 ))
      2.400     0.700     0.700 peak  1527 spectrum    1 weight  0.10000E+01 volume  0.59289E-02 ppm1      1.289 ppm2      1.517 CV     1
 OR { 1527}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI { 1529}
   (( segid "    " and resid 114  and name HG  ))
   (  segid "    " and resid 114  and name HD1%)
      2.100     0.600     0.600 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.12050E-01 ppm1      1.300 ppm2      0.516 CV     1
 ASSI { 1531}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 138  and name HB  ))
      3.100     1.200     1.200 peak  1531 spectrum    1 weight  0.10000E+01 volume  0.83711E-03 ppm1      1.273 ppm2      3.973 CV     1
 ASSI { 1532}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 48   and name HB1 ))
      4.800     2.900     1.200 peak  1532 spectrum    1 weight  0.10000E+01 volume  0.36635E-03 ppm1      1.277 ppm2      3.561 CV     1
 ASSI { 1536}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 65   and name HN  ))
      4.100     2.100     1.900 peak  1536 spectrum    1 weight  0.10000E+01 volume  0.67108E-03 ppm1      1.237 ppm2      8.470 CV     1
 ASSI { 1541}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 56   and name HN  ))
      4.600     2.600     1.400 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.49224E-03 ppm1      1.223 ppm2      8.881 CV     1
 ASSI { 1544}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 11   and name HN  ))
      3.800     1.800     1.800 peak  1544 spectrum    1 weight  0.10000E+01 volume  0.11559E-02 ppm1      1.155 ppm2      8.729 CV     1
 ASSI { 1546}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 138  and name HA  ))
      3.200     1.300     1.300 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.12598E-02 ppm1      1.161 ppm2      5.275 CV     1
 ASSI { 1547}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 10   and name HA  ))
      3.300     1.400     1.400 peak  1547 spectrum    1 weight  0.10000E+01 volume  0.16815E-02 ppm1      1.166 ppm2      4.565 CV     1
 ASSI { 1548}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 138  and name HB  ))
      4.500     2.600     1.500 peak  1548 spectrum    1 weight  0.10000E+01 volume  0.48176E-03 ppm1      1.162 ppm2      3.979 CV     1
 ASSI { 1549}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 10   and name HB1 ))
      2.900     1.100     1.100 peak  1549 spectrum    1 weight  0.10000E+01 volume  0.34577E-02 ppm1      1.163 ppm2      1.815 CV     1
 ASSI { 1550}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 10   and name HB2 ))
      2.600     0.900     0.900 peak  1550 spectrum    1 weight  0.10000E+01 volume  0.36097E-02 ppm1      1.160 ppm2      1.457 CV     1
 ASSI { 1551}
   (( segid "    " and resid 10   and name HG  ))
   (  segid "    " and resid 10   and name HD2%)
      2.200     0.600     0.600 peak  1551 spectrum    1 weight  0.10000E+01 volume  0.11681E-01 ppm1      1.159 ppm2      0.935 CV     1
 ASSI { 1553}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 9    and name HB2 ))
      4.900     3.000     1.100 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.33460E-03 ppm1      1.149 ppm2      2.533 CV     1
 ASSI { 1557}
   (  segid "    " and resid 42   and name HD1%)
   (( segid "    " and resid 96   and name HG11))
      3.800     1.800     1.800 peak  1557 spectrum    1 weight  0.10000E+01 volume  0.24422E-02 ppm1      0.939 ppm2      1.165 CV     1
 OR { 1557}
   (  segid "    " and resid 42   and name HD1%)
   (( segid "    " and resid 96   and name HG12))
 ASSI { 1558}
   (  segid "    " and resid 42   and name HD1%)
   (( segid "    " and resid 69   and name HB  ))
      3.300     1.300     1.300 peak  1558 spectrum    1 weight  0.10000E+01 volume  0.99947E-03 ppm1      0.940 ppm2      0.652 CV     1
 ASSI { 1586}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 140  and name HN  ))
      3.400     1.500     1.500 peak  1586 spectrum    1 weight  0.10000E+01 volume  0.41101E-02 ppm1      0.635 ppm2      9.258 CV     1
 ASSI { 1591}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 140  and name HA  ))
      3.100     1.200     1.200 peak  1591 spectrum    1 weight  0.10000E+01 volume  0.18045E-02 ppm1      0.629 ppm2      5.390 CV     1
 ASSI { 1595}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 112  and name HB1 ))
      3.300     1.400     1.400 peak  1595 spectrum    1 weight  0.10000E+01 volume  0.85106E-02 ppm1      0.634 ppm2      2.698 CV     1
 ASSI { 1597}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 98   and name HB  ))
      2.200     0.600     0.600 peak  1597 spectrum    1 weight  0.10000E+01 volume  0.13365E-01 ppm1      0.627 ppm2      1.526 CV     1
 ASSI { 1602}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 112  and name HN  ))
      3.500     1.600     1.600 peak  1602 spectrum    1 weight  0.10000E+01 volume  0.11068E-02 ppm1      0.373 ppm2      9.444 CV     1
 ASSI { 1605}
   (( segid "    " and resid 140  and name HG  ))
   (  segid "    " and resid 112  and name HD% )
      3.200     1.300     1.300 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.10985E-02 ppm1      0.364 ppm2      6.816 CV     1
 ASSI { 1607}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 140  and name HA  ))
      3.300     1.300     1.300 peak  1607 spectrum    1 weight  0.10000E+01 volume  0.16530E-02 ppm1      0.372 ppm2      5.405 CV     1
 ASSI { 1620}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 56   and name HB2 ))
      4.000     2.000     2.000 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.16552E-02 ppm1      0.357 ppm2      1.538 CV     1
 ASSI { 1623}
   (( segid "    " and resid 51   and name HB1 ))
   (( segid "    " and resid 52   and name HA1 ))
      3.900     1.900     1.900 peak  1623 spectrum    1 weight  0.10000E+01 volume  0.41319E-03 ppm1      2.303 ppm2      4.062 CV     1
 ASSI { 1625}
   (( segid "    " and resid 51   and name HB1 ))
   (( segid "    " and resid 51   and name HN  ))
      3.600     1.600     1.600 peak  1625 spectrum    1 weight  0.10000E+01 volume  0.16923E-02 ppm1      2.265 ppm2      9.373 CV     1
 ASSI { 1627}
   (( segid "    " and resid 51   and name HB1 ))
   (( segid "    " and resid 51   and name HA  ))
      2.500     0.800     0.800 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.80016E-02 ppm1      2.260 ppm2      3.870 CV     1
 ASSI { 1629}
   (( segid "    " and resid 24   and name HG1 ))
   (  segid "    " and resid 99   and name HE% )
      3.400     1.400     1.400 peak  1629 spectrum    1 weight  0.10000E+01 volume  0.84830E-03 ppm1      2.229 ppm2      6.639 CV     1
 ASSI { 1630}
   (( segid "    " and resid 24   and name HG1 ))
   (( segid "    " and resid 23   and name HA  ))
      4.000     2.000     2.000 peak  1630 spectrum    1 weight  0.10000E+01 volume  0.15603E-02 ppm1      2.231 ppm2      4.541 CV     1
 ASSI { 1631}
   (( segid "    " and resid 24   and name HG1 ))
   (( segid "    " and resid 24   and name HB2 ))
      2.600     0.900     0.900 peak  1631 spectrum    1 weight  0.10000E+01 volume  0.48882E-02 ppm1      2.223 ppm2      1.723 CV     1
 ASSI { 1638}
   (( segid "    " and resid 24   and name HG2 ))
   (  segid "    " and resid 99   and name HE% )
      4.300     2.300     1.700 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.15233E-02 ppm1      2.126 ppm2      6.646 CV     1
 ASSI { 1643}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      4.300     2.300     1.700 peak  1643 spectrum    1 weight  0.10000E+01 volume  0.53443E-03 ppm1      2.022 ppm2      8.436 CV     1
 ASSI { 1644}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
      3.400     1.500     1.500 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.23184E-02 ppm1      2.026 ppm2      4.400 CV     1
 ASSI { 1650}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 51   and name HB1 ))
      1.600     0.300     0.600 peak  1650 spectrum    1 weight  0.10000E+01 volume  0.29254E-01 ppm1      1.993 ppm2      2.286 CV     1
 ASSI { 1656}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 16   and name HG2 ))
      1.500     0.300     0.700 peak  1656 spectrum    1 weight  0.10000E+01 volume  0.30194E-01 ppm1      1.860 ppm2      1.678 CV     1
 OR { 1656}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 16   and name HB2 ))
 ASSI { 1665}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 16   and name HE  ))
      2.900     1.100     1.100 peak  1665 spectrum    1 weight  0.10000E+01 volume  0.15917E-02 ppm1      1.713 ppm2      7.277 CV     1
 ASSI { 1667}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 15   and name HA  ))
      4.400     2.500     1.600 peak  1667 spectrum    1 weight  0.10000E+01 volume  0.10574E-02 ppm1      1.715 ppm2      5.087 CV     1
 ASSI { 1668}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 16   and name HB1 ))
      2.400     0.700     0.700 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.29375E-02 ppm1      1.719 ppm2      2.051 CV     1
 ASSI { 1669}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 16   and name HN  ))
      3.300     1.400     1.400 peak  1669 spectrum    1 weight  0.10000E+01 volume  0.26151E-02 ppm1      1.704 ppm2      8.551 CV     1
 ASSI { 1672}
   (( segid "    " and resid 16   and name HG2 ))
   (  segid "    " and resid 140  and name HD2%)
      2.900     1.000     1.000 peak  1672 spectrum    1 weight  0.10000E+01 volume  0.38796E-02 ppm1      1.704 ppm2      0.712 CV     1
 OR { 1672}
   (( segid "    " and resid 16   and name HG2 ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 1678}
   (( segid "    " and resid 33   and name HG  ))
   (( segid "    " and resid 33   and name HN  ))
      3.300     1.400     1.400 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.27010E-02 ppm1      1.606 ppm2      8.965 CV     1
 ASSI { 1681}
   (( segid "    " and resid 33   and name HG  ))
   (( segid "    " and resid 33   and name HA  ))
      2.900     1.000     1.000 peak  1681 spectrum    1 weight  0.10000E+01 volume  0.35975E-02 ppm1      1.600 ppm2      4.688 CV     1
 ASSI { 1683}
   (( segid "    " and resid 33   and name HG  ))
   (  segid "    " and resid 33   and name HD2%)
      2.100     0.500     0.500 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.17619E-01 ppm1      1.601 ppm2      0.876 CV     1
 ASSI { 1684}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 63   and name HN  ))
      3.300     1.400     1.400 peak  1684 spectrum    1 weight  0.10000E+01 volume  0.10713E-02 ppm1      1.587 ppm2      7.895 CV     1
 ASSI { 1687}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HG2 ))
      1.500     0.300     0.700 peak  1687 spectrum    1 weight  0.10000E+01 volume  0.25996E-01 ppm1      1.583 ppm2      1.394 CV     1
 ASSI { 1688}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HN  ))
      3.100     1.200     1.200 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.20278E-02 ppm1      1.579 ppm2      8.425 CV     1
 ASSI { 1689}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HD2 ))
      2.200     0.600     0.600 peak  1689 spectrum    1 weight  0.10000E+01 volume  0.13450E-01 ppm1      1.571 ppm2      3.161 CV     1
 OR { 1689}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HD1 ))
 ASSI { 1694}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 63   and name HN  ))
      3.800     1.800     1.800 peak  1694 spectrum    1 weight  0.10000E+01 volume  0.87625E-03 ppm1      1.396 ppm2      7.892 CV     1
 ASSI { 1697}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HD2 ))
      2.200     0.600     0.600 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.98936E-02 ppm1      1.394 ppm2      3.146 CV     1
 OR { 1697}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HD1 ))
 ASSI { 1701}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 112  and name HB1 ))
      4.400     2.400     1.600 peak  1701 spectrum    1 weight  0.10000E+01 volume  0.57097E-03 ppm1      1.290 ppm2      2.776 CV     1
 ASSI { 1705}
   (( segid "    " and resid 65   and name HG  ))
   (  segid "    " and resid 65   and name HD2%)
      2.200     0.600     0.600 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.87001E-02 ppm1      1.238 ppm2      0.418 CV     1
 ASSI { 1708}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 104  and name HB1 ))
      4.000     2.000     2.000 peak  1708 spectrum    1 weight  0.10000E+01 volume  0.42524E-03 ppm1      1.214 ppm2      2.548 CV     1
 ASSI { 1709}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 99   and name HA  ))
      3.500     1.500     1.500 peak  1709 spectrum    1 weight  0.10000E+01 volume  0.10191E-02 ppm1      1.040 ppm2      5.026 CV     1
 ASSI { 1711}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 24   and name HA  ))
      4.200     2.200     1.800 peak  1711 spectrum    1 weight  0.10000E+01 volume  0.93482E-03 ppm1      1.045 ppm2      4.151 CV     1
 ASSI { 1720}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 27   and name HD1 ))
      4.500     2.600     1.500 peak  1720 spectrum    1 weight  0.10000E+01 volume  0.68940E-03 ppm1      1.029 ppm2      3.508 CV     1
 OR { 1720}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 27   and name HD2 ))
 ASSI { 1723}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 92   and name HB2 ))
      4.500     2.600     1.500 peak  1723 spectrum    1 weight  0.10000E+01 volume  0.70695E-03 ppm1      1.012 ppm2      2.978 CV     1
 ASSI { 1726}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 86   and name HE1 ))
      3.200     1.300     1.300 peak  1726 spectrum    1 weight  0.10000E+01 volume  0.16624E-02 ppm1      0.985 ppm2      2.684 CV     1
 OR { 1726}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 1728}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 88   and name HN  ))
      3.000     1.200     1.200 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.11096E-02 ppm1      0.975 ppm2      7.287 CV     1
 ASSI { 1730}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 86   and name HG2 ))
      2.000     0.500     0.500 peak  1730 spectrum    1 weight  0.10000E+01 volume  0.34583E-02 ppm1      0.971 ppm2     -0.590 CV     1
 ASSI { 1731}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 86   and name HB2 ))
      2.900     1.100     1.100 peak  1731 spectrum    1 weight  0.10000E+01 volume  0.10034E-02 ppm1      0.978 ppm2     -0.813 CV     1
 ASSI { 1738}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HN  ))
      3.400     1.500     1.500 peak  1738 spectrum    1 weight  0.10000E+01 volume  0.25950E-03 ppm1     -0.583 ppm2      8.469 CV     1
 ASSI { 1739}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 87   and name HN  ))
      4.500     2.500     1.500 peak  1739 spectrum    1 weight  0.10000E+01 volume  0.70901E-03 ppm1     -0.584 ppm2      7.951 CV     1
 ASSI { 1742}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HE1 ))
      3.000     1.100     1.100 peak  1742 spectrum    1 weight  0.10000E+01 volume  0.17529E-02 ppm1     -0.582 ppm2      2.680 CV     1
 OR { 1742}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 1744}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HD1 ))
      2.900     1.100     1.100 peak  1744 spectrum    1 weight  0.10000E+01 volume  0.11954E-02 ppm1     -0.588 ppm2      1.327 CV     1
 OR { 1744}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 1748}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HB2 ))
      3.600     1.600     1.600 peak  1748 spectrum    1 weight  0.10000E+01 volume  0.84896E-03 ppm1     -0.578 ppm2     -0.834 CV     1
 ASSI { 1759}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 99   and name HN  ))
      4.100     2.100     1.900 peak  1759 spectrum    1 weight  0.10000E+01 volume  0.11956E-02 ppm1      1.367 ppm2      8.966 CV     1
 ASSI { 1760}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 98   and name HN  ))
      2.800     1.000     1.000 peak  1760 spectrum    1 weight  0.10000E+01 volume  0.25190E-02 ppm1      1.365 ppm2      7.647 CV     1
 ASSI { 1762}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 98   and name HG12))
      1.700     0.300     0.500 peak  1762 spectrum    1 weight  0.10000E+01 volume  0.15522E-01 ppm1      1.363 ppm2      0.642 CV     1
 ASSI { 1763}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 69   and name HG12))
      3.600     1.600     1.600 peak  1763 spectrum    1 weight  0.10000E+01 volume  0.10910E-02 ppm1      1.366 ppm2      0.119 CV     1
 ASSI { 1764}
   (( segid "    " and resid 98   and name HG11))
   (  segid "    " and resid 69   and name HG2%)
      2.900     1.000     1.000 peak  1764 spectrum    1 weight  0.10000E+01 volume  0.15844E-02 ppm1      1.373 ppm2     -0.172 CV     1
 ASSI { 1766}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 96   and name HN  ))
      2.600     0.900     0.900 peak  1766 spectrum    1 weight  0.10000E+01 volume  0.25212E-02 ppm1      1.204 ppm2      9.177 CV     1
 ASSI { 1767}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 28   and name HN  ))
      3.400     1.500     1.500 peak  1767 spectrum    1 weight  0.10000E+01 volume  0.75880E-03 ppm1      1.204 ppm2      8.972 CV     1
 ASSI { 1768}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 92   and name HZ3 ))
      4.100     2.100     1.900 peak  1768 spectrum    1 weight  0.10000E+01 volume  0.91538E-03 ppm1      1.200 ppm2      6.742 CV     1
 OR { 1768}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 92   and name HH2 ))
 ASSI { 1770}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 96   and name HA  ))
      3.800     1.800     1.800 peak  1770 spectrum    1 weight  0.10000E+01 volume  0.83645E-03 ppm1      1.204 ppm2      4.475 CV     1
 ASSI { 1772}
   (( segid "    " and resid 96   and name HG11))
   (  segid "    " and resid 96   and name HG2%)
      3.300     1.400     1.400 peak  1772 spectrum    1 weight  0.10000E+01 volume  0.39442E-02 ppm1      1.204 ppm2      0.270 CV     1
 ASSI { 1773}
   (( segid "    " and resid 96   and name HG11))
   (  segid "    " and resid 96   and name HD1%)
      2.500     0.800     0.800 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.41118E-02 ppm1      1.205 ppm2      0.094 CV     1
 ASSI { 1774}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 96   and name HN  ))
      2.900     1.000     1.000 peak  1774 spectrum    1 weight  0.10000E+01 volume  0.24395E-02 ppm1      1.103 ppm2      9.174 CV     1
 ASSI { 1775}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 28   and name HN  ))
      4.500     2.600     1.500 peak  1775 spectrum    1 weight  0.10000E+01 volume  0.53460E-03 ppm1      1.101 ppm2      8.961 CV     1
 ASSI { 1778}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 71   and name HA  ))
      3.600     1.600     1.600 peak  1778 spectrum    1 weight  0.10000E+01 volume  0.87711E-03 ppm1      1.103 ppm2      4.800 CV     1
 ASSI { 1782}
   (( segid "    " and resid 96   and name HG12))
   (  segid "    " and resid 96   and name HD1%)
      2.600     0.800     0.800 peak  1782 spectrum    1 weight  0.10000E+01 volume  0.36414E-02 ppm1      1.103 ppm2      0.094 CV     1
 ASSI { 1787}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 38   and name HB2 ))
      2.000     0.500     0.500 peak  1787 spectrum    1 weight  0.10000E+01 volume  0.16956E-01 ppm1      0.852 ppm2      1.591 CV     1
 OR { 1787}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 1789}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 98   and name HN  ))
      3.600     1.600     1.600 peak  1789 spectrum    1 weight  0.10000E+01 volume  0.16538E-02 ppm1      0.644 ppm2      7.668 CV     1
 ASSI { 1790}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 98   and name HA  ))
      3.100     1.200     1.200 peak  1790 spectrum    1 weight  0.10000E+01 volume  0.18248E-02 ppm1      0.643 ppm2      4.510 CV     1
 ASSI { 1791}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 67   and name HB  ))
      5.100     3.200     0.900 peak  1791 spectrum    1 weight  0.10000E+01 volume  0.29035E-03 ppm1      0.647 ppm2      2.157 CV     1
 ASSI { 1793}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 69   and name HG12))
      3.700     1.700     1.700 peak  1793 spectrum    1 weight  0.10000E+01 volume  0.71240E-03 ppm1      0.648 ppm2      0.117 CV     1
 ASSI { 1800}
   (  segid "    " and resid 65   and name HD2%)
   (( segid "    " and resid 65   and name HA  ))
      3.600     1.600     1.600 peak  1800 spectrum    1 weight  0.10000E+01 volume  0.19918E-02 ppm1      0.440 ppm2      4.731 CV     1
 ASSI { 1832}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 38   and name HA  ))
      2.900     1.100     1.100 peak  1832 spectrum    1 weight  0.10000E+01 volume  0.21336E-02 ppm1      1.344 ppm2      4.847 CV     1
 ASSI { 1835}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 38   and name HN  ))
      3.900     1.900     1.900 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.10317E-02 ppm1      1.347 ppm2      7.366 CV     1
 ASSI { 1836}
   (( segid "    " and resid 38   and name HG1 ))
   (  segid "    " and resid 120  and name HD% )
      3.100     1.200     1.200 peak  1836 spectrum    1 weight  0.10000E+01 volume  0.15588E-02 ppm1      1.355 ppm2      6.666 CV     1
 ASSI { 1837}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 120  and name HB2 ))
      3.000     1.100     1.100 peak  1837 spectrum    1 weight  0.10000E+01 volume  0.25034E-02 ppm1      1.344 ppm2      2.751 CV     1
 ASSI { 1840}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 38   and name HG2 ))
      1.800     0.400     0.400 peak  1840 spectrum    1 weight  0.10000E+01 volume  0.99832E-02 ppm1      1.345 ppm2      0.866 CV     1
 ASSI { 1842}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 35   and name HB1 ))
      4.600     2.600     1.400 peak  1842 spectrum    1 weight  0.10000E+01 volume  0.53348E-03 ppm1      1.340 ppm2      3.282 CV     1
 ASSI { 1849}
   (( segid "    " and resid 96   and name HG11))
   (  segid "    " and resid 69   and name HG2%)
      3.900     1.900     1.900 peak  1849 spectrum    1 weight  0.10000E+01 volume  0.70001E-03 ppm1      1.194 ppm2     -0.150 CV     1
 ASSI { 1851}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 96   and name HA  ))
      3.400     1.500     1.500 peak  1851 spectrum    1 weight  0.10000E+01 volume  0.85957E-03 ppm1      1.110 ppm2      4.479 CV     1
 ASSI { 1853}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 30   and name HB  ))
      3.700     1.700     1.700 peak  1853 spectrum    1 weight  0.10000E+01 volume  0.58872E-03 ppm1      1.081 ppm2      2.188 CV     1
 ASSI { 1881}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 77   and name HZ3 ))
      3.100     1.200     1.200 peak  1881 spectrum    1 weight  0.10000E+01 volume  0.21331E-02 ppm1      0.877 ppm2      6.315 CV     1
 ASSI { 1888}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 120  and name HA  ))
      4.300     2.300     1.700 peak  1888 spectrum    1 weight  0.10000E+01 volume  0.56667E-03 ppm1      0.839 ppm2      5.736 CV     1
 ASSI { 1892}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 99   and name HA  ))
      4.000     2.000     2.000 peak  1892 spectrum    1 weight  0.10000E+01 volume  0.10635E-02 ppm1      0.793 ppm2      5.114 CV     1
 ASSI { 1894}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 19   and name HA  ))
      3.000     1.100     1.100 peak  1894 spectrum    1 weight  0.10000E+01 volume  0.26779E-02 ppm1      0.798 ppm2      4.414 CV     1
 ASSI { 1896}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.200     0.600     0.600 peak  1896 spectrum    1 weight  0.10000E+01 volume  0.13906E-01 ppm1      0.793 ppm2      1.895 CV     1
 ASSI { 1904}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 18   and name HN  ))
      3.900     1.900     1.900 peak  1904 spectrum    1 weight  0.10000E+01 volume  0.78893E-03 ppm1      0.781 ppm2      7.809 CV     1
 ASSI { 1906}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 28   and name HN  ))
      5.300     3.500     0.700 peak  1906 spectrum    1 weight  0.10000E+01 volume  0.47226E-03 ppm1      2.190 ppm2      8.972 CV     1
 ASSI { 1907}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 27   and name HA  ))
      4.000     2.000     2.000 peak  1907 spectrum    1 weight  0.10000E+01 volume  0.81098E-03 ppm1      2.194 ppm2      5.102 CV     1
 ASSI { 1910}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 27   and name HD2 ))
      2.500     0.800     0.800 peak  1910 spectrum    1 weight  0.10000E+01 volume  0.47235E-02 ppm1      2.190 ppm2      3.521 CV     1
 OR { 1910}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 27   and name HD1 ))
 ASSI { 1911}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 27   and name HB1 ))
      2.000     0.500     0.500 peak  1911 spectrum    1 weight  0.10000E+01 volume  0.13441E-01 ppm1      2.191 ppm2      1.934 CV     1
 ASSI { 1912}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 27   and name HB2 ))
      2.800     1.000     1.000 peak  1912 spectrum    1 weight  0.10000E+01 volume  0.37358E-02 ppm1      2.191 ppm2      1.666 CV     1
 ASSI { 1915}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 28   and name HN  ))
      5.200     3.400     0.800 peak  1915 spectrum    1 weight  0.10000E+01 volume  0.39372E-03 ppm1      2.028 ppm2      8.965 CV     1
 ASSI { 1916}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 27   and name HA  ))
      4.100     2.100     1.900 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.93437E-03 ppm1      2.032 ppm2      5.103 CV     1
 ASSI { 1919}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 27   and name HD1 ))
      2.500     0.800     0.800 peak  1919 spectrum    1 weight  0.10000E+01 volume  0.54385E-02 ppm1      2.026 ppm2      3.522 CV     1
 OR { 1919}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 27   and name HD2 ))
 ASSI { 1920}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 27   and name HG1 ))
      1.800     0.400     0.400 peak  1920 spectrum    1 weight  0.10000E+01 volume  0.12491E-01 ppm1      2.025 ppm2      2.188 CV     1
 ASSI { 1921}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 27   and name HB2 ))
      2.400     0.700     0.700 peak  1921 spectrum    1 weight  0.10000E+01 volume  0.42190E-02 ppm1      2.021 ppm2      1.652 CV     1
 ASSI { 1939}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 114  and name HA  ))
      4.000     2.000     2.000 peak  1939 spectrum    1 weight  0.10000E+01 volume  0.20696E-02 ppm1      0.551 ppm2      4.704 CV     1
 ASSI { 1947}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 114  and name HN  ))
      4.200     2.200     1.800 peak  1947 spectrum    1 weight  0.10000E+01 volume  0.12928E-02 ppm1      0.533 ppm2      8.866 CV     1
 ASSI { 1948}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 115  and name HN  ))
      3.700     1.800     1.800 peak  1948 spectrum    1 weight  0.10000E+01 volume  0.18526E-02 ppm1      0.531 ppm2      7.988 CV     1
 ASSI { 1954}
   (  segid "    " and resid 65   and name HD2%)
   (( segid "    " and resid 106  and name HA  ))
      4.600     2.600     1.400 peak  1954 spectrum    1 weight  0.10000E+01 volume  0.31238E-03 ppm1      0.403 ppm2      4.861 CV     1
 ASSI { 1957}
   (( segid "    " and resid 69   and name HG12))
   (  segid "    " and resid 84   and name HE% )
      5.700     4.100     0.300 peak  1957 spectrum    1 weight  0.10000E+01 volume  0.23961E-03 ppm1      0.109 ppm2      6.185 CV     1
 ASSI { 1971}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 42   and name HA  ))
      3.600     1.600     1.600 peak  1971 spectrum    1 weight  0.10000E+01 volume  0.97862E-03 ppm1      1.497 ppm2      5.338 CV     1
 ASSI { 1973}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 84   and name HN  ))
      3.500     1.600     1.600 peak  1973 spectrum    1 weight  0.10000E+01 volume  0.14492E-02 ppm1      1.481 ppm2      9.497 CV     1
 ASSI { 1975}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 41   and name HN  ))
      2.400     0.700     0.700 peak  1975 spectrum    1 weight  0.10000E+01 volume  0.50719E-02 ppm1      1.480 ppm2      8.791 CV     1
 ASSI { 1981}
   (  segid "    " and resid 41   and name HB% )
   (  segid "    " and resid 85   and name HD% )
      3.600     1.600     1.600 peak  1981 spectrum    1 weight  0.10000E+01 volume  0.19557E-02 ppm1      1.478 ppm2      6.040 CV     1
 ASSI { 1983}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 121  and name HA  ))
      3.600     1.700     1.700 peak  1983 spectrum    1 weight  0.10000E+01 volume  0.18746E-02 ppm1      1.488 ppm2      4.815 CV     1
 ASSI { 1984}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 119  and name HA1 ))
      3.600     1.600     1.600 peak  1984 spectrum    1 weight  0.10000E+01 volume  0.68953E-03 ppm1      1.479 ppm2      4.284 CV     1
 ASSI { 1985}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 40   and name HA  ))
      3.600     1.600     1.600 peak  1985 spectrum    1 weight  0.10000E+01 volume  0.21803E-02 ppm1      1.485 ppm2      3.936 CV     1
 ASSI { 1988}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 11   and name HA  ))
      4.300     2.300     1.700 peak  1988 spectrum    1 weight  0.10000E+01 volume  0.62150E-03 ppm1      1.365 ppm2      5.272 CV     1
 ASSI { 1989}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 139  and name HA  ))
      3.300     1.400     1.400 peak  1989 spectrum    1 weight  0.10000E+01 volume  0.17778E-02 ppm1      1.355 ppm2      4.945 CV     1
 ASSI { 1990}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 112  and name HN  ))
      3.900     1.900     1.900 peak  1990 spectrum    1 weight  0.10000E+01 volume  0.44696E-03 ppm1      1.275 ppm2      9.459 CV     1
 ASSI { 1995}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 65   and name HN  ))
      3.300     1.400     1.400 peak  1995 spectrum    1 weight  0.10000E+01 volume  0.15382E-02 ppm1      1.130 ppm2      8.538 CV     1
 ASSI { 1996}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 43   and name HA  ))
      2.600     0.900     0.900 peak  1996 spectrum    1 weight  0.10000E+01 volume  0.30546E-02 ppm1      1.142 ppm2      4.851 CV     1
 ASSI { 2000}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 55   and name HB1 ))
      2.700     0.900     0.900 peak  2000 spectrum    1 weight  0.10000E+01 volume  0.32189E-02 ppm1      1.135 ppm2      2.680 CV     1
 ASSI { 2008}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 64   and name HA  ))
      3.600     1.600     1.600 peak  2008 spectrum    1 weight  0.10000E+01 volume  0.16702E-02 ppm1      1.115 ppm2      5.093 CV     1
 ASSI { 2009}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 64   and name HE2 ))
      2.800     1.000     1.000 peak  2009 spectrum    1 weight  0.10000E+01 volume  0.28139E-02 ppm1      1.124 ppm2      2.336 CV     1
 ASSI { 2011}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 64   and name HG2 ))
      2.900     1.000     1.000 peak  2011 spectrum    1 weight  0.10000E+01 volume  0.21987E-02 ppm1      1.121 ppm2     -0.160 CV     1
 ASSI { 2012}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 64   and name HN  ))
      4.000     2.000     2.000 peak  2012 spectrum    1 weight  0.10000E+01 volume  0.15582E-02 ppm1      1.100 ppm2      8.254 CV     1
 ASSI { 2014}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 64   and name HD1 ))
      1.800     0.400     0.400 peak  2014 spectrum    1 weight  0.10000E+01 volume  0.11139E-01 ppm1      0.681 ppm2      1.059 CV     1
 ASSI { 2015}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 64   and name HG2 ))
      2.900     1.000     1.000 peak  2015 spectrum    1 weight  0.10000E+01 volume  0.25884E-02 ppm1      0.673 ppm2     -0.118 CV     1
 ASSI { 2017}
   (( segid "    " and resid 64   and name HD2 ))
   (  segid "    " and resid 66   and name HD% )
      3.100     1.200     1.200 peak  2017 spectrum    1 weight  0.10000E+01 volume  0.17085E-02 ppm1      0.665 ppm2      7.205 CV     1
 ASSI { 2029}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 70   and name HN  ))
      4.800     2.900     1.200 peak  2029 spectrum    1 weight  0.10000E+01 volume  0.38181E-03 ppm1      0.346 ppm2      8.568 CV     1
 ASSI { 2031}
   (( segid "    " and resid 69   and name HG11))
   (  segid "    " and resid 54   and name HE% )
      3.600     1.600     1.600 peak  2031 spectrum    1 weight  0.10000E+01 volume  0.64044E-03 ppm1      0.347 ppm2      7.279 CV     1
 OR { 2031}
   (( segid "    " and resid 69   and name HG11))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 2033}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 68   and name HA  ))
      4.700     2.700     1.300 peak  2033 spectrum    1 weight  0.10000E+01 volume  0.73027E-03 ppm1      0.348 ppm2      5.155 CV     1
 ASSI { 2034}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 69   and name HA  ))
      3.400     1.500     1.500 peak  2034 spectrum    1 weight  0.10000E+01 volume  0.14462E-02 ppm1      0.348 ppm2      4.921 CV     1
 ASSI { 2035}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 98   and name HA  ))
      5.200     3.400     0.800 peak  2035 spectrum    1 weight  0.10000E+01 volume  0.27766E-03 ppm1      0.338 ppm2      4.529 CV     1
 ASSI { 2037}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 84   and name HB2 ))
      3.500     1.600     1.600 peak  2037 spectrum    1 weight  0.10000E+01 volume  0.41434E-03 ppm1      0.339 ppm2      2.702 CV     1
 ASSI { 2038}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 69   and name HB  ))
      2.500     0.800     0.800 peak  2038 spectrum    1 weight  0.10000E+01 volume  0.33060E-02 ppm1      0.335 ppm2      0.719 CV     1
 ASSI { 2039}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 69   and name HG12))
      1.600     0.300     0.600 peak  2039 spectrum    1 weight  0.10000E+01 volume  0.16838E-01 ppm1      0.338 ppm2      0.135 CV     1
 ASSI { 2040}
   (( segid "    " and resid 69   and name HG11))
   (  segid "    " and resid 69   and name HD1%)
      2.200     0.600     0.600 peak  2040 spectrum    1 weight  0.10000E+01 volume  0.78922E-02 ppm1      0.350 ppm2     -0.592 CV     1
 ASSI { 2042}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 70   and name HN  ))
      4.800     2.900     1.200 peak  2042 spectrum    1 weight  0.10000E+01 volume  0.54855E-03 ppm1      0.111 ppm2      8.576 CV     1
 ASSI { 2044}
   (( segid "    " and resid 69   and name HG12))
   (  segid "    " and resid 54   and name HE% )
      3.900     1.900     1.900 peak  2044 spectrum    1 weight  0.10000E+01 volume  0.67277E-03 ppm1      0.104 ppm2      7.273 CV     1
 OR { 2044}
   (( segid "    " and resid 69   and name HG12))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 2046}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 69   and name HA  ))
      3.300     1.300     1.300 peak  2046 spectrum    1 weight  0.10000E+01 volume  0.17262E-02 ppm1      0.107 ppm2      4.921 CV     1
 ASSI { 2047}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 98   and name HA  ))
      4.400     2.400     1.600 peak  2047 spectrum    1 weight  0.10000E+01 volume  0.44390E-03 ppm1      0.102 ppm2      4.525 CV     1
 ASSI { 2048}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 84   and name HB1 ))
      4.800     2.900     1.200 peak  2048 spectrum    1 weight  0.10000E+01 volume  0.30260E-03 ppm1      0.109 ppm2      3.046 CV     1
 ASSI { 2049}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 84   and name HB2 ))
      4.900     3.000     1.100 peak  2049 spectrum    1 weight  0.10000E+01 volume  0.29612E-03 ppm1      0.103 ppm2      2.696 CV     1
 ASSI { 2051}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 69   and name HB  ))
      3.100     1.200     1.200 peak  2051 spectrum    1 weight  0.10000E+01 volume  0.21405E-02 ppm1      0.114 ppm2      0.672 CV     1
 ASSI { 2064}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 81   and name HB1 ))
      2.500     0.800     0.800 peak  2064 spectrum    1 weight  0.10000E+01 volume  0.48977E-02 ppm1      1.427 ppm2      3.088 CV     1
 OR { 2064}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI { 2068}
   (( segid "    " and resid 53   and name HD1 ))
   (  segid "    " and resid 66   and name HE% )
      3.900     1.900     1.900 peak  2068 spectrum    1 weight  0.10000E+01 volume  0.14094E-02 ppm1      1.416 ppm2      6.625 CV     1
 OR { 2068}
   (( segid "    " and resid 53   and name HD2 ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2069}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HA  ))
      2.300     0.600     0.600 peak  2069 spectrum    1 weight  0.10000E+01 volume  0.77374E-02 ppm1      1.412 ppm2      4.741 CV     1
 OR { 2069}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI { 2071}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HB1 ))
      2.400     0.700     0.700 peak  2071 spectrum    1 weight  0.10000E+01 volume  0.70117E-02 ppm1      1.412 ppm2      2.220 CV     1
 OR { 2071}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HB1 ))
 ASSI { 2076}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 112  and name HN  ))
      3.900     1.900     1.900 peak  2076 spectrum    1 weight  0.10000E+01 volume  0.45724E-03 ppm1      1.342 ppm2      9.454 CV     1
 ASSI { 2079}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 139  and name HE1 ))
      3.300     1.300     1.300 peak  2079 spectrum    1 weight  0.10000E+01 volume  0.26943E-02 ppm1      1.342 ppm2      2.849 CV     1
 ASSI { 2080}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 11   and name HA  ))
      4.700     2.800     1.300 peak  2080 spectrum    1 weight  0.10000E+01 volume  0.56234E-03 ppm1      1.287 ppm2      5.279 CV     1
 ASSI { 2084}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 113  and name HA  ))
      3.600     1.600     1.600 peak  2084 spectrum    1 weight  0.10000E+01 volume  0.50306E-03 ppm1      1.280 ppm2      5.813 CV     1
 ASSI { 2085}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HA  ))
      2.700     0.900     0.900 peak  2085 spectrum    1 weight  0.10000E+01 volume  0.19390E-02 ppm1      1.282 ppm2      4.945 CV     1
 ASSI { 2086}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HE1 ))
      3.200     1.200     1.200 peak  2086 spectrum    1 weight  0.10000E+01 volume  0.26091E-02 ppm1      1.271 ppm2      2.849 CV     1
 ASSI { 2087}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HB1 ))
      2.800     1.000     1.000 peak  2087 spectrum    1 weight  0.10000E+01 volume  0.41315E-02 ppm1      1.278 ppm2      1.904 CV     1
 ASSI { 2088}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HD1 ))
      2.100     0.600     0.600 peak  2088 spectrum    1 weight  0.10000E+01 volume  0.11225E-01 ppm1      1.278 ppm2      1.665 CV     1
 OR { 2088}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HB2 ))
 ASSI { 2090}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 129  and name HB1 ))
      4.600     2.600     1.400 peak  2090 spectrum    1 weight  0.10000E+01 volume  0.26088E-03 ppm1      1.194 ppm2      3.107 CV     1
 ASSI { 2097}
   (  segid "    " and resid 33   and name HD2%)
   (( segid "    " and resid 33   and name HG  ))
      1.900     0.500     0.500 peak  2097 spectrum    1 weight  0.10000E+01 volume  0.32074E-01 ppm1      0.898 ppm2      1.586 CV     1
 OR { 2097}
   (  segid "    " and resid 33   and name HD2%)
   (( segid "    " and resid 33   and name HB2 ))
 ASSI { 2100}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 121  and name HE3 ))
      3.600     1.600     1.600 peak  2100 spectrum    1 weight  0.10000E+01 volume  0.12769E-02 ppm1      0.829 ppm2      6.914 CV     1
 ASSI { 2101}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 43   and name HA  ))
      3.300     1.300     1.300 peak  2101 spectrum    1 weight  0.10000E+01 volume  0.25224E-02 ppm1      0.832 ppm2      4.808 CV     1
 ASSI { 2103}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 43   and name HG1 ))
      1.600     0.300     0.600 peak  2103 spectrum    1 weight  0.10000E+01 volume  0.17319E-01 ppm1      0.827 ppm2      1.176 CV     1
 ASSI { 2105}
   (  segid "    " and resid 114  and name HD2%)
   (( segid "    " and resid 56   and name HA  ))
      3.000     1.200     1.200 peak  2105 spectrum    1 weight  0.10000E+01 volume  0.12612E-02 ppm1      0.788 ppm2      4.632 CV     1
 ASSI { 2122}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 117  and name HN  ))
      4.500     2.500     1.500 peak  2122 spectrum    1 weight  0.10000E+01 volume  0.80867E-03 ppm1      0.534 ppm2      9.039 CV     1
 ASSI { 2123}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 44   and name HA  ))
      3.600     1.600     1.600 peak  2123 spectrum    1 weight  0.10000E+01 volume  0.11979E-02 ppm1      0.535 ppm2      5.294 CV     1
 ASSI { 2132}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 116  and name HB1 ))
      2.400     0.700     0.700 peak  2132 spectrum    1 weight  0.10000E+01 volume  0.82873E-02 ppm1      0.529 ppm2      1.760 CV     1
 ASSI { 2139}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HA  ))
      3.700     1.700     1.700 peak  2139 spectrum    1 weight  0.10000E+01 volume  0.25598E-02 ppm1      0.489 ppm2      4.568 CV     1
 ASSI { 2143}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HG  ))
      2.100     0.600     0.600 peak  2143 spectrum    1 weight  0.10000E+01 volume  0.12977E-01 ppm1      0.471 ppm2      1.154 CV     1
 ASSI { 2144}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 139  and name HN  ))
      4.200     2.200     1.800 peak  2144 spectrum    1 weight  0.10000E+01 volume  0.86654E-03 ppm1      0.480 ppm2      9.134 CV     1
 ASSI { 2166}
   (  segid "    " and resid 114  and name HD2%)
   (( segid "    " and resid 138  and name HB  ))
      3.800     1.900     1.900 peak  2166 spectrum    1 weight  0.10000E+01 volume  0.13497E-02 ppm1      0.810 ppm2      3.909 CV     1
 ASSI { 2169}
   (  segid "    " and resid 114  and name HD2%)
   (( segid "    " and resid 114  and name HG  ))
      2.100     0.500     0.500 peak  2169 spectrum    1 weight  0.10000E+01 volume  0.12221E-01 ppm1      0.811 ppm2      1.273 CV     1
 ASSI { 2172}
   (  segid "    " and resid 114  and name HD2%)
   (( segid "    " and resid 140  and name HB1 ))
      2.400     0.700     0.700 peak  2172 spectrum    1 weight  0.10000E+01 volume  0.30160E-02 ppm1      0.798 ppm2      1.677 CV     1
 ASSI { 2176}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 33   and name HN  ))
      2.800     1.000     1.000 peak  2176 spectrum    1 weight  0.10000E+01 volume  0.62703E-02 ppm1      1.741 ppm2      9.024 CV     1
 ASSI { 2181}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 92   and name HE3 ))
      4.100     2.100     1.900 peak  2181 spectrum    1 weight  0.10000E+01 volume  0.89210E-03 ppm1      1.750 ppm2      7.326 CV     1
 ASSI { 2182}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 32   and name HA  ))
      2.200     0.600     0.600 peak  2182 spectrum    1 weight  0.10000E+01 volume  0.10923E-01 ppm1      1.745 ppm2      5.627 CV     1
 ASSI { 2184}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 91   and name HA  ))
      2.600     0.900     0.900 peak  2184 spectrum    1 weight  0.10000E+01 volume  0.62789E-02 ppm1      1.743 ppm2      4.045 CV     1
 ASSI { 2189}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 93   and name HA1 ))
      4.300     2.300     1.700 peak  2189 spectrum    1 weight  0.10000E+01 volume  0.84066E-03 ppm1      1.730 ppm2      4.392 CV     1
 ASSI { 2191}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 91   and name HB2 ))
      3.300     1.300     1.300 peak  2191 spectrum    1 weight  0.10000E+01 volume  0.25486E-02 ppm1      1.735 ppm2      3.812 CV     1
 OR { 2191}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 91   and name HB1 ))
 ASSI { 2206}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 95   and name HB  ))
      2.200     0.600     0.600 peak  2206 spectrum    1 weight  0.10000E+01 volume  0.12994E-01 ppm1      1.055 ppm2      3.752 CV     1
 ASSI { 2230}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 134  and name HA  ))
      2.400     0.700     0.700 peak  2230 spectrum    1 weight  0.10000E+01 volume  0.11032E-01 ppm1      1.263 ppm2      4.999 CV     1
 ASSI { 2237}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 77   and name HH2 ))
      2.500     0.800     0.800 peak  2237 spectrum    1 weight  0.10000E+01 volume  0.55924E-02 ppm1      1.244 ppm2      6.626 CV     1
 ASSI { 2240}
   (  segid "    " and resid 79   and name HG2%)
   (( segid "    " and resid 79   and name HB  ))
      2.100     0.500     0.500 peak  2240 spectrum    1 weight  0.10000E+01 volume  0.17137E-01 ppm1      1.248 ppm2      4.093 CV     1
 ASSI { 2255}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 138  and name HA  ))
      3.400     1.400     1.400 peak  2255 spectrum    1 weight  0.10000E+01 volume  0.17652E-02 ppm1      0.956 ppm2      5.253 CV     1
 ASSI { 2264}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 10   and name HB1 ))
      2.400     0.700     0.700 peak  2264 spectrum    1 weight  0.10000E+01 volume  0.62620E-02 ppm1      0.938 ppm2      1.857 CV     1
 ASSI { 2265}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 10   and name HB2 ))
      3.000     1.100     1.100 peak  2265 spectrum    1 weight  0.10000E+01 volume  0.78031E-02 ppm1      0.941 ppm2      1.450 CV     1
 ASSI { 2271}
   (  segid "    " and resid 7    and name HG1%)
   (( segid "    " and resid 8    and name HN  ))
      2.900     1.000     1.000 peak  2271 spectrum    1 weight  0.10000E+01 volume  0.32941E-02 ppm1      0.886 ppm2      8.790 CV     1
 ASSI { 2275}
   (  segid "    " and resid 7    and name HG1%)
   (( segid "    " and resid 7    and name HB  ))
      2.100     0.600     0.600 peak  2275 spectrum    1 weight  0.10000E+01 volume  0.13981E-01 ppm1      0.884 ppm2      1.883 CV     1
 ASSI { 2277}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 80   and name HB1 ))
      3.100     1.200     1.200 peak  2277 spectrum    1 weight  0.10000E+01 volume  0.14986E-02 ppm1      0.867 ppm2      2.681 CV     1
 ASSI { 2313}
   (  segid "    " and resid 5    and name HG1%)
   (( segid "    " and resid 5    and name HN  ))
      3.400     1.400     1.400 peak  2313 spectrum    1 weight  0.10000E+01 volume  0.38775E-02 ppm1      1.403 ppm2      9.282 CV     1
 ASSI { 2320}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
      2.100     0.500     0.500 peak  2320 spectrum    1 weight  0.10000E+01 volume  0.18594E-01 ppm1      1.352 ppm2      4.217 CV     1
 ASSI { 2347}
   (  segid "    " and resid 83   and name HG2%)
   (  segid "    " and resid 85   and name HD% )
      3.300     1.400     1.400 peak  2347 spectrum    1 weight  0.10000E+01 volume  0.10270E-02 ppm1      0.850 ppm2      5.996 CV     1
 ASSI { 2352}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 83   and name HB  ))
      2.100     0.500     0.500 peak  2352 spectrum    1 weight  0.10000E+01 volume  0.13506E-01 ppm1      0.855 ppm2      2.227 CV     1
 ASSI { 2356}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 96   and name HN  ))
      4.000     2.000     2.000 peak  2356 spectrum    1 weight  0.10000E+01 volume  0.10860E-02 ppm1      0.603 ppm2      9.182 CV     1
 ASSI { 2357}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 28   and name HN  ))
      2.600     0.900     0.900 peak  2357 spectrum    1 weight  0.10000E+01 volume  0.50698E-02 ppm1      0.608 ppm2      8.958 CV     1
 ASSI { 2364}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 28   and name HB  ))
      2.200     0.600     0.600 peak  2364 spectrum    1 weight  0.10000E+01 volume  0.12133E-01 ppm1      0.586 ppm2      1.693 CV     1
 ASSI { 2381}
   (  segid "    " and resid 116  and name HD2%)
   (( segid "    " and resid 116  and name HB2 ))
      2.600     0.800     0.800 peak  2381 spectrum    1 weight  0.10000E+01 volume  0.90064E-02 ppm1      0.489 ppm2      1.011 CV     1
 ASSI { 2383}
   (  segid "    " and resid 116  and name HD2%)
   (  segid "    " and resid 69   and name HD1%)
      2.600     0.900     0.900 peak  2383 spectrum    1 weight  0.10000E+01 volume  0.47639E-02 ppm1      0.487 ppm2     -0.571 CV     1
 ASSI { 2389}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 100  and name HN  ))
      4.000     2.000     2.000 peak  2389 spectrum    1 weight  0.10000E+01 volume  0.80256E-03 ppm1      0.415 ppm2      9.423 CV     1
 ASSI { 2411}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 113  and name HA  ))
      2.300     0.600     0.600 peak  2411 spectrum    1 weight  0.10000E+01 volume  0.10471E-01 ppm1      1.178 ppm2      5.812 CV     1
 ASSI { 2429}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 5    and name HB  ))
      2.200     0.600     0.600 peak  2429 spectrum    1 weight  0.10000E+01 volume  0.10695E-01 ppm1      1.078 ppm2      2.224 CV     1
 ASSI { 2430}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 7    and name HB  ))
      2.700     0.900     0.900 peak  2430 spectrum    1 weight  0.10000E+01 volume  0.33363E-02 ppm1      1.005 ppm2      1.886 CV     1
 ASSI { 2436}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 7    and name HN  ))
      3.100     1.200     1.200 peak  2436 spectrum    1 weight  0.10000E+01 volume  0.15648E-02 ppm1      1.008 ppm2      7.656 CV     1
 ASSI { 2446}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 134  and name HN  ))
      3.700     1.700     1.700 peak  2446 spectrum    1 weight  0.10000E+01 volume  0.75748E-03 ppm1      0.994 ppm2      8.357 CV     1
 ASSI { 2455}
   (  segid "    " and resid 28   and name HG1%)
   (( segid "    " and resid 28   and name HA  ))
      2.400     0.700     0.700 peak  2455 spectrum    1 weight  0.10000E+01 volume  0.83273E-02 ppm1      0.696 ppm2      4.029 CV     1
 ASSI { 2459}
   (  segid "    " and resid 28   and name HG1%)
   (( segid "    " and resid 28   and name HN  ))
      3.400     1.400     1.400 peak  2459 spectrum    1 weight  0.10000E+01 volume  0.23301E-02 ppm1      0.681 ppm2      8.950 CV     1
 ASSI { 2461}
   (  segid "    " and resid 28   and name HG1%)
   (( segid "    " and resid 29   and name HN  ))
      2.700     0.900     0.900 peak  2461 spectrum    1 weight  0.10000E+01 volume  0.50582E-02 ppm1      0.683 ppm2      8.304 CV     1
 ASSI { 2462}
   (  segid "    " and resid 28   and name HG1%)
   (( segid "    " and resid 28   and name HB  ))
      2.200     0.600     0.600 peak  2462 spectrum    1 weight  0.10000E+01 volume  0.11206E-01 ppm1      0.674 ppm2      1.687 CV     1
 ASSI { 2466}
   (  segid "    " and resid 117  and name HG2%)
   (( segid "    " and resid 135  and name HA  ))
      3.100     1.200     1.200 peak  2466 spectrum    1 weight  0.10000E+01 volume  0.24468E-02 ppm1      1.440 ppm2      5.296 CV     1
 ASSI { 2469}
   (  segid "    " and resid 117  and name HG2%)
   (( segid "    " and resid 117  and name HB  ))
      2.200     0.600     0.600 peak  2469 spectrum    1 weight  0.10000E+01 volume  0.11980E-01 ppm1      1.438 ppm2      3.945 CV     1
 ASSI { 2473}
   (  segid "    " and resid 122  and name HB% )
   (( segid "    " and resid 123  and name HN  ))
      3.000     1.100     1.100 peak  2473 spectrum    1 weight  0.10000E+01 volume  0.63330E-02 ppm1      1.250 ppm2      8.270 CV     1
 ASSI { 2478}
   (  segid "    " and resid 122  and name HB% )
   (( segid "    " and resid 122  and name HA  ))
      2.100     0.600     0.600 peak  2478 spectrum    1 weight  0.10000E+01 volume  0.16752E-01 ppm1      1.246 ppm2      4.404 CV     1
 ASSI { 2500}
   (  segid "    " and resid 78   and name HG2%)
   (  segid "    " and resid 85   and name HE% )
      2.700     0.900     0.900 peak  2500 spectrum    1 weight  0.10000E+01 volume  0.54975E-02 ppm1      0.809 ppm2      5.677 CV     1
 ASSI { 2503}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HA  ))
      2.200     0.600     0.600 peak  2503 spectrum    1 weight  0.10000E+01 volume  0.14849E-01 ppm1      0.815 ppm2      2.071 CV     1
 ASSI { 2510}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 12   and name HB  ))
      2.200     0.600     0.600 peak  2510 spectrum    1 weight  0.10000E+01 volume  0.12179E-01 ppm1      0.927 ppm2      1.947 CV     1
 ASSI { 2514}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 107  and name HN  ))
      3.100     1.200     1.200 peak  2514 spectrum    1 weight  0.10000E+01 volume  0.24711E-02 ppm1      0.900 ppm2      7.212 CV     1
 ASSI { 2517}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 107  and name HB  ))
      2.200     0.600     0.600 peak  2517 spectrum    1 weight  0.10000E+01 volume  0.14225E-01 ppm1      0.899 ppm2      3.694 CV     1
 ASSI { 2524}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 43   and name HA  ))
      3.700     1.700     1.700 peak  2524 spectrum    1 weight  0.10000E+01 volume  0.30983E-02 ppm1      1.525 ppm2      4.863 CV     1
 ASSI { 2526}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 82   and name HA2 ))
      3.600     1.600     1.600 peak  2526 spectrum    1 weight  0.10000E+01 volume  0.14684E-02 ppm1      1.530 ppm2      2.167 CV     1
 ASSI { 2530}
   (  segid "    " and resid 44   and name HB% )
   (  segid "    " and resid 49   and name HE% )
      4.000     2.000     2.000 peak  2530 spectrum    1 weight  0.10000E+01 volume  0.15797E-02 ppm1      1.513 ppm2      6.913 CV     1
 OR { 2530}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 49   and name HN  ))
 ASSI { 2532}
   (  segid "    " and resid 44   and name HB% )
   (  segid "    " and resid 49   and name HD% )
      2.600     0.900     0.900 peak  2532 spectrum    1 weight  0.10000E+01 volume  0.25669E-02 ppm1      1.509 ppm2      6.563 CV     1
 ASSI { 2542}
   (  segid "    " and resid 76   and name HB% )
   (( segid "    " and resid 77   and name HD1 ))
      4.000     2.000     2.000 peak  2542 spectrum    1 weight  0.10000E+01 volume  0.10613E-02 ppm1      1.337 ppm2      6.784 CV     1
 ASSI { 2543}
   (  segid "    " and resid 76   and name HB% )
   (( segid "    " and resid 77   and name HN  ))
      3.200     1.300     1.300 peak  2543 spectrum    1 weight  0.10000E+01 volume  0.60432E-02 ppm1      1.326 ppm2      8.304 CV     1
 ASSI { 2547}
   (  segid "    " and resid 76   and name HB% )
   (( segid "    " and resid 76   and name HA  ))
      2.100     0.600     0.600 peak  2547 spectrum    1 weight  0.10000E+01 volume  0.15659E-01 ppm1      1.327 ppm2      4.613 CV     1
 ASSI { 2554}
   (  segid "    " and resid 138  and name HG2%)
   (( segid "    " and resid 138  and name HA  ))
      2.300     0.700     0.700 peak  2554 spectrum    1 weight  0.10000E+01 volume  0.83373E-02 ppm1      0.781 ppm2      5.285 CV     1
 ASSI { 2557}
   (  segid "    " and resid 138  and name HG2%)
   (( segid "    " and resid 138  and name HB  ))
      2.200     0.600     0.600 peak  2557 spectrum    1 weight  0.10000E+01 volume  0.10392E-01 ppm1      0.780 ppm2      3.968 CV     1
 ASSI { 2572}
   (  segid "    " and resid 76   and name HB% )
   (( segid "    " and resid 75   and name HB2 ))
      4.300     2.300     1.700 peak  2572 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      1.334 ppm2      4.352 CV     1
 ASSI { 2575}
   (  segid "    " and resid 37   and name HB% )
   (( segid "    " and resid 38   and name HN  ))
      3.400     1.400     1.400 peak  2575 spectrum    1 weight  0.10000E+01 volume  0.30529E-02 ppm1      1.290 ppm2      7.380 CV     1
 ASSI { 2577}
   (  segid "    " and resid 37   and name HB% )
   (( segid "    " and resid 37   and name HA  ))
      2.000     0.500     0.500 peak  2577 spectrum    1 weight  0.10000E+01 volume  0.22265E-01 ppm1      1.290 ppm2      4.510 CV     1
 ASSI { 2587}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 38   and name HN  ))
      4.200     2.200     1.800 peak  2587 spectrum    1 weight  0.10000E+01 volume  0.10842E-02 ppm1      0.864 ppm2      7.373 CV     1
 ASSI { 2590}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 89   and name HA  ))
      3.100     1.200     1.200 peak  2590 spectrum    1 weight  0.10000E+01 volume  0.40224E-02 ppm1      0.862 ppm2      4.034 CV     1
 ASSI { 2600}
   (  segid "    " and resid 23   and name HB% )
   (  segid "    " and resid 99   and name HD% )
      4.700     2.800     1.300 peak  2600 spectrum    1 weight  0.10000E+01 volume  0.44609E-03 ppm1      1.533 ppm2      6.816 CV     1
 ASSI { 2601}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 23   and name HA  ))
      2.100     0.500     0.500 peak  2601 spectrum    1 weight  0.10000E+01 volume  0.13343E-01 ppm1      1.523 ppm2      4.597 CV     1
 ASSI { 2602}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 19   and name HA  ))
      2.400     0.700     0.700 peak  2602 spectrum    1 weight  0.10000E+01 volume  0.41814E-02 ppm1      1.529 ppm2      4.420 CV     1
 ASSI { 2604}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 24   and name HD2 ))
      2.900     1.100     1.100 peak  2604 spectrum    1 weight  0.10000E+01 volume  0.67347E-02 ppm1      1.528 ppm2      3.835 CV     1
 ASSI { 2606}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 24   and name HG1 ))
      4.200     2.200     1.800 peak  2606 spectrum    1 weight  0.10000E+01 volume  0.14362E-02 ppm1      1.521 ppm2      2.248 CV     1
 ASSI { 2615}
   (  segid "    " and resid 57   and name HG2%)
   (  segid "    " and resid 55   and name HD% )
      4.100     2.100     1.900 peak  2615 spectrum    1 weight  0.10000E+01 volume  0.12945E-02 ppm1      1.028 ppm2      6.684 CV     1
 ASSI { 2616}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 64   and name HA  ))
      4.200     2.200     1.800 peak  2616 spectrum    1 weight  0.10000E+01 volume  0.85144E-03 ppm1      1.026 ppm2      5.101 CV     1
 ASSI { 2617}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 112  and name HA  ))
      4.000     2.000     2.000 peak  2617 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      1.031 ppm2      4.928 CV     1
 ASSI { 2621}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 57   and name HN  ))
      2.100     0.600     0.600 peak  2621 spectrum    1 weight  0.10000E+01 volume  0.12102E-01 ppm1      1.017 ppm2      8.966 CV     1
 ASSI { 2622}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 113  and name HN  ))
      2.900     1.100     1.100 peak  2622 spectrum    1 weight  0.10000E+01 volume  0.30890E-02 ppm1      1.013 ppm2      8.733 CV     1
 ASSI { 2626}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 57   and name HA  ))
      3.100     1.200     1.200 peak  2626 spectrum    1 weight  0.10000E+01 volume  0.36836E-02 ppm1      1.015 ppm2      5.395 CV     1
 ASSI { 2627}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 113  and name HB  ))
      3.000     1.100     1.100 peak  2627 spectrum    1 weight  0.10000E+01 volume  0.20785E-02 ppm1      1.017 ppm2      3.873 CV     1
 ASSI { 2629}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 57   and name HB  ))
      2.000     0.500     0.500 peak  2629 spectrum    1 weight  0.10000E+01 volume  0.12503E-01 ppm1      1.013 ppm2      2.056 CV     1
 ASSI { 2632}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 68   and name HN  ))
      3.600     1.600     1.600 peak  2632 spectrum    1 weight  0.10000E+01 volume  0.25708E-02 ppm1      0.515 ppm2      9.447 CV     1
 ASSI { 2634}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 98   and name HN  ))
      3.500     1.600     1.600 peak  2634 spectrum    1 weight  0.10000E+01 volume  0.23957E-02 ppm1      0.511 ppm2      7.681 CV     1
 ASSI { 2635}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 67   and name HA  ))
      4.000     2.000     2.000 peak  2635 spectrum    1 weight  0.10000E+01 volume  0.20899E-02 ppm1      0.518 ppm2      5.285 CV     1
 ASSI { 2643}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 28   and name HN  ))
      4.100     2.100     1.900 peak  2643 spectrum    1 weight  0.10000E+01 volume  0.11176E-02 ppm1      0.300 ppm2      8.965 CV     1
 ASSI { 2653}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 72   and name HN  ))
      4.300     2.300     1.700 peak  2653 spectrum    1 weight  0.10000E+01 volume  0.85131E-03 ppm1      0.277 ppm2      8.730 CV     1
 ASSI { 2658}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 71   and name HA  ))
      2.500     0.800     0.800 peak  2658 spectrum    1 weight  0.10000E+01 volume  0.32863E-02 ppm1      0.282 ppm2      4.805 CV     1
 ASSI { 2659}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HA  ))
      2.300     0.700     0.700 peak  2659 spectrum    1 weight  0.10000E+01 volume  0.63033E-02 ppm1      0.287 ppm2      4.454 CV     1
 ASSI { 2660}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HB  ))
      2.000     0.500     0.500 peak  2660 spectrum    1 weight  0.10000E+01 volume  0.15972E-01 ppm1      0.284 ppm2      1.524 CV     1
 ASSI { 2667}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 70   and name HN  ))
      3.200     1.300     1.300 peak  2667 spectrum    1 weight  0.10000E+01 volume  0.41095E-02 ppm1     -0.138 ppm2      8.540 CV     1
 ASSI { 2668}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 69   and name HN  ))
      3.500     1.500     1.500 peak  2668 spectrum    1 weight  0.10000E+01 volume  0.27466E-02 ppm1     -0.149 ppm2      8.024 CV     1
 ASSI { 2674}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 98   and name HA  ))
      2.800     1.000     1.000 peak  2674 spectrum    1 weight  0.10000E+01 volume  0.33521E-02 ppm1     -0.142 ppm2      4.475 CV     1
 ASSI { 2679}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 69   and name HG12))
      2.300     0.700     0.700 peak  2679 spectrum    1 weight  0.10000E+01 volume  0.67075E-02 ppm1     -0.136 ppm2      0.107 CV     1
 ASSI { 2687}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 23   and name HN  ))
      3.600     1.600     1.600 peak  2687 spectrum    1 weight  0.10000E+01 volume  0.30853E-02 ppm1      1.506 ppm2      8.157 CV     1
 ASSI { 2688}
   (  segid "    " and resid 22   and name HB% )
   (  segid "    " and resid 99   and name HD% )
      3.100     1.200     1.200 peak  2688 spectrum    1 weight  0.10000E+01 volume  0.17425E-02 ppm1      1.500 ppm2      6.808 CV     1
 ASSI { 2696}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HA  ))
      2.400     0.700     0.700 peak  2696 spectrum    1 weight  0.10000E+01 volume  0.81218E-02 ppm1      0.540 ppm2      3.929 CV     1
 ASSI { 2732}
   (  segid "    " and resid 57   and name HD1%)
   (( segid "    " and resid 63   and name HN  ))
      3.600     1.600     1.600 peak  2732 spectrum    1 weight  0.10000E+01 volume  0.15124E-02 ppm1      0.979 ppm2      7.880 CV     1
 ASSI { 2734}
   (  segid "    " and resid 57   and name HD1%)
   (  segid "    " and resid 55   and name HD% )
      3.200     1.300     1.300 peak  2734 spectrum    1 weight  0.10000E+01 volume  0.30795E-02 ppm1      0.981 ppm2      6.651 CV     1
 ASSI { 2736}
   (  segid "    " and resid 57   and name HD1%)
   (( segid "    " and resid 64   and name HA  ))
      3.000     1.200     1.200 peak  2736 spectrum    1 weight  0.10000E+01 volume  0.24365E-02 ppm1      0.983 ppm2      5.070 CV     1
 ASSI { 2745}
   (  segid "    " and resid 57   and name HD1%)
   (( segid "    " and resid 57   and name HG12))
      2.200     0.600     0.600 peak  2745 spectrum    1 weight  0.10000E+01 volume  0.83856E-02 ppm1      0.983 ppm2      1.753 CV     1
 ASSI { 2746}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 138  and name HB  ))
      3.300     1.300     1.300 peak  2746 spectrum    1 weight  0.10000E+01 volume  0.16068E-02 ppm1      0.475 ppm2      3.975 CV     1
 ASSI { 2750}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 98   and name HN  ))
      3.000     1.100     1.100 peak  2750 spectrum    1 weight  0.10000E+01 volume  0.28014E-02 ppm1      0.453 ppm2      7.663 CV     1
 ASSI { 2751}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 26   and name HN  ))
      3.600     1.600     1.600 peak  2751 spectrum    1 weight  0.10000E+01 volume  0.13989E-02 ppm1      0.459 ppm2      6.842 CV     1
 ASSI { 2753}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 98   and name HA  ))
      3.300     1.300     1.300 peak  2753 spectrum    1 weight  0.10000E+01 volume  0.31190E-02 ppm1      0.452 ppm2      4.501 CV     1
 ASSI { 2754}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 98   and name HB  ))
      2.200     0.600     0.600 peak  2754 spectrum    1 weight  0.10000E+01 volume  0.11196E-01 ppm1      0.453 ppm2      1.514 CV     1
 ASSI { 2755}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 98   and name HG11))
      2.000     0.500     0.500 peak  2755 spectrum    1 weight  0.10000E+01 volume  0.16072E-01 ppm1      0.462 ppm2      1.339 CV     1
 ASSI { 2776}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 84   and name HN  ))
      4.400     2.400     1.600 peak  2776 spectrum    1 weight  0.10000E+01 volume  0.55615E-03 ppm1     -0.575 ppm2      9.450 CV     1
 ASSI { 2780}
   (  segid "    " and resid 69   and name HD1%)
   (  segid "    " and resid 54   and name HE% )
      2.900     1.100     1.100 peak  2780 spectrum    1 weight  0.10000E+01 volume  0.25221E-02 ppm1     -0.589 ppm2      7.265 CV     1
 OR { 2780}
   (  segid "    " and resid 69   and name HD1%)
   (  segid "    " and resid 54   and name HD% )
 ASSI { 2781}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 68   and name HA  ))
      5.500     3.800     0.500 peak  2781 spectrum    1 weight  0.10000E+01 volume  0.57737E-03 ppm1     -0.575 ppm2      5.166 CV     1
 ASSI { 2783}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 84   and name HB1 ))
      3.300     1.400     1.400 peak  2783 spectrum    1 weight  0.10000E+01 volume  0.26224E-02 ppm1     -0.579 ppm2      3.062 CV     1
 ASSI { 2787}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HG12))
      2.100     0.500     0.500 peak  2787 spectrum    1 weight  0.10000E+01 volume  0.12177E-01 ppm1     -0.584 ppm2      0.132 CV     1
 ASSI { 2790}
   (  segid "    " and resid 69   and name HD1%)
   (  segid "    " and resid 84   and name HD% )
      3.400     1.500     1.500 peak  2790 spectrum    1 weight  0.10000E+01 volume  0.20195E-02 ppm1     -0.591 ppm2      6.927 CV     1
 ASSI { 2791}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 54   and name HZ  ))
      3.700     1.800     1.800 peak  2791 spectrum    1 weight  0.10000E+01 volume  0.13048E-02 ppm1     -0.593 ppm2      6.753 CV     1
 ASSI { 2795}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HN  ))
      3.400     1.400     1.400 peak  2795 spectrum    1 weight  0.10000E+01 volume  0.34356E-02 ppm1      0.402 ppm2      8.559 CV     1
 ASSI { 2796}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 26   and name HN  ))
      3.900     1.900     1.900 peak  2796 spectrum    1 weight  0.10000E+01 volume  0.15839E-02 ppm1      0.399 ppm2      6.859 CV     1
 ASSI { 2815}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 114  and name HN  ))
      3.100     1.200     1.200 peak  2815 spectrum    1 weight  0.10000E+01 volume  0.45191E-02 ppm1      3.887 ppm2      8.846 CV     1
 ASSI { 2816}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 113  and name HN  ))
      2.500     0.800     0.800 peak  2816 spectrum    1 weight  0.10000E+01 volume  0.43238E-02 ppm1      3.888 ppm2      8.721 CV     1
 ASSI { 2817}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 115  and name HN  ))
      4.500     2.600     1.500 peak  2817 spectrum    1 weight  0.10000E+01 volume  0.41889E-03 ppm1      3.887 ppm2      7.965 CV     1
 ASSI { 2818}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 113  and name HA  ))
      2.500     0.800     0.800 peak  2818 spectrum    1 weight  0.10000E+01 volume  0.63512E-02 ppm1      3.884 ppm2      5.801 CV     1
 ASSI { 2822}
   (( segid "    " and resid 113  and name HB  ))
   (  segid "    " and resid 113  and name HG2%)
      2.100     0.600     0.600 peak  2822 spectrum    1 weight  0.10000E+01 volume  0.16381E-01 ppm1      3.883 ppm2      1.166 CV     1
 ASSI { 2824}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 96   and name HN  ))
      2.600     0.800     0.800 peak  2824 spectrum    1 weight  0.10000E+01 volume  0.47218E-02 ppm1      3.751 ppm2      9.181 CV     1
 ASSI { 2825}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 28   and name HN  ))
      3.600     1.600     1.600 peak  2825 spectrum    1 weight  0.10000E+01 volume  0.14929E-02 ppm1      3.756 ppm2      8.940 CV     1
 ASSI { 2826}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 95   and name HN  ))
      3.000     1.100     1.100 peak  2826 spectrum    1 weight  0.10000E+01 volume  0.33029E-02 ppm1      3.753 ppm2      8.415 CV     1
 ASSI { 2827}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 95   and name HA  ))
      2.300     0.700     0.700 peak  2827 spectrum    1 weight  0.10000E+01 volume  0.76062E-02 ppm1      3.752 ppm2      5.152 CV     1
 ASSI { 2832}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 27   and name HB1 ))
      2.800     1.000     1.000 peak  2832 spectrum    1 weight  0.10000E+01 volume  0.27341E-02 ppm1      3.749 ppm2      1.934 CV     1
 ASSI { 2833}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 27   and name HB2 ))
      2.700     0.900     0.900 peak  2833 spectrum    1 weight  0.10000E+01 volume  0.35013E-02 ppm1      3.756 ppm2      1.617 CV     1
 ASSI { 2847}
   (( segid "    " and resid 29   and name HB  ))
   (  segid "    " and resid 28   and name HG1%)
      4.000     2.000     2.000 peak  2847 spectrum    1 weight  0.10000E+01 volume  0.93957E-03 ppm1      4.296 ppm2      0.680 CV     1
 ASSI { 2851}
   (( segid "    " and resid 117  and name HB  ))
   (( segid "    " and resid 43   and name HB2 ))
      3.000     1.200     1.200 peak  2851 spectrum    1 weight  0.10000E+01 volume  0.11812E-02 ppm1      3.909 ppm2     -0.431 CV     1
 ASSI { 2854}
   (( segid "    " and resid 135  and name HB  ))
   (( segid "    " and resid 135  and name HN  ))
      2.400     0.700     0.700 peak  2854 spectrum    1 weight  0.10000E+01 volume  0.79818E-02 ppm1      3.889 ppm2      8.442 CV     1
 ASSI { 2855}
   (( segid "    " and resid 135  and name HB  ))
   (( segid "    " and resid 135  and name HA  ))
      2.700     0.900     0.900 peak  2855 spectrum    1 weight  0.10000E+01 volume  0.31449E-02 ppm1      3.885 ppm2      5.251 CV     1
 ASSI { 2856}
   (( segid "    " and resid 135  and name HB  ))
   (  segid "    " and resid 135  and name HG2%)
      2.200     0.600     0.600 peak  2856 spectrum    1 weight  0.10000E+01 volume  0.16206E-01 ppm1      3.892 ppm2      1.099 CV     1
 ASSI { 2865}
   (( segid "    " and resid 29   and name HB  ))
   (( segid "    " and resid 29   and name HN  ))
      3.200     1.200     1.200 peak  2865 spectrum    1 weight  0.10000E+01 volume  0.26148E-02 ppm1      4.299 ppm2      8.327 CV     1
 ASSI { 2869}
   (( segid "    " and resid 29   and name HB  ))
   (  segid "    " and resid 29   and name HG2%)
      2.000     0.500     0.500 peak  2869 spectrum    1 weight  0.10000E+01 volume  0.24209E-01 ppm1      4.296 ppm2      1.124 CV     1
 ASSI { 2870}
   (( segid "    " and resid 29   and name HB  ))
   (( segid "    " and resid 30   and name HN  ))
      4.800     2.800     1.200 peak  2870 spectrum    1 weight  0.10000E+01 volume  0.53406E-03 ppm1      4.285 ppm2      8.571 CV     1
 ASSI { 2877}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 137  and name HN  ))
      2.400     0.700     0.700 peak  2877 spectrum    1 weight  0.10000E+01 volume  0.61320E-02 ppm1      3.782 ppm2      9.400 CV     1
 ASSI { 2878}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 137  and name HA  ))
      2.800     1.000     1.000 peak  2878 spectrum    1 weight  0.10000E+01 volume  0.29961E-02 ppm1      3.776 ppm2      4.918 CV     1
 ASSI { 2884}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 139  and name HE1 ))
      3.700     1.800     1.800 peak  2884 spectrum    1 weight  0.10000E+01 volume  0.56655E-03 ppm1      3.769 ppm2      2.860 CV     1
 ASSI { 2899}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 18   and name HN  ))
      4.100     2.100     1.900 peak  2899 spectrum    1 weight  0.10000E+01 volume  0.55532E-03 ppm1      4.445 ppm2      7.796 CV     1
 ASSI { 2902}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 15   and name HA  ))
      2.100     0.600     0.600 peak  2902 spectrum    1 weight  0.10000E+01 volume  0.89164E-02 ppm1      4.433 ppm2      5.064 CV     1
 ASSI { 2907}
   (( segid "    " and resid 11   and name HB  ))
   (( segid "    " and resid 11   and name HN  ))
      2.400     0.700     0.700 peak  2907 spectrum    1 weight  0.10000E+01 volume  0.72127E-02 ppm1      3.991 ppm2      8.706 CV     1
 ASSI { 2913}
   (( segid "    " and resid 141  and name HB  ))
   (( segid "    " and resid 141  and name HN  ))
      2.300     0.600     0.600 peak  2913 spectrum    1 weight  0.10000E+01 volume  0.82097E-02 ppm1      3.923 ppm2      8.906 CV     1
 ASSI { 2914}
   (( segid "    " and resid 141  and name HB  ))
   (( segid "    " and resid 14   and name HN  ))
      3.800     1.800     1.800 peak  2914 spectrum    1 weight  0.10000E+01 volume  0.19391E-02 ppm1      3.919 ppm2      8.691 CV     1
 ASSI { 2915}
   (( segid "    " and resid 141  and name HB  ))
   (( segid "    " and resid 13   and name HA  ))
      2.400     0.700     0.700 peak  2915 spectrum    1 weight  0.10000E+01 volume  0.58637E-02 ppm1      3.912 ppm2      5.505 CV     1
 ASSI { 2916}
   (( segid "    " and resid 141  and name HB  ))
   (( segid "    " and resid 141  and name HA  ))
      2.900     1.000     1.000 peak  2916 spectrum    1 weight  0.10000E+01 volume  0.29340E-02 ppm1      3.919 ppm2      5.122 CV     1
 ASSI { 2919}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 116  and name HN  ))
      3.500     1.600     1.600 peak  2919 spectrum    1 weight  0.10000E+01 volume  0.17271E-02 ppm1      3.872 ppm2      8.663 CV     1
 ASSI { 2920}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 115  and name HN  ))
      2.400     0.700     0.700 peak  2920 spectrum    1 weight  0.10000E+01 volume  0.49583E-02 ppm1      3.864 ppm2      7.991 CV     1
 ASSI { 2921}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 45   and name HN  ))
      3.600     1.600     1.600 peak  2921 spectrum    1 weight  0.10000E+01 volume  0.15050E-02 ppm1      3.861 ppm2      7.663 CV     1
 ASSI { 2931}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 106  and name HD22))
      3.800     1.800     1.800 peak  2931 spectrum    1 weight  0.10000E+01 volume  0.53943E-03 ppm1      4.436 ppm2      6.895 CV     1
 ASSI { 2933}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 20   and name HA  ))
      2.700     0.900     0.900 peak  2933 spectrum    1 weight  0.10000E+01 volume  0.38825E-02 ppm1      4.439 ppm2      4.027 CV     1
 ASSI { 2938}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 16   and name HD2 ))
      4.500     2.500     1.500 peak  2938 spectrum    1 weight  0.10000E+01 volume  0.55908E-03 ppm1      4.429 ppm2      3.070 CV     1
 ASSI { 2939}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 106  and name HB2 ))
      3.500     1.500     1.500 peak  2939 spectrum    1 weight  0.10000E+01 volume  0.62323E-03 ppm1      4.426 ppm2      2.830 CV     1
 ASSI { 2946}
   (( segid "    " and resid 79   and name HB  ))
   (  segid "    " and resid 78   and name HG2%)
      4.000     2.000     2.000 peak  2946 spectrum    1 weight  0.10000E+01 volume  0.16487E-02 ppm1      4.103 ppm2      0.821 CV     1
 ASSI { 2951}
   (( segid "    " and resid 79   and name HB  ))
   (  segid "    " and resid 84   and name HD% )
      4.300     2.300     1.700 peak  2951 spectrum    1 weight  0.10000E+01 volume  0.55425E-03 ppm1      4.088 ppm2      6.902 CV     1
 ASSI { 2952}
   (( segid "    " and resid 79   and name HB  ))
   (( segid "    " and resid 84   and name HA  ))
      4.600     2.700     1.400 peak  2952 spectrum    1 weight  0.10000E+01 volume  0.59442E-03 ppm1      4.088 ppm2      5.617 CV     1
 ASSI { 2958}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 113  and name HA  ))
      4.700     2.800     1.300 peak  2958 spectrum    1 weight  0.10000E+01 volume  0.76338E-03 ppm1      3.976 ppm2      5.771 CV     1
 ASSI { 2959}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 138  and name HN  ))
      2.600     0.900     0.900 peak  2959 spectrum    1 weight  0.10000E+01 volume  0.37319E-02 ppm1      3.968 ppm2      9.519 CV     1
 ASSI { 2963}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 114  and name HB2 ))
      2.900     1.000     1.000 peak  2963 spectrum    1 weight  0.10000E+01 volume  0.55355E-02 ppm1      3.968 ppm2      1.499 CV     1
 OR { 2963}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI { 2965}
   (( segid "    " and resid 138  and name HB  ))
   (  segid "    " and resid 114  and name HD1%)
      2.700     0.900     0.900 peak  2965 spectrum    1 weight  0.10000E+01 volume  0.35834E-02 ppm1      3.974 ppm2      0.544 CV     1
 ASSI { 2970}
   (( segid "    " and resid 105  and name HB  ))
   (( segid "    " and resid 107  and name HA  ))
      4.000     2.000     2.000 peak  2970 spectrum    1 weight  0.10000E+01 volume  0.32191E-03 ppm1      4.378 ppm2      4.072 CV     1
 ASSI { 2971}
   (( segid "    " and resid 105  and name HB  ))
   (( segid "    " and resid 106  and name HN  ))
      3.400     1.500     1.500 peak  2971 spectrum    1 weight  0.10000E+01 volume  0.11192E-02 ppm1      4.366 ppm2      8.241 CV     1
 ASSI { 2973}
   (( segid "    " and resid 105  and name HB  ))
   (( segid "    " and resid 105  and name HN  ))
      3.500     1.500     1.500 peak  2973 spectrum    1 weight  0.10000E+01 volume  0.15162E-02 ppm1      4.349 ppm2      7.656 CV     1
 ASSI { 2976}
   (( segid "    " and resid 105  and name HB  ))
   (  segid "    " and resid 105  and name HG2%)
      2.300     0.600     0.600 peak  2976 spectrum    1 weight  0.10000E+01 volume  0.12585E-01 ppm1      4.359 ppm2      1.118 CV     1
 ASSI { 2978}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 48   and name HN  ))
      4.700     2.700     1.300 peak  2978 spectrum    1 weight  0.10000E+01 volume  0.67570E-03 ppm1      4.238 ppm2      7.804 CV     1
 ASSI { 2979}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 46   and name HN  ))
      2.500     0.800     0.800 peak  2979 spectrum    1 weight  0.10000E+01 volume  0.92739E-02 ppm1      4.222 ppm2      8.389 CV     1
 ASSI { 2980}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 49   and name HN  ))
      4.200     2.200     1.800 peak  2980 spectrum    1 weight  0.10000E+01 volume  0.10752E-02 ppm1      4.223 ppm2      6.924 CV     1
 ASSI { 2982}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 46   and name HA  ))
      2.000     0.500     0.500 peak  2982 spectrum    1 weight  0.10000E+01 volume  0.17406E-01 ppm1      4.221 ppm2      4.053 CV     1
 ASSI { 2988}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 81   and name HD22))
      4.900     3.000     1.100 peak  2988 spectrum    1 weight  0.10000E+01 volume  0.32144E-03 ppm1      7.285 ppm2      6.959 CV     1
 ASSI { 2989}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 66   and name HN  ))
      2.600     0.900     0.900 peak  2989 spectrum    1 weight  0.10000E+01 volume  0.36691E-02 ppm1      7.263 ppm2      9.595 CV     1
 ASSI { 2990}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 67   and name HN  ))
      4.000     2.000     2.000 peak  2990 spectrum    1 weight  0.10000E+01 volume  0.15017E-02 ppm1      7.269 ppm2      8.716 CV     1
 ASSI { 2991}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 81   and name HD21))
      3.600     1.600     1.600 peak  2991 spectrum    1 weight  0.10000E+01 volume  0.62662E-03 ppm1      7.272 ppm2      7.721 CV     1
 ASSI { 2992}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 66   and name HE% )
      2.100     0.500     0.500 peak  2992 spectrum    1 weight  0.10000E+01 volume  0.16924E-01 ppm1      7.267 ppm2      6.623 CV     1
 ASSI { 2993}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 66   and name HA  ))
      2.900     1.000     1.000 peak  2993 spectrum    1 weight  0.10000E+01 volume  0.24755E-02 ppm1      7.263 ppm2      4.849 CV     1
 ASSI { 2994}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 66   and name HB1 ))
      2.600     0.800     0.800 peak  2994 spectrum    1 weight  0.10000E+01 volume  0.42846E-02 ppm1      7.267 ppm2      3.445 CV     1
 ASSI { 2995}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 66   and name HB2 ))
      2.600     0.800     0.800 peak  2995 spectrum    1 weight  0.10000E+01 volume  0.42599E-02 ppm1      7.267 ppm2      3.035 CV     1
 ASSI { 2998}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 53   and name HB2 ))
      3.400     1.500     1.500 peak  2998 spectrum    1 weight  0.10000E+01 volume  0.23835E-02 ppm1      7.263 ppm2      1.981 CV     1
 ASSI { 2999}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 65   and name HB1 ))
      3.600     1.600     1.600 peak  2999 spectrum    1 weight  0.10000E+01 volume  0.20361E-02 ppm1      7.265 ppm2      1.513 CV     1
 ASSI { 3002}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 101  and name HN  ))
      4.000     2.000     2.000 peak  3002 spectrum    1 weight  0.10000E+01 volume  0.57679E-03 ppm1      7.248 ppm2      8.485 CV     1
 ASSI { 3003}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 54   and name HN  ))
      3.600     1.600     1.600 peak  3003 spectrum    1 weight  0.10000E+01 volume  0.68346E-03 ppm1      7.251 ppm2      8.372 CV     1
 ASSI { 3004}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 55   and name HA  ))
      3.800     1.800     1.800 peak  3004 spectrum    1 weight  0.10000E+01 volume  0.12082E-02 ppm1      7.262 ppm2      5.283 CV     1
 ASSI { 3022}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 99   and name HB1 ))
      2.200     0.600     0.600 peak  3022 spectrum    1 weight  0.10000E+01 volume  0.85437E-02 ppm1      6.805 ppm2      2.517 CV     1
 OR { 3022}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 3030}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 111  and name HA  ))
      3.700     1.700     1.700 peak  3030 spectrum    1 weight  0.10000E+01 volume  0.10974E-02 ppm1      6.769 ppm2      5.585 CV     1
 ASSI { 3032}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 112  and name HB1 ))
      2.500     0.800     0.800 peak  3032 spectrum    1 weight  0.10000E+01 volume  0.38529E-02 ppm1      6.768 ppm2      2.682 CV     1
 OR { 3032}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 112  and name HB2 ))
 ASSI { 3036}
   (  segid "    " and resid 112  and name HD% )
   (  segid "    " and resid 140  and name HD2%)
      2.800     1.000     1.000 peak  3036 spectrum    1 weight  0.10000E+01 volume  0.35121E-02 ppm1      6.765 ppm2      0.610 CV     1
 OR { 3036}
   (  segid "    " and resid 112  and name HD% )
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 3038}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 58   and name HB2 ))
      3.900     1.900     1.900 peak  3038 spectrum    1 weight  0.10000E+01 volume  0.44663E-03 ppm1      6.763 ppm2      3.498 CV     1
 OR { 3038}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 58   and name HB1 ))
 ASSI { 3040}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 120  and name HA  ))
      3.700     1.700     1.700 peak  3040 spectrum    1 weight  0.10000E+01 volume  0.10527E-02 ppm1      6.636 ppm2      5.740 CV     1
 ASSI { 3043}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 120  and name HB1 ))
      2.700     0.900     0.900 peak  3043 spectrum    1 weight  0.10000E+01 volume  0.28629E-02 ppm1      6.630 ppm2      2.997 CV     1
 ASSI { 3052}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 49   and name HE% )
      2.400     0.700     0.700 peak  3052 spectrum    1 weight  0.10000E+01 volume  0.50587E-02 ppm1      6.542 ppm2      6.917 CV     1
 ASSI { 3054}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 82   and name HA1 ))
      4.900     3.000     1.100 peak  3054 spectrum    1 weight  0.10000E+01 volume  0.57167E-03 ppm1      6.544 ppm2      3.162 CV     1
 ASSI { 3055}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 49   and name HB1 ))
      2.800     1.000     1.000 peak  3055 spectrum    1 weight  0.10000E+01 volume  0.22696E-02 ppm1      6.545 ppm2      2.675 CV     1
 ASSI { 3056}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 49   and name HB2 ))
      2.800     1.000     1.000 peak  3056 spectrum    1 weight  0.10000E+01 volume  0.21311E-02 ppm1      6.554 ppm2      2.520 CV     1
 ASSI { 3059}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 50   and name HN  ))
      3.600     1.600     1.600 peak  3059 spectrum    1 weight  0.10000E+01 volume  0.96595E-03 ppm1      6.535 ppm2      8.377 CV     1
 ASSI { 3061}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 48   and name HN  ))
      6.000     4.800     0.000 peak  3061 spectrum    1 weight  0.10000E+01 volume  0.25296E-03 ppm1      6.536 ppm2      7.794 CV     1
 ASSI { 3065}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 50   and name HA  ))
      3.400     1.400     1.400 peak  3065 spectrum    1 weight  0.10000E+01 volume  0.96186E-03 ppm1      6.535 ppm2      4.390 CV     1
 ASSI { 3068}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 43   and name HG1 ))
      4.400     2.400     1.600 peak  3068 spectrum    1 weight  0.10000E+01 volume  0.44432E-03 ppm1      6.539 ppm2      1.232 CV     1
 ASSI { 3069}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 121  and name HE1 ))
      3.500     1.500     1.500 peak  3069 spectrum    1 weight  0.10000E+01 volume  0.85697E-03 ppm1      6.025 ppm2      9.475 CV     1
 ASSI { 3072}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 39   and name HN  ))
      3.700     1.700     1.700 peak  3072 spectrum    1 weight  0.10000E+01 volume  0.16997E-02 ppm1      6.018 ppm2      8.180 CV     1
 ASSI { 3088}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 55   and name HZ  ))
      3.900     1.900     1.900 peak  3088 spectrum    1 weight  0.10000E+01 volume  0.13222E-02 ppm1      6.660 ppm2      6.955 CV     1
 ASSI { 3090}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 56   and name HN  ))
      3.600     1.600     1.600 peak  3090 spectrum    1 weight  0.10000E+01 volume  0.10427E-02 ppm1      6.656 ppm2      8.892 CV     1
 ASSI { 3094}
   (  segid "    " and resid 55   and name HD% )
   (  segid "    " and resid 55   and name HE% )
      2.200     0.600     0.600 peak  3094 spectrum    1 weight  0.10000E+01 volume  0.80982E-02 ppm1      6.655 ppm2      7.199 CV     1
 ASSI { 3096}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 64   and name HA  ))
      3.200     1.300     1.300 peak  3096 spectrum    1 weight  0.10000E+01 volume  0.17271E-02 ppm1      6.651 ppm2      5.081 CV     1
 ASSI { 3099}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 55   and name HB1 ))
      2.500     0.800     0.800 peak  3099 spectrum    1 weight  0.10000E+01 volume  0.37690E-02 ppm1      6.650 ppm2      2.689 CV     1
 ASSI { 3100}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 55   and name HB2 ))
      2.500     0.800     0.800 peak  3100 spectrum    1 weight  0.10000E+01 volume  0.45364E-02 ppm1      6.656 ppm2      2.221 CV     1
 ASSI { 3101}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 57   and name HB  ))
      3.000     1.100     1.100 peak  3101 spectrum    1 weight  0.10000E+01 volume  0.15499E-02 ppm1      6.648 ppm2      2.000 CV     1
 ASSI { 3103}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 64   and name HB2 ))
      2.700     0.900     0.900 peak  3103 spectrum    1 weight  0.10000E+01 volume  0.27013E-02 ppm1      6.659 ppm2      0.680 CV     1
 OR { 3103}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 64   and name HD2 ))
 ASSI { 3105}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 64   and name HG2 ))
      4.000     2.000     2.000 peak  3105 spectrum    1 weight  0.10000E+01 volume  0.83348E-03 ppm1      6.657 ppm2     -0.184 CV     1
 ASSI { 3106}
   (  segid "    " and resid 54   and name HD% )
   (  segid "    " and resid 49   and name HD% )
      4.300     2.300     1.700 peak  3106 spectrum    1 weight  0.10000E+01 volume  0.60812E-03 ppm1      7.312 ppm2      6.548 CV     1
 ASSI { 3109}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 54   and name HB2 ))
      3.200     1.200     1.200 peak  3109 spectrum    1 weight  0.10000E+01 volume  0.20150E-02 ppm1      7.305 ppm2      2.738 CV     1
 ASSI { 3117}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 54   and name HZ  ))
      3.200     1.300     1.300 peak  3117 spectrum    1 weight  0.10000E+01 volume  0.11925E-02 ppm1      6.942 ppm2      6.737 CV     1
 ASSI { 3118}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 77   and name HH2 ))
      3.900     1.900     1.900 peak  3118 spectrum    1 weight  0.10000E+01 volume  0.15678E-02 ppm1      6.944 ppm2      6.613 CV     1
 ASSI { 3119}
   (  segid "    " and resid 84   and name HD% )
   (  segid "    " and resid 84   and name HE% )
      2.000     0.500     0.500 peak  3119 spectrum    1 weight  0.10000E+01 volume  0.13014E-01 ppm1      6.944 ppm2      6.209 CV     1
 ASSI { 3120}
   (  segid "    " and resid 84   and name HD% )
   (  segid "    " and resid 85   and name HD% )
      4.200     2.200     1.800 peak  3120 spectrum    1 weight  0.10000E+01 volume  0.17612E-02 ppm1      6.941 ppm2      5.980 CV     1
 ASSI { 3121}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 84   and name HA  ))
      2.600     0.900     0.900 peak  3121 spectrum    1 weight  0.10000E+01 volume  0.44836E-02 ppm1      6.939 ppm2      5.617 CV     1
 ASSI { 3122}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 84   and name HB1 ))
      2.400     0.700     0.700 peak  3122 spectrum    1 weight  0.10000E+01 volume  0.57452E-02 ppm1      6.946 ppm2      3.073 CV     1
 ASSI { 3123}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 84   and name HB2 ))
      2.300     0.700     0.700 peak  3123 spectrum    1 weight  0.10000E+01 volume  0.48634E-02 ppm1      6.942 ppm2      2.676 CV     1
 ASSI { 3130}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 69   and name HG11))
      2.900     1.000     1.000 peak  3130 spectrum    1 weight  0.10000E+01 volume  0.12652E-02 ppm1      6.947 ppm2      0.289 CV     1
 ASSI { 3142}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 101  and name HN  ))
      2.200     0.600     0.600 peak  3142 spectrum    1 weight  0.10000E+01 volume  0.70233E-02 ppm1      3.508 ppm2      8.517 CV     1
 ASSI { 3146}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 67   and name HA  ))
      2.600     0.800     0.800 peak  3146 spectrum    1 weight  0.10000E+01 volume  0.33827E-02 ppm1      3.505 ppm2      5.287 CV     1
 ASSI { 3151}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 54   and name HZ  ))
      3.800     1.800     1.800 peak  3151 spectrum    1 weight  0.10000E+01 volume  0.15605E-02 ppm1      7.307 ppm2      6.738 CV     1
 ASSI { 3154}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 53   and name HA  ))
      4.400     2.400     1.600 peak  3154 spectrum    1 weight  0.10000E+01 volume  0.64874E-03 ppm1      7.299 ppm2      4.731 CV     1
 ASSI { 3155}
   (  segid "    " and resid 54   and name HD% )
   (  segid "    " and resid 44   and name HB% )
      2.700     0.900     0.900 peak  3155 spectrum    1 weight  0.10000E+01 volume  0.26053E-02 ppm1      7.295 ppm2      1.548 CV     1
 ASSI { 3157}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 69   and name HG12))
      4.000     2.000     2.000 peak  3157 spectrum    1 weight  0.10000E+01 volume  0.46516E-03 ppm1      7.297 ppm2      0.095 CV     1
 ASSI { 3159}
   (  segid "    " and resid 54   and name HD% )
   (  segid "    " and resid 69   and name HD1%)
      3.700     1.700     1.700 peak  3159 spectrum    1 weight  0.10000E+01 volume  0.68193E-03 ppm1      7.305 ppm2     -0.587 CV     1
 ASSI { 3169}
   (  segid "    " and resid 54   and name HE% )
   (  segid "    " and resid 69   and name HD1%)
      3.600     1.600     1.600 peak  3169 spectrum    1 weight  0.10000E+01 volume  0.67244E-03 ppm1      7.224 ppm2     -0.594 CV     1
 ASSI { 3175}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      2.500     0.800     0.800 peak  3175 spectrum    1 weight  0.10000E+01 volume  0.40383E-02 ppm1      4.047 ppm2      6.914 CV     1
 ASSI { 3176}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 49   and name HD% )
      3.900     1.900     1.900 peak  3176 spectrum    1 weight  0.10000E+01 volume  0.10144E-02 ppm1      4.044 ppm2      6.575 CV     1
 ASSI { 3177}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HA  ))
      3.500     1.600     1.600 peak  3177 spectrum    1 weight  0.10000E+01 volume  0.16208E-02 ppm1      4.052 ppm2      4.706 CV     1
 ASSI { 3178}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 45   and name HA  ))
      4.000     2.000     2.000 peak  3178 spectrum    1 weight  0.10000E+01 volume  0.10107E-02 ppm1      4.055 ppm2      4.539 CV     1
 ASSI { 3183}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 57   and name HG12))
      4.500     2.500     1.500 peak  3183 spectrum    1 weight  0.10000E+01 volume  0.27023E-03 ppm1      7.206 ppm2      1.804 CV     1
 ASSI { 3188}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 57   and name HA  ))
      4.600     2.700     1.400 peak  3188 spectrum    1 weight  0.10000E+01 volume  0.67702E-03 ppm1      7.189 ppm2      5.400 CV     1
 ASSI { 3192}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 50   and name HG1 ))
      2.500     0.800     0.800 peak  3192 spectrum    1 weight  0.10000E+01 volume  0.53716E-02 ppm1      7.194 ppm2      2.298 CV     1
 OR { 3192}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 50   and name HB2 ))
 OR { 3192}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 50   and name HB1 ))
 ASSI { 3194}
   (  segid "    " and resid 55   and name HE% )
   (  segid "    " and resid 57   and name HD1%)
      2.800     1.000     1.000 peak  3194 spectrum    1 weight  0.10000E+01 volume  0.38058E-02 ppm1      7.198 ppm2      0.997 CV     1
 OR { 3194}
   (  segid "    " and resid 55   and name HE% )
   (  segid "    " and resid 57   and name HG2%)
 ASSI { 3198}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 82   and name HA2 ))
      3.100     1.200     1.200 peak  3198 spectrum    1 weight  0.10000E+01 volume  0.93652E-03 ppm1      6.941 ppm2      2.215 CV     1
 ASSI { 3201}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 77   and name HE1 ))
      4.200     2.300     1.800 peak  3201 spectrum    1 weight  0.10000E+01 volume  0.38142E-03 ppm1      4.208 ppm2      9.185 CV     1
 ASSI { 3202}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 76   and name HN  ))
      2.800     1.000     1.000 peak  3202 spectrum    1 weight  0.10000E+01 volume  0.18673E-02 ppm1      4.200 ppm2      8.133 CV     1
 ASSI { 3203}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HN  ))
      3.600     1.600     1.600 peak  3203 spectrum    1 weight  0.10000E+01 volume  0.12182E-02 ppm1      4.203 ppm2      7.844 CV     1
 ASSI { 3205}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HA  ))
      2.500     0.800     0.800 peak  3205 spectrum    1 weight  0.10000E+01 volume  0.61113E-02 ppm1      4.209 ppm2      3.804 CV     1
 ASSI { 3208}
   (( segid "    " and resid 75   and name HB1 ))
   (  segid "    " and resid 76   and name HB% )
      4.700     2.800     1.300 peak  3208 spectrum    1 weight  0.10000E+01 volume  0.49988E-03 ppm1      4.202 ppm2      1.336 CV     1
 ASSI { 3210}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      2.100     0.500     0.500 peak  3210 spectrum    1 weight  0.10000E+01 volume  0.95864E-02 ppm1      3.924 ppm2      8.777 CV     1
 ASSI { 3213}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 120  and name HA  ))
      2.800     1.000     1.000 peak  3213 spectrum    1 weight  0.10000E+01 volume  0.25993E-02 ppm1      3.923 ppm2      5.735 CV     1
 ASSI { 3215}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB  ))
      2.700     0.900     0.900 peak  3215 spectrum    1 weight  0.10000E+01 volume  0.30076E-02 ppm1      3.932 ppm2      1.984 CV     1
 ASSI { 3218}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 40   and name HG2%)
      2.300     0.700     0.700 peak  3218 spectrum    1 weight  0.10000E+01 volume  0.88454E-02 ppm1      3.930 ppm2      1.221 CV     1
 OR { 3218}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 40   and name HG1%)
 ASSI { 3220}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 120  and name HB1 ))
      3.700     1.700     1.700 peak  3220 spectrum    1 weight  0.10000E+01 volume  0.11097E-02 ppm1      3.914 ppm2      2.976 CV     1
 ASSI { 3229}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 52   and name HA1 ))
      3.600     1.600     1.600 peak  3229 spectrum    1 weight  0.10000E+01 volume  0.39107E-02 ppm1      6.927 ppm2      4.046 CV     1
 ASSI { 3230}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 52   and name HA2 ))
      3.500     1.600     1.600 peak  3230 spectrum    1 weight  0.10000E+01 volume  0.83286E-03 ppm1      6.931 ppm2      3.764 CV     1
 ASSI { 3244}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 84   and name HZ  ))
      2.100     0.600     0.600 peak  3244 spectrum    1 weight  0.10000E+01 volume  0.10131E-01 ppm1      6.222 ppm2      6.385 CV     1
 ASSI { 3246}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 84   and name HB2 ))
      4.400     2.400     1.600 peak  3246 spectrum    1 weight  0.10000E+01 volume  0.56812E-03 ppm1      6.231 ppm2      2.666 CV     1
 ASSI { 3247}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 77   and name HB1 ))
      3.200     1.300     1.300 peak  3247 spectrum    1 weight  0.10000E+01 volume  0.14016E-02 ppm1      6.224 ppm2      2.049 CV     1
 ASSI { 3252}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 69   and name HG11))
      3.200     1.300     1.300 peak  3252 spectrum    1 weight  0.10000E+01 volume  0.15559E-02 ppm1      6.227 ppm2      0.310 CV     1
 ASSI { 3255}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 70   and name HA  ))
      2.900     1.100     1.100 peak  3255 spectrum    1 weight  0.10000E+01 volume  0.15057E-02 ppm1      6.213 ppm2      4.876 CV     1
 ASSI { 3258}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 79   and name HB  ))
      3.700     1.800     1.800 peak  3258 spectrum    1 weight  0.10000E+01 volume  0.60540E-03 ppm1      6.211 ppm2      4.116 CV     1
 ASSI { 3262}
   (  segid "    " and resid 84   and name HE% )
   (  segid "    " and resid 79   and name HG2%)
      4.600     2.700     1.400 peak  3262 spectrum    1 weight  0.10000E+01 volume  0.49493E-03 ppm1      6.220 ppm2      1.225 CV     1
 ASSI { 3265}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 106  and name HN  ))
      3.500     1.600     1.600 peak  3265 spectrum    1 weight  0.10000E+01 volume  0.97342E-03 ppm1      4.495 ppm2      8.238 CV     1
 ASSI { 3266}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      4.600     2.600     1.400 peak  3266 spectrum    1 weight  0.10000E+01 volume  0.45282E-03 ppm1      4.494 ppm2      7.185 CV     1
 ASSI { 3272}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      4.000     2.000     2.000 peak  3272 spectrum    1 weight  0.10000E+01 volume  0.13384E-02 ppm1      4.339 ppm2      3.720 CV     1
 ASSI { 3273}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 96   and name HN  ))
      3.600     1.600     1.600 peak  3273 spectrum    1 weight  0.10000E+01 volume  0.21861E-02 ppm1      4.334 ppm2      9.173 CV     1
 ASSI { 3274}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      2.000     0.500     0.500 peak  3274 spectrum    1 weight  0.10000E+01 volume  0.13742E-01 ppm1      4.332 ppm2      8.542 CV     1
 ASSI { 3275}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      2.800     1.000     1.000 peak  3275 spectrum    1 weight  0.10000E+01 volume  0.23916E-02 ppm1      4.336 ppm2      8.313 CV     1
 ASSI { 3276}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 95   and name HA  ))
      2.700     0.900     0.900 peak  3276 spectrum    1 weight  0.10000E+01 volume  0.53604E-02 ppm1      4.334 ppm2      5.163 CV     1
 ASSI { 3279}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      5.000     3.200     1.000 peak  3279 spectrum    1 weight  0.10000E+01 volume  0.44580E-03 ppm1      4.339 ppm2      8.912 CV     1
 ASSI { 3280}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 30   and name HB  ))
      4.400     2.400     1.600 peak  3280 spectrum    1 weight  0.10000E+01 volume  0.12149E-02 ppm1      4.322 ppm2      2.165 CV     1
 ASSI { 3282}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 110  and name HN  ))
      2.300     0.700     0.700 peak  3282 spectrum    1 weight  0.10000E+01 volume  0.93875E-02 ppm1      4.214 ppm2      8.686 CV     1
 ASSI { 3284}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HD2 ))
      3.300     1.400     1.400 peak  3284 spectrum    1 weight  0.10000E+01 volume  0.18143E-02 ppm1      4.204 ppm2      3.705 CV     1
 ASSI { 3287}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HB2 ))
      2.800     1.000     1.000 peak  3287 spectrum    1 weight  0.10000E+01 volume  0.39262E-02 ppm1      4.216 ppm2      1.939 CV     1
 ASSI { 3289}
   (( segid "    " and resid 109  and name HA  ))
   (  segid "    " and resid 107  and name HG2%)
      4.100     2.100     1.900 peak  3289 spectrum    1 weight  0.10000E+01 volume  0.37293E-03 ppm1      4.207 ppm2      0.907 CV     1
 ASSI { 3302}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 63   and name HN  ))
      3.000     1.200     1.200 peak  3302 spectrum    1 weight  0.10000E+01 volume  0.22973E-02 ppm1      3.504 ppm2      7.900 CV     1
 OR { 3302}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 63   and name HN  ))
 ASSI { 3306}
   (( segid "    " and resid 58   and name HB1 ))
   (  segid "    " and resid 112  and name HD% )
      4.400     2.400     1.600 peak  3306 spectrum    1 weight  0.10000E+01 volume  0.63689E-03 ppm1      3.487 ppm2      6.749 CV     1
 ASSI { 3307}
   (( segid "    " and resid 58   and name HB2 ))
   (  segid "    " and resid 112  and name HE% )
      3.000     1.100     1.100 peak  3307 spectrum    1 weight  0.10000E+01 volume  0.17863E-02 ppm1      3.492 ppm2      6.329 CV     1
 OR { 3307}
   (( segid "    " and resid 58   and name HB1 ))
   (  segid "    " and resid 112  and name HE% )
 ASSI { 3308}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 57   and name HA  ))
      4.300     2.300     1.700 peak  3308 spectrum    1 weight  0.10000E+01 volume  0.10143E-02 ppm1      3.491 ppm2      5.385 CV     1
 OR { 3308}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI { 3313}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 57   and name HG12))
      5.400     3.700     0.600 peak  3313 spectrum    1 weight  0.10000E+01 volume  0.49600E-03 ppm1      3.492 ppm2      1.803 CV     1
 OR { 3313}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 57   and name HG12))
 ASSI { 3315}
   (( segid "    " and resid 58   and name HB1 ))
   (  segid "    " and resid 57   and name HD1%)
      4.400     2.400     1.600 peak  3315 spectrum    1 weight  0.10000E+01 volume  0.90911E-03 ppm1      3.486 ppm2      0.989 CV     1
 OR { 3315}
   (( segid "    " and resid 58   and name HB2 ))
   (  segid "    " and resid 57   and name HD1%)
 OR { 3315}
   (( segid "    " and resid 58   and name HB1 ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI { 3318}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 55   and name HN  ))
      4.700     2.800     1.300 peak  3318 spectrum    1 weight  0.10000E+01 volume  0.31590E-03 ppm1      6.961 ppm2      8.017 CV     1
 ASSI { 3319}
   (( segid "    " and resid 55   and name HZ  ))
   (  segid "    " and resid 55   and name HE% )
      2.200     0.600     0.600 peak  3319 spectrum    1 weight  0.10000E+01 volume  0.90213E-02 ppm1      6.958 ppm2      7.196 CV     1
 ASSI { 3322}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 48   and name HA  ))
      3.700     1.700     1.700 peak  3322 spectrum    1 weight  0.10000E+01 volume  0.69275E-03 ppm1      6.960 ppm2      4.332 CV     1
 ASSI { 3323}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 50   and name HG1 ))
      3.200     1.300     1.300 peak  3323 spectrum    1 weight  0.10000E+01 volume  0.24688E-02 ppm1      6.960 ppm2      2.276 CV     1
 OR { 3323}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 50   and name HB2 ))
 OR { 3323}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI { 3325}
   (( segid "    " and resid 55   and name HZ  ))
   (  segid "    " and resid 57   and name HD1%)
      4.400     2.500     1.600 peak  3325 spectrum    1 weight  0.10000E+01 volume  0.79831E-03 ppm1      6.961 ppm2      0.991 CV     1
 OR { 3325}
   (( segid "    " and resid 55   and name HZ  ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI { 3326}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 64   and name HD2 ))
      4.700     2.700     1.300 peak  3326 spectrum    1 weight  0.10000E+01 volume  0.42153E-03 ppm1      6.957 ppm2      0.695 CV     1
 OR { 3326}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 64   and name HB2 ))
 OR { 3326}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 64   and name HG1 ))
 ASSI { 3327}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 64   and name HG2 ))
      4.100     2.100     1.900 peak  3327 spectrum    1 weight  0.10000E+01 volume  0.53468E-03 ppm1      6.954 ppm2     -0.115 CV     1
 ASSI { 3329}
   (( segid "    " and resid 54   and name HZ  ))
   (  segid "    " and resid 54   and name HE% )
      2.600     0.800     0.800 peak  3329 spectrum    1 weight  0.10000E+01 volume  0.46983E-02 ppm1      6.755 ppm2      7.230 CV     1
 ASSI { 3334}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 82   and name HA2 ))
      4.000     2.000     2.000 peak  3334 spectrum    1 weight  0.10000E+01 volume  0.60841E-03 ppm1      6.756 ppm2      2.145 CV     1
 ASSI { 3340}
   (( segid "    " and resid 84   and name HZ  ))
   (  segid "    " and resid 84   and name HD% )
      3.900     1.900     1.900 peak  3340 spectrum    1 weight  0.10000E+01 volume  0.10599E-02 ppm1      6.399 ppm2      6.945 CV     1
 ASSI { 3345}
   (( segid "    " and resid 84   and name HZ  ))
   (( segid "    " and resid 71   and name HD2 ))
      3.600     1.600     1.600 peak  3345 spectrum    1 weight  0.10000E+01 volume  0.15294E-02 ppm1      6.398 ppm2      3.073 CV     1
 ASSI { 3355}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
      4.200     2.200     1.800 peak  3355 spectrum    1 weight  0.10000E+01 volume  0.24567E-03 ppm1      5.175 ppm2      9.214 CV     1
 ASSI { 3361}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 135  and name HA  ))
      2.300     0.700     0.700 peak  3361 spectrum    1 weight  0.10000E+01 volume  0.52052E-02 ppm1      4.934 ppm2      5.277 CV     1
 ASSI { 3363}
   (( segid "    " and resid 117  and name HA  ))
   (  segid "    " and resid 117  and name HG2%)
      2.700     0.900     0.900 peak  3363 spectrum    1 weight  0.10000E+01 volume  0.42206E-02 ppm1      4.945 ppm2      1.400 CV     1
 ASSI { 3366}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 118  and name HA1 ))
      3.300     1.400     1.400 peak  3366 spectrum    1 weight  0.10000E+01 volume  0.50314E-02 ppm1      4.924 ppm2      4.686 CV     1
 ASSI { 3370}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 138  and name HN  ))
      2.100     0.600     0.600 peak  3370 spectrum    1 weight  0.10000E+01 volume  0.86246E-02 ppm1      4.917 ppm2      9.518 CV     1
 ASSI { 3379}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 96   and name HD1%)
      4.800     2.900     1.200 peak  3379 spectrum    1 weight  0.10000E+01 volume  0.80561E-03 ppm1      4.792 ppm2      0.114 CV     1
 ASSI { 3382}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 32   and name HA  ))
      3.300     1.400     1.400 peak  3382 spectrum    1 weight  0.10000E+01 volume  0.70592E-03 ppm1      4.612 ppm2      5.607 CV     1
 ASSI { 3385}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB  ))
      3.000     1.100     1.100 peak  3385 spectrum    1 weight  0.10000E+01 volume  0.23641E-02 ppm1      4.501 ppm2      1.869 CV     1
 ASSI { 3386}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 105  and name HG2%)
      2.600     0.900     0.900 peak  3386 spectrum    1 weight  0.10000E+01 volume  0.48461E-02 ppm1      4.502 ppm2      1.122 CV     1
 ASSI { 3398}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 109  and name HD2 ))
      3.100     1.200     1.200 peak  3398 spectrum    1 weight  0.10000E+01 volume  0.71525E-02 ppm1      4.117 ppm2      3.627 CV     1
 ASSI { 3399}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
      3.900     1.900     1.900 peak  3399 spectrum    1 weight  0.10000E+01 volume  0.50525E-03 ppm1      4.098 ppm2      2.848 CV     1
 ASSI { 3411}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 120  and name HN  ))
      4.400     2.400     1.600 peak  3411 spectrum    1 weight  0.10000E+01 volume  0.82861E-03 ppm1      4.001 ppm2      7.651 CV     1
 ASSI { 3414}
   (( segid "    " and resid 131  and name HA  ))
   (  segid "    " and resid 117  and name HG2%)
      2.900     1.100     1.100 peak  3414 spectrum    1 weight  0.10000E+01 volume  0.26052E-02 ppm1      3.993 ppm2      1.439 CV     1
 ASSI { 3415}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 132  and name HN  ))
      2.100     0.600     0.600 peak  3415 spectrum    1 weight  0.10000E+01 volume  0.68131E-02 ppm1      3.996 ppm2      9.004 CV     1
 ASSI { 3416}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 119  and name HA1 ))
      3.200     1.300     1.300 peak  3416 spectrum    1 weight  0.10000E+01 volume  0.15088E-02 ppm1      3.995 ppm2      4.233 CV     1
 ASSI { 3417}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HB1 ))
      2.300     0.700     0.700 peak  3417 spectrum    1 weight  0.10000E+01 volume  0.51676E-02 ppm1      3.985 ppm2      2.225 CV     1
 ASSI { 3418}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HB2 ))
      3.000     1.100     1.100 peak  3418 spectrum    1 weight  0.10000E+01 volume  0.33059E-02 ppm1      3.992 ppm2      1.987 CV     1
 ASSI { 3420}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 32   and name HN  ))
      3.900     1.900     1.900 peak  3420 spectrum    1 weight  0.10000E+01 volume  0.36764E-03 ppm1      3.821 ppm2      8.804 CV     1
 OR { 3420}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 32   and name HN  ))
 ASSI { 3421}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 91   and name HN  ))
      2.900     1.000     1.000 peak  3421 spectrum    1 weight  0.10000E+01 volume  0.28899E-02 ppm1      3.827 ppm2      8.225 CV     1
 OR { 3421}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 91   and name HN  ))
 ASSI { 3424}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
      2.100     0.500     0.500 peak  3424 spectrum    1 weight  0.10000E+01 volume  0.18553E-01 ppm1      3.823 ppm2      4.063 CV     1
 OR { 3424}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 91   and name HA  ))
 ASSI { 3425}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 35   and name HB2 ))
      3.600     1.600     1.600 peak  3425 spectrum    1 weight  0.10000E+01 volume  0.73238E-03 ppm1      3.819 ppm2      2.701 CV     1
 OR { 3425}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 35   and name HB2 ))
 ASSI { 3430}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 49   and name HE% )
      2.200     0.600     0.600 peak  3430 spectrum    1 weight  0.10000E+01 volume  0.10871E-01 ppm1      7.127 ppm2      6.911 CV     1
 ASSI { 3431}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 49   and name HD% )
      4.000     2.000     2.000 peak  3431 spectrum    1 weight  0.10000E+01 volume  0.10693E-02 ppm1      7.132 ppm2      6.535 CV     1
 ASSI { 3432}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 82   and name HN  ))
      5.000     3.100     1.000 peak  3432 spectrum    1 weight  0.10000E+01 volume  0.51416E-03 ppm1      7.122 ppm2      5.647 CV     1
 ASSI { 3433}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 52   and name HA1 ))
      3.900     1.900     1.900 peak  3433 spectrum    1 weight  0.10000E+01 volume  0.25962E-02 ppm1      7.127 ppm2      4.048 CV     1
 ASSI { 3434}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 52   and name HA2 ))
      2.800     1.000     1.000 peak  3434 spectrum    1 weight  0.10000E+01 volume  0.16947E-02 ppm1      7.127 ppm2      3.760 CV     1
 ASSI { 3435}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 82   and name HA2 ))
      5.100     3.200     0.900 peak  3435 spectrum    1 weight  0.10000E+01 volume  0.32144E-03 ppm1      7.116 ppm2      2.243 CV     1
 ASSI { 3439}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 136  and name HN  ))
      2.200     0.600     0.600 peak  3439 spectrum    1 weight  0.10000E+01 volume  0.77304E-02 ppm1      5.278 ppm2      9.371 CV     1
 ASSI { 3448}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 80   and name HN  ))
      2.300     0.600     0.600 peak  3448 spectrum    1 weight  0.10000E+01 volume  0.70212E-02 ppm1      5.252 ppm2      9.504 CV     1
 ASSI { 3449}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      3.000     1.100     1.100 peak  3449 spectrum    1 weight  0.10000E+01 volume  0.14889E-02 ppm1      5.248 ppm2      8.187 CV     1
 ASSI { 3451}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 54   and name HE% )
      4.400     2.500     1.600 peak  3451 spectrum    1 weight  0.10000E+01 volume  0.54735E-03 ppm1      5.247 ppm2      7.233 CV     1
 OR { 3451}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 3452}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 84   and name HD% )
      3.200     1.200     1.200 peak  3452 spectrum    1 weight  0.10000E+01 volume  0.17243E-02 ppm1      5.243 ppm2      6.932 CV     1
 ASSI { 3453}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 85   and name HD% )
      4.800     2.900     1.200 peak  3453 spectrum    1 weight  0.10000E+01 volume  0.35706E-03 ppm1      5.240 ppm2      6.023 CV     1
 ASSI { 3454}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB  ))
      2.500     0.800     0.800 peak  3454 spectrum    1 weight  0.10000E+01 volume  0.37450E-02 ppm1      5.249 ppm2      4.111 CV     1
 ASSI { 3456}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
      4.800     2.800     1.200 peak  3456 spectrum    1 weight  0.10000E+01 volume  0.47247E-03 ppm1      5.241 ppm2      2.323 CV     1
 ASSI { 3464}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 138  and name HN  ))
      3.400     1.500     1.500 peak  3464 spectrum    1 weight  0.10000E+01 volume  0.90985E-03 ppm1      5.025 ppm2      9.569 CV     1
 ASSI { 3465}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 116  and name HN  ))
      2.000     0.500     0.500 peak  3465 spectrum    1 weight  0.10000E+01 volume  0.12085E-01 ppm1      5.028 ppm2      8.666 CV     1
 ASSI { 3466}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 115  and name HN  ))
      2.800     1.000     1.000 peak  3466 spectrum    1 weight  0.10000E+01 volume  0.17287E-02 ppm1      5.026 ppm2      7.975 CV     1
 ASSI { 3467}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 114  and name HA  ))
      3.300     1.300     1.300 peak  3467 spectrum    1 weight  0.10000E+01 volume  0.24706E-02 ppm1      5.028 ppm2      4.703 CV     1
 ASSI { 3468}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
      2.700     0.900     0.900 peak  3468 spectrum    1 weight  0.10000E+01 volume  0.23598E-02 ppm1      5.026 ppm2      3.872 CV     1
 ASSI { 3469}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 116  and name HB1 ))
      4.700     2.700     1.300 peak  3469 spectrum    1 weight  0.10000E+01 volume  0.93809E-03 ppm1      5.022 ppm2      1.765 CV     1
 ASSI { 3473}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 116  and name HD2%)
      3.700     1.700     1.700 peak  3473 spectrum    1 weight  0.10000E+01 volume  0.12837E-02 ppm1      5.021 ppm2      0.532 CV     1
 OR { 3473}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 3476}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
      4.300     2.300     1.700 peak  3476 spectrum    1 weight  0.10000E+01 volume  0.76462E-03 ppm1      5.017 ppm2      2.831 CV     1
 OR { 3476}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 3482}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 84   and name HA  ))
      2.900     1.000     1.000 peak  3482 spectrum    1 weight  0.10000E+01 volume  0.26823E-02 ppm1      5.255 ppm2      5.604 CV     1
 ASSI { 3491}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB  ))
      3.000     1.100     1.100 peak  3491 spectrum    1 weight  0.10000E+01 volume  0.19287E-02 ppm1      4.958 ppm2      2.177 CV     1
 ASSI { 3492}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 6    and name HB2 ))
      3.600     1.600     1.600 peak  3492 spectrum    1 weight  0.10000E+01 volume  0.10964E-02 ppm1      4.960 ppm2      1.857 CV     1
 OR { 3492}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 6    and name HB1 ))
 ASSI { 3496}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 8    and name HN  ))
      2.200     0.600     0.600 peak  3496 spectrum    1 weight  0.10000E+01 volume  0.10595E-01 ppm1      4.485 ppm2      8.775 CV     1
 ASSI { 3497}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HN  ))
      2.900     1.100     1.100 peak  3497 spectrum    1 weight  0.10000E+01 volume  0.19724E-02 ppm1      4.489 ppm2      7.613 CV     1
 ASSI { 3499}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 136  and name HA2 ))
      5.200     3.400     0.800 peak  3499 spectrum    1 weight  0.10000E+01 volume  0.49695E-03 ppm1      4.487 ppm2      3.425 CV     1
 ASSI { 3500}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 7    and name HG2%)
      2.500     0.800     0.800 peak  3500 spectrum    1 weight  0.10000E+01 volume  0.74059E-02 ppm1      4.479 ppm2      1.009 CV     1
 ASSI { 3501}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 28   and name HG1%)
      3.200     1.300     1.300 peak  3501 spectrum    1 weight  0.10000E+01 volume  0.21419E-02 ppm1      4.487 ppm2      0.649 CV     1
 OR { 3501}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 28   and name HG2%)
 ASSI { 3503}
   (( segid "    " and resid 132  and name HB1 ))
   (  segid "    " and resid 120  and name HD% )
      3.100     1.200     1.200 peak  3503 spectrum    1 weight  0.10000E+01 volume  0.23147E-02 ppm1      3.988 ppm2      6.625 CV     1
 ASSI { 3505}
   (( segid "    " and resid 132  and name HB1 ))
   (( segid "    " and resid 132  and name HB2 ))
      2.000     0.500     0.500 peak  3505 spectrum    1 weight  0.10000E+01 volume  0.60494E-02 ppm1      3.985 ppm2      3.688 CV     1
 ASSI { 3506}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      2.800     1.000     1.000 peak  3506 spectrum    1 weight  0.10000E+01 volume  0.25163E-02 ppm1      3.904 ppm2      8.573 CV     1
 ASSI { 3507}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      3.100     1.200     1.200 peak  3507 spectrum    1 weight  0.10000E+01 volume  0.19189E-02 ppm1      3.900 ppm2      6.862 CV     1
 ASSI { 3511}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB  ))
      2.700     0.900     0.900 peak  3511 spectrum    1 weight  0.10000E+01 volume  0.43032E-02 ppm1      3.897 ppm2      1.528 CV     1
 ASSI { 3512}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HG12))
      2.700     0.900     0.900 peak  3512 spectrum    1 weight  0.10000E+01 volume  0.52308E-02 ppm1      3.897 ppm2      1.061 CV     1
 ASSI { 3518}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 133  and name HN  ))
      4.800     2.900     1.200 peak  3518 spectrum    1 weight  0.10000E+01 volume  0.39306E-03 ppm1      3.683 ppm2      8.370 CV     1
 ASSI { 3519}
   (( segid "    " and resid 132  and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
      2.700     0.900     0.900 peak  3519 spectrum    1 weight  0.10000E+01 volume  0.27967E-02 ppm1      3.681 ppm2      6.624 CV     1
 ASSI { 3520}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.800     1.000     1.000 peak  3520 spectrum    1 weight  0.10000E+01 volume  0.40637E-02 ppm1      3.681 ppm2      4.693 CV     1
 ASSI { 3527}
   (( segid "    " and resid 92   and name HD1 ))
   (( segid "    " and resid 92   and name HA  ))
      3.300     1.300     1.300 peak  3527 spectrum    1 weight  0.10000E+01 volume  0.16324E-02 ppm1      7.541 ppm2      4.563 CV     1
 ASSI { 3528}
   (( segid "    " and resid 92   and name HD1 ))
   (( segid "    " and resid 92   and name HB1 ))
      4.000     2.000     2.000 peak  3528 spectrum    1 weight  0.10000E+01 volume  0.12505E-02 ppm1      7.541 ppm2      3.154 CV     1
 ASSI { 3529}
   (( segid "    " and resid 92   and name HD1 ))
   (( segid "    " and resid 92   and name HB2 ))
      3.300     1.400     1.400 peak  3529 spectrum    1 weight  0.10000E+01 volume  0.80239E-03 ppm1      7.546 ppm2      2.947 CV     1
 ASSI { 3530}
   (( segid "    " and resid 92   and name HD1 ))
   (( segid "    " and resid 86   and name HE1 ))
      3.700     1.700     1.700 peak  3530 spectrum    1 weight  0.10000E+01 volume  0.13906E-02 ppm1      7.542 ppm2      2.684 CV     1
 ASSI { 3531}
   (( segid "    " and resid 92   and name HD1 ))
   (( segid "    " and resid 86   and name HE2 ))
      3.800     1.800     1.800 peak  3531 spectrum    1 weight  0.10000E+01 volume  0.75504E-03 ppm1      7.549 ppm2      2.161 CV     1
 ASSI { 3534}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
      3.200     1.300     1.300 peak  3534 spectrum    1 weight  0.10000E+01 volume  0.17174E-02 ppm1      5.812 ppm2      9.255 CV     1
 ASSI { 3535}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 139  and name HA  ))
      2.600     0.800     0.800 peak  3535 spectrum    1 weight  0.10000E+01 volume  0.37733E-02 ppm1      5.812 ppm2      4.945 CV     1
 ASSI { 3537}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 114  and name HB1 ))
      4.300     2.300     1.700 peak  3537 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      5.814 ppm2      1.508 CV     1
 OR { 3537}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 114  and name HB2 ))
 ASSI { 3539}
   (( segid "    " and resid 113  and name HA  ))
   (  segid "    " and resid 114  and name HD2%)
      3.500     1.600     1.600 peak  3539 spectrum    1 weight  0.10000E+01 volume  0.10828E-02 ppm1      5.814 ppm2      0.774 CV     1
 ASSI { 3541}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 114  and name HN  ))
      2.000     0.500     0.500 peak  3541 spectrum    1 weight  0.10000E+01 volume  0.10407E-01 ppm1      5.816 ppm2      8.846 CV     1
 ASSI { 3542}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 114  and name HA  ))
      3.600     1.700     1.700 peak  3542 spectrum    1 weight  0.10000E+01 volume  0.16013E-02 ppm1      5.810 ppm2      4.695 CV     1
 ASSI { 3545}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      1.900     0.500     0.500 peak  3545 spectrum    1 weight  0.10000E+01 volume  0.12425E-01 ppm1      5.128 ppm2      8.986 CV     1
 ASSI { 3547}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 97   and name HA1 ))
      3.100     1.200     1.200 peak  3547 spectrum    1 weight  0.10000E+01 volume  0.53798E-02 ppm1      5.128 ppm2      4.343 CV     1
 ASSI { 3548}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HA  ))
      3.800     1.800     1.800 peak  3548 spectrum    1 weight  0.10000E+01 volume  0.13192E-02 ppm1      5.122 ppm2      4.083 CV     1
 ASSI { 3558}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 97   and name HA2 ))
      2.400     0.700     0.700 peak  3558 spectrum    1 weight  0.10000E+01 volume  0.23353E-02 ppm1      5.125 ppm2      3.377 CV     1
 ASSI { 3563}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      2.100     0.500     0.500 peak  3563 spectrum    1 weight  0.10000E+01 volume  0.11772E-01 ppm1      4.952 ppm2      8.881 CV     1
 ASSI { 3564}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      2.900     1.100     1.100 peak  3564 spectrum    1 weight  0.10000E+01 volume  0.19260E-02 ppm1      4.955 ppm2      8.547 CV     1
 ASSI { 3567}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 28   and name HG1%)
      4.100     2.100     1.900 peak  3567 spectrum    1 weight  0.10000E+01 volume  0.45199E-03 ppm1      4.950 ppm2      0.704 CV     1
 ASSI { 3575}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      2.800     1.000     1.000 peak  3575 spectrum    1 weight  0.10000E+01 volume  0.22726E-02 ppm1      4.055 ppm2      8.977 CV     1
 ASSI { 3579}
   (( segid "    " and resid 28   and name HA  ))
   (  segid "    " and resid 28   and name HG2%)
      2.400     0.700     0.700 peak  3579 spectrum    1 weight  0.10000E+01 volume  0.80087E-02 ppm1      4.058 ppm2      0.623 CV     1
 OR { 3579}
   (( segid "    " and resid 28   and name HA  ))
   (  segid "    " and resid 28   and name HG1%)
 ASSI { 3580}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      4.300     2.300     1.700 peak  3580 spectrum    1 weight  0.10000E+01 volume  0.64457E-03 ppm1      4.013 ppm2      7.390 CV     1
 ASSI { 3584}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 39   and name HB1 ))
      3.600     1.600     1.600 peak  3584 spectrum    1 weight  0.10000E+01 volume  0.74559E-03 ppm1      4.023 ppm2      2.449 CV     1
 ASSI { 3586}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
      2.400     0.700     0.700 peak  3586 spectrum    1 weight  0.10000E+01 volume  0.51945E-02 ppm1      4.020 ppm2      1.870 CV     1
 ASSI { 3587}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 89   and name HG1%)
      2.400     0.700     0.700 peak  3587 spectrum    1 weight  0.10000E+01 volume  0.82419E-02 ppm1      4.020 ppm2      0.812 CV     1
 OR { 3587}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 89   and name HG2%)
 ASSI { 3591}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      4.500     2.600     1.500 peak  3591 spectrum    1 weight  0.10000E+01 volume  0.46240E-03 ppm1      4.859 ppm2      8.938 CV     1
 ASSI { 3592}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      2.400     0.700     0.700 peak  3592 spectrum    1 weight  0.10000E+01 volume  0.28626E-02 ppm1      4.866 ppm2      8.736 CV     1
 ASSI { 3604}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 86   and name HA  ))
      4.600     2.600     1.400 peak  3604 spectrum    1 weight  0.10000E+01 volume  0.28053E-03 ppm1      6.796 ppm2      2.704 CV     1
 ASSI { 3605}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 71   and name HB2 ))
      4.400     2.400     1.600 peak  3605 spectrum    1 weight  0.10000E+01 volume  0.48201E-03 ppm1      6.795 ppm2      2.417 CV     1
 ASSI { 3606}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 71   and name HG2 ))
      2.900     1.100     1.100 peak  3606 spectrum    1 weight  0.10000E+01 volume  0.23987E-02 ppm1      6.794 ppm2      1.809 CV     1
 OR { 3606}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI { 3609}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 76   and name HN  ))
      4.000     2.000     2.000 peak  3609 spectrum    1 weight  0.10000E+01 volume  0.49687E-03 ppm1      6.791 ppm2      8.117 CV     1
 ASSI { 3611}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 77   and name HB1 ))
      3.500     1.500     1.500 peak  3611 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      6.792 ppm2      2.048 CV     1
 ASSI { 3612}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 71   and name HB1 ))
      4.200     2.200     1.800 peak  3612 spectrum    1 weight  0.10000E+01 volume  0.59309E-03 ppm1      6.782 ppm2      1.484 CV     1
 ASSI { 3614}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 86   and name HG2 ))
      5.200     3.400     0.800 peak  3614 spectrum    1 weight  0.10000E+01 volume  0.32120E-03 ppm1      6.784 ppm2     -0.564 CV     1
 ASSI { 3616}
   (( segid "    " and resid 121  and name HD1 ))
   (  segid "    " and resid 85   and name HD% )
      3.900     1.900     1.900 peak  3616 spectrum    1 weight  0.10000E+01 volume  0.39411E-03 ppm1      6.387 ppm2      6.002 CV     1
 ASSI { 3617}
   (( segid "    " and resid 121  and name HD1 ))
   (  segid "    " and resid 85   and name HE% )
      3.700     1.700     1.700 peak  3617 spectrum    1 weight  0.10000E+01 volume  0.61902E-03 ppm1      6.386 ppm2      5.685 CV     1
 ASSI { 3619}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 121  and name HN  ))
      4.200     2.200     1.800 peak  3619 spectrum    1 weight  0.10000E+01 volume  0.45071E-03 ppm1      6.375 ppm2      9.063 CV     1
 ASSI { 3620}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 39   and name HN  ))
      3.900     1.900     1.900 peak  3620 spectrum    1 weight  0.10000E+01 volume  0.82188E-03 ppm1      6.374 ppm2      8.201 CV     1
 ASSI { 3622}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 121  and name HZ2 ))
      4.700     2.800     1.300 peak  3622 spectrum    1 weight  0.10000E+01 volume  0.44093E-03 ppm1      6.374 ppm2      7.218 CV     1
 ASSI { 3623}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 121  and name HA  ))
      4.000     2.000     2.000 peak  3623 spectrum    1 weight  0.10000E+01 volume  0.66286E-03 ppm1      6.371 ppm2      4.854 CV     1
 ASSI { 3624}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 129  and name HA  ))
      3.800     1.800     1.800 peak  3624 spectrum    1 weight  0.10000E+01 volume  0.45047E-03 ppm1      6.355 ppm2      4.675 CV     1
 ASSI { 3626}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 123  and name HA  ))
      4.700     2.700     1.300 peak  3626 spectrum    1 weight  0.10000E+01 volume  0.41467E-03 ppm1      6.371 ppm2      3.917 CV     1
 ASSI { 3628}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 121  and name HB1 ))
      2.800     1.000     1.000 peak  3628 spectrum    1 weight  0.10000E+01 volume  0.18092E-02 ppm1      6.381 ppm2      2.749 CV     1
 ASSI { 3632}
   (( segid "    " and resid 121  and name HD1 ))
   (  segid "    " and resid 41   and name HB% )
      4.600     2.700     1.400 peak  3632 spectrum    1 weight  0.10000E+01 volume  0.87125E-03 ppm1      6.381 ppm2      1.432 CV     1
 ASSI { 3633}
   (( segid "    " and resid 121  and name HD1 ))
   (  segid "    " and resid 122  and name HB% )
      4.600     2.600     1.400 peak  3633 spectrum    1 weight  0.10000E+01 volume  0.62496E-03 ppm1      6.378 ppm2      1.258 CV     1
 ASSI { 3636}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 96   and name HN  ))
      2.100     0.500     0.500 peak  3636 spectrum    1 weight  0.10000E+01 volume  0.10402E-01 ppm1      5.166 ppm2      9.179 CV     1
 ASSI { 3638}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 96   and name HB  ))
      4.400     2.400     1.600 peak  3638 spectrum    1 weight  0.10000E+01 volume  0.91633E-03 ppm1      5.171 ppm2      1.537 CV     1
 ASSI { 3640}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 96   and name HG2%)
      4.600     2.700     1.400 peak  3640 spectrum    1 weight  0.10000E+01 volume  0.46962E-03 ppm1      5.171 ppm2      0.285 CV     1
 ASSI { 3643}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 94   and name HA2 ))
      4.100     2.100     1.900 peak  3643 spectrum    1 weight  0.10000E+01 volume  0.71628E-03 ppm1      5.163 ppm2      3.213 CV     1
 ASSI { 3645}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 92   and name HZ3 ))
      3.900     1.900     1.900 peak  3645 spectrum    1 weight  0.10000E+01 volume  0.59966E-03 ppm1      5.143 ppm2      6.781 CV     1
 OR { 3645}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 92   and name HH2 ))
 ASSI { 3653}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HB2 ))
      4.000     2.000     2.000 peak  3653 spectrum    1 weight  0.10000E+01 volume  0.18098E-02 ppm1      5.074 ppm2      1.734 CV     1
 OR { 3653}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 3654}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HG2%)
      2.300     0.700     0.700 peak  3654 spectrum    1 weight  0.10000E+01 volume  0.97656E-02 ppm1      5.072 ppm2      1.170 CV     1
 ASSI { 3656}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HB1 ))
      5.100     3.300     0.900 peak  3656 spectrum    1 weight  0.10000E+01 volume  0.52692E-03 ppm1      5.063 ppm2      2.068 CV     1
 ASSI { 3659}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      2.000     0.500     0.500 peak  3659 spectrum    1 weight  0.10000E+01 volume  0.87340E-02 ppm1      4.485 ppm2      8.968 CV     1
 ASSI { 3660}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
      2.700     0.900     0.900 peak  3660 spectrum    1 weight  0.10000E+01 volume  0.21914E-02 ppm1      4.488 ppm2      7.632 CV     1
 ASSI { 3661}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 99   and name HD% )
      3.800     1.800     1.800 peak  3661 spectrum    1 weight  0.10000E+01 volume  0.97908E-03 ppm1      4.488 ppm2      6.806 CV     1
 ASSI { 3662}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 69   and name HA  ))
      2.600     0.800     0.800 peak  3662 spectrum    1 weight  0.10000E+01 volume  0.30140E-02 ppm1      4.487 ppm2      4.921 CV     1
 ASSI { 3664}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
      4.200     2.200     1.800 peak  3664 spectrum    1 weight  0.10000E+01 volume  0.13677E-02 ppm1      4.485 ppm2      2.520 CV     1
 OR { 3664}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI { 3665}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 67   and name HB  ))
      3.900     1.900     1.900 peak  3665 spectrum    1 weight  0.10000E+01 volume  0.88326E-03 ppm1      4.488 ppm2      2.147 CV     1
 ASSI { 3666}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB  ))
      3.000     1.100     1.100 peak  3666 spectrum    1 weight  0.10000E+01 volume  0.21081E-02 ppm1      4.482 ppm2      1.521 CV     1
 ASSI { 3667}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HG11))
      2.700     0.900     0.900 peak  3667 spectrum    1 weight  0.10000E+01 volume  0.18589E-02 ppm1      4.487 ppm2      1.342 CV     1
 ASSI { 3668}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HG2%)
      2.500     0.800     0.800 peak  3668 spectrum    1 weight  0.10000E+01 volume  0.62996E-02 ppm1      4.485 ppm2      0.513 CV     1
 OR { 3668}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI { 3674}
   (( segid "    " and resid 20   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      4.400     2.400     1.600 peak  3674 spectrum    1 weight  0.10000E+01 volume  0.68049E-03 ppm1      4.072 ppm2      1.531 CV     1
 ASSI { 3675}
   (( segid "    " and resid 20   and name HA  ))
   (  segid "    " and resid 100  and name HG1%)
      3.600     1.600     1.600 peak  3675 spectrum    1 weight  0.10000E+01 volume  0.11679E-02 ppm1      4.081 ppm2      0.887 CV     1
 ASSI { 3677}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      2.400     0.700     0.700 peak  3677 spectrum    1 weight  0.10000E+01 volume  0.53708E-02 ppm1      4.069 ppm2      8.200 CV     1
 ASSI { 3678}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.800     1.000     1.000 peak  3678 spectrum    1 weight  0.10000E+01 volume  0.26559E-02 ppm1      4.067 ppm2      7.559 CV     1
 ASSI { 3681}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
      3.000     1.100     1.100 peak  3681 spectrum    1 weight  0.10000E+01 volume  0.20153E-02 ppm1      4.067 ppm2      2.117 CV     1
 ASSI { 3684}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 103  and name HB1 ))
      3.300     1.400     1.400 peak  3684 spectrum    1 weight  0.10000E+01 volume  0.10307E-02 ppm1      4.064 ppm2      2.226 CV     1
 ASSI { 3686}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB2 ))
      2.600     0.900     0.900 peak  3686 spectrum    1 weight  0.10000E+01 volume  0.78493E-02 ppm1      3.713 ppm2      1.705 CV     1
 OR { 3686}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 3687}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      2.500     0.800     0.800 peak  3687 spectrum    1 weight  0.10000E+01 volume  0.35916E-02 ppm1      3.702 ppm2      8.564 CV     1
 ASSI { 3689}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      3.700     1.700     1.700 peak  3689 spectrum    1 weight  0.10000E+01 volume  0.64730E-03 ppm1      3.698 ppm2      7.801 CV     1
 ASSI { 3690}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      3.500     1.500     1.500 peak  3690 spectrum    1 weight  0.10000E+01 volume  0.94940E-03 ppm1      3.702 ppm2      7.580 CV     1
 ASSI { 3691}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HD1 ))
      4.800     2.900     1.200 peak  3691 spectrum    1 weight  0.10000E+01 volume  0.46223E-03 ppm1      3.695 ppm2      3.293 CV     1
 ASSI { 3692}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HD2 ))
      4.400     2.500     1.600 peak  3692 spectrum    1 weight  0.10000E+01 volume  0.44510E-03 ppm1      3.696 ppm2      3.100 CV     1
 ASSI { 3693}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB1 ))
      2.400     0.700     0.700 peak  3693 spectrum    1 weight  0.10000E+01 volume  0.45819E-02 ppm1      3.695 ppm2      2.057 CV     1
 ASSI { 3694}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HG1 ))
      2.200     0.600     0.600 peak  3694 spectrum    1 weight  0.10000E+01 volume  0.67983E-02 ppm1      3.690 ppm2      1.825 CV     1
 ASSI { 3695}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name HG  ))
      2.200     0.600     0.600 peak  3695 spectrum    1 weight  0.10000E+01 volume  0.82217E-02 ppm1      3.694 ppm2      0.772 CV     1
 ASSI { 3699}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      3.000     1.100     1.100 peak  3699 spectrum    1 weight  0.10000E+01 volume  0.12259E-02 ppm1      5.285 ppm2      8.735 CV     1
 ASSI { 3700}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 101  and name HN  ))
      2.700     0.900     0.900 peak  3700 spectrum    1 weight  0.10000E+01 volume  0.40058E-02 ppm1      5.279 ppm2      8.514 CV     1
 ASSI { 3706}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
      3.900     1.900     1.900 peak  3706 spectrum    1 weight  0.10000E+01 volume  0.13668E-02 ppm1      5.279 ppm2      0.865 CV     1
 OR { 3706}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 100  and name HG1%)
 ASSI { 3709}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HB  ))
      2.300     0.700     0.700 peak  3709 spectrum    1 weight  0.10000E+01 volume  0.10663E-01 ppm1      5.017 ppm2      4.702 CV     1
 ASSI { 3711}
   (( segid "    " and resid 134  and name HA  ))
   (  segid "    " and resid 117  and name HG2%)
      4.200     2.200     1.800 peak  3711 spectrum    1 weight  0.10000E+01 volume  0.37050E-03 ppm1      5.014 ppm2      1.460 CV     1
 ASSI { 3714}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      3.500     1.500     1.500 peak  3714 spectrum    1 weight  0.10000E+01 volume  0.12988E-02 ppm1      4.938 ppm2      8.966 CV     1
 ASSI { 3718}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 69   and name HD1%)
      4.300     2.400     1.700 peak  3718 spectrum    1 weight  0.10000E+01 volume  0.11049E-02 ppm1      4.934 ppm2     -0.605 CV     1
 ASSI { 3719}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      4.500     2.500     1.500 peak  3719 spectrum    1 weight  0.10000E+01 volume  0.80524E-03 ppm1      4.928 ppm2      1.405 CV     1
 ASSI { 3721}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HN  ))
      3.100     1.200     1.200 peak  3721 spectrum    1 weight  0.10000E+01 volume  0.19481E-02 ppm1      4.550 ppm2      7.545 CV     1
 OR { 3721}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HD1 ))
 ASSI { 3725}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 86   and name HE1 ))
      4.900     3.000     1.100 peak  3725 spectrum    1 weight  0.10000E+01 volume  0.42545E-03 ppm1      4.544 ppm2      2.620 CV     1
 ASSI { 3729}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      2.000     0.500     0.500 peak  3729 spectrum    1 weight  0.10000E+01 volume  0.85936E-02 ppm1      4.935 ppm2      8.564 CV     1
 ASSI { 3730}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
      2.700     0.900     0.900 peak  3730 spectrum    1 weight  0.10000E+01 volume  0.20550E-02 ppm1      4.936 ppm2      8.038 CV     1
 ASSI { 3733}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 96   and name HG2%)
      3.000     1.100     1.100 peak  3733 spectrum    1 weight  0.10000E+01 volume  0.17802E-02 ppm1      4.929 ppm2      0.329 CV     1
 ASSI { 3734}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
      4.900     3.000     1.100 peak  3734 spectrum    1 weight  0.10000E+01 volume  0.78485E-03 ppm1      4.924 ppm2      2.533 CV     1
 OR { 3734}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 3735}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 99   and name HE% )
      4.100     2.100     1.900 peak  3735 spectrum    1 weight  0.10000E+01 volume  0.91398E-03 ppm1      4.916 ppm2      6.614 CV     1
 ASSI { 3751}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 35   and name HB1 ))
      3.400     1.500     1.500 peak  3751 spectrum    1 weight  0.10000E+01 volume  0.17824E-02 ppm1      4.020 ppm2      3.311 CV     1
 ASSI { 3754}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
      2.600     0.900     0.900 peak  3754 spectrum    1 weight  0.10000E+01 volume  0.29247E-02 ppm1      4.020 ppm2      2.681 CV     1
 ASSI { 3758}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      4.400     2.400     1.600 peak  3758 spectrum    1 weight  0.10000E+01 volume  0.48122E-03 ppm1      4.487 ppm2      8.945 CV     1
 ASSI { 3762}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HN  ))
      2.600     0.900     0.900 peak  3762 spectrum    1 weight  0.10000E+01 volume  0.27352E-02 ppm1      4.422 ppm2      9.012 CV     1
 ASSI { 3763}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 133  and name HN  ))
      2.200     0.600     0.600 peak  3763 spectrum    1 weight  0.10000E+01 volume  0.92343E-02 ppm1      4.427 ppm2      8.349 CV     1
 ASSI { 3764}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HB2 ))
      2.300     0.600     0.600 peak  3764 spectrum    1 weight  0.10000E+01 volume  0.13072E-01 ppm1      4.424 ppm2      3.664 CV     1
 ASSI { 3777}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
      2.400     0.700     0.700 peak  3777 spectrum    1 weight  0.10000E+01 volume  0.53996E-02 ppm1      4.055 ppm2      2.156 CV     1
 OR { 3777}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB1 ))
 ASSI { 3778}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 104  and name HB2 ))
      4.300     2.300     1.700 peak  3778 spectrum    1 weight  0.10000E+01 volume  0.76417E-03 ppm1      4.047 ppm2      1.471 CV     1
 ASSI { 3784}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 100  and name HG1%)
      2.900     1.100     1.100 peak  3784 spectrum    1 weight  0.10000E+01 volume  0.14430E-02 ppm1      4.050 ppm2      0.895 CV     1
 OR { 3784}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 3786}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 121  and name HE1 ))
      4.300     2.300     1.700 peak  3786 spectrum    1 weight  0.10000E+01 volume  0.46558E-03 ppm1      7.098 ppm2      9.525 CV     1
 ASSI { 3787}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 121  and name HH2 ))
      2.300     0.600     0.600 peak  3787 spectrum    1 weight  0.10000E+01 volume  0.58249E-02 ppm1      7.107 ppm2      6.923 CV     1
 OR { 3787}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 121  and name HE3 ))
 ASSI { 3789}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 125  and name HB2 ))
      4.200     2.300     1.800 peak  3789 spectrum    1 weight  0.10000E+01 volume  0.67264E-03 ppm1      7.107 ppm2      2.687 CV     1
 OR { 3789}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 125  and name HB1 ))
 ASSI { 3790}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 128  and name HA2 ))
      4.200     2.200     1.800 peak  3790 spectrum    1 weight  0.10000E+01 volume  0.85940E-03 ppm1      7.109 ppm2      2.332 CV     1
 ASSI { 3792}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 126  and name HG1 ))
      5.300     3.500     0.700 peak  3792 spectrum    1 weight  0.10000E+01 volume  0.35463E-03 ppm1      7.111 ppm2      1.406 CV     1
 OR { 3792}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI { 3794}
   (( segid "    " and resid 121  and name HZ3 ))
   (  segid "    " and resid 83   and name HG2%)
      3.600     1.600     1.600 peak  3794 spectrum    1 weight  0.10000E+01 volume  0.51458E-03 ppm1      7.113 ppm2      0.803 CV     1
 ASSI { 3796}
   (( segid "    " and resid 121  and name HZ3 ))
   (  segid "    " and resid 85   and name HE% )
      3.900     1.900     1.900 peak  3796 spectrum    1 weight  0.10000E+01 volume  0.40846E-03 ppm1      7.097 ppm2      5.670 CV     1
 ASSI { 3799}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      2.800     1.000     1.000 peak  3799 spectrum    1 weight  0.10000E+01 volume  0.20492E-02 ppm1      4.473 ppm2      8.749 CV     1
 ASSI { 3800}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 71   and name HA  ))
      2.400     0.700     0.700 peak  3800 spectrum    1 weight  0.10000E+01 volume  0.47978E-02 ppm1      4.467 ppm2      4.810 CV     1
 ASSI { 3801}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HA2 ))
      4.100     2.100     1.900 peak  3801 spectrum    1 weight  0.10000E+01 volume  0.98127E-03 ppm1      4.475 ppm2      3.341 CV     1
 ASSI { 3802}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HG11))
      3.100     1.200     1.200 peak  3802 spectrum    1 weight  0.10000E+01 volume  0.22542E-02 ppm1      4.467 ppm2      1.120 CV     1
 OR { 3802}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HG12))
 ASSI { 3805}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 96   and name HD1%)
      3.700     1.700     1.700 peak  3805 spectrum    1 weight  0.10000E+01 volume  0.32600E-02 ppm1      4.471 ppm2      0.107 CV     1
 ASSI { 3807}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 129  and name HA  ))
      3.900     1.900     1.900 peak  3807 spectrum    1 weight  0.10000E+01 volume  0.48395E-03 ppm1      7.088 ppm2      4.702 CV     1
 ASSI { 3810}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 72   and name HN  ))
      3.900     1.900     1.900 peak  3810 spectrum    1 weight  0.10000E+01 volume  0.56164E-03 ppm1      6.784 ppm2      8.732 CV     1
 ASSI { 3813}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 92   and name HE3 ))
      4.600     2.600     1.400 peak  3813 spectrum    1 weight  0.10000E+01 volume  0.53662E-03 ppm1      6.792 ppm2      7.333 CV     1
 ASSI { 3815}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 94   and name HA2 ))
      5.000     3.200     1.000 peak  3815 spectrum    1 weight  0.10000E+01 volume  0.50582E-03 ppm1      6.787 ppm2      3.219 CV     1
 ASSI { 3816}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 71   and name HB2 ))
      4.900     3.000     1.100 peak  3816 spectrum    1 weight  0.10000E+01 volume  0.34447E-03 ppm1      6.787 ppm2      2.333 CV     1
 ASSI { 3818}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 71   and name HB1 ))
      3.600     1.600     1.600 peak  3818 spectrum    1 weight  0.10000E+01 volume  0.49204E-03 ppm1      6.787 ppm2      1.456 CV     1
 ASSI { 3820}
   (( segid "    " and resid 92   and name HH2 ))
   (  segid "    " and resid 96   and name HG2%)
      3.400     1.500     1.500 peak  3820 spectrum    1 weight  0.10000E+01 volume  0.99406E-03 ppm1      6.792 ppm2      0.286 CV     1
 ASSI { 3821}
   (( segid "    " and resid 92   and name HH2 ))
   (  segid "    " and resid 96   and name HD1%)
      3.800     1.800     1.800 peak  3821 spectrum    1 weight  0.10000E+01 volume  0.14300E-02 ppm1      6.787 ppm2      0.115 CV     1
 ASSI { 3822}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 71   and name HA  ))
      3.500     1.500     1.500 peak  3822 spectrum    1 weight  0.10000E+01 volume  0.59495E-03 ppm1      6.769 ppm2      4.796 CV     1
 ASSI { 3829}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 49   and name HD% )
      3.400     1.500     1.500 peak  3829 spectrum    1 weight  0.10000E+01 volume  0.17827E-02 ppm1      5.275 ppm2      6.563 CV     1
 ASSI { 3830}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 49   and name HA  ))
      2.700     0.900     0.900 peak  3830 spectrum    1 weight  0.10000E+01 volume  0.28628E-02 ppm1      5.280 ppm2      5.102 CV     1
 ASSI { 3832}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB1 ))
      2.700     0.900     0.900 peak  3832 spectrum    1 weight  0.10000E+01 volume  0.22070E-02 ppm1      5.277 ppm2      3.016 CV     1
 ASSI { 3834}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 49   and name HB2 ))
      3.600     1.600     1.600 peak  3834 spectrum    1 weight  0.10000E+01 volume  0.10685E-02 ppm1      5.279 ppm2      2.523 CV     1
 ASSI { 3839}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 44   and name HB% )
      3.900     1.900     1.900 peak  3839 spectrum    1 weight  0.10000E+01 volume  0.53844E-03 ppm1      5.275 ppm2      1.501 CV     1
 ASSI { 3842}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      3.300     1.400     1.400 peak  3842 spectrum    1 weight  0.10000E+01 volume  0.21513E-02 ppm1      4.432 ppm2      7.899 CV     1
 ASSI { 3844}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HD1 ))
      3.700     1.700     1.700 peak  3844 spectrum    1 weight  0.10000E+01 volume  0.22893E-02 ppm1      4.423 ppm2      3.167 CV     1
 OR { 3844}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HD2 ))
 ASSI { 3845}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB1 ))
      2.300     0.600     0.600 peak  3845 spectrum    1 weight  0.10000E+01 volume  0.12385E-01 ppm1      4.425 ppm2      1.587 CV     1
 OR { 3845}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 3847}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 128  and name HN  ))
      4.600     2.600     1.400 peak  3847 spectrum    1 weight  0.10000E+01 volume  0.64350E-03 ppm1      4.031 ppm2      7.384 CV     1
 ASSI { 3848}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HN  ))
      2.300     0.700     0.700 peak  3848 spectrum    1 weight  0.10000E+01 volume  0.89226E-02 ppm1      4.022 ppm2      8.313 CV     1
 ASSI { 3850}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HE2 ))
      5.300     3.500     0.700 peak  3850 spectrum    1 weight  0.10000E+01 volume  0.61407E-03 ppm1      4.017 ppm2      2.979 CV     1
 ASSI { 3851}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 125  and name HB2 ))
      3.500     1.600     1.600 peak  3851 spectrum    1 weight  0.10000E+01 volume  0.10971E-02 ppm1      4.020 ppm2      2.699 CV     1
 OR { 3851}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 125  and name HB1 ))
 ASSI { 3852}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HB2 ))
      2.100     0.600     0.600 peak  3852 spectrum    1 weight  0.10000E+01 volume  0.14158E-01 ppm1      4.020 ppm2      1.759 CV     1
 OR { 3852}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HB1 ))
 ASSI { 3853}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HG1 ))
      3.000     1.100     1.100 peak  3853 spectrum    1 weight  0.10000E+01 volume  0.60490E-02 ppm1      4.026 ppm2      1.370 CV     1
 OR { 3853}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI { 3855}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 122  and name HN  ))
      5.000     3.100     1.000 peak  3855 spectrum    1 weight  0.10000E+01 volume  0.32044E-03 ppm1      3.932 ppm2      7.655 CV     1
 ASSI { 3857}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HA1 ))
      3.600     1.600     1.600 peak  3857 spectrum    1 weight  0.10000E+01 volume  0.12287E-02 ppm1      3.916 ppm2      4.095 CV     1
 ASSI { 3858}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 128  and name HA1 ))
      5.000     3.200     1.000 peak  3858 spectrum    1 weight  0.10000E+01 volume  0.23937E-03 ppm1      3.917 ppm2      3.271 CV     1
 ASSI { 3859}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 49   and name HZ  ))
      4.400     2.400     1.600 peak  3859 spectrum    1 weight  0.10000E+01 volume  0.65638E-03 ppm1      3.904 ppm2      7.099 CV     1
 ASSI { 3860}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 49   and name HE% )
      3.600     1.600     1.600 peak  3860 spectrum    1 weight  0.10000E+01 volume  0.97673E-03 ppm1      3.904 ppm2      6.904 CV     1
 ASSI { 3865}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 102  and name HA1 ))
      4.300     2.300     1.700 peak  3865 spectrum    1 weight  0.10000E+01 volume  0.16003E-02 ppm1      3.855 ppm2      4.299 CV     1
 ASSI { 3866}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 102  and name HA2 ))
      3.500     1.600     1.600 peak  3866 spectrum    1 weight  0.10000E+01 volume  0.69832E-03 ppm1      3.858 ppm2      3.438 CV     1
 ASSI { 3873}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      2.900     1.100     1.100 peak  3873 spectrum    1 weight  0.10000E+01 volume  0.12424E-02 ppm1      2.696 ppm2      8.481 CV     1
 ASSI { 3874}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name HN  ))
      2.400     0.700     0.700 peak  3874 spectrum    1 weight  0.10000E+01 volume  0.34994E-02 ppm1      2.696 ppm2      7.948 CV     1
 ASSI { 3876}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 85   and name HA  ))
      4.300     2.300     1.700 peak  3876 spectrum    1 weight  0.10000E+01 volume  0.37151E-03 ppm1      2.700 ppm2      5.661 CV     1
 OR { 3876}
   (( segid "    " and resid 86   and name HA  ))
   (  segid "    " and resid 85   and name HE% )
 ASSI { 3877}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 77   and name HA  ))
      2.000     0.500     0.500 peak  3877 spectrum    1 weight  0.10000E+01 volume  0.42136E-02 ppm1      2.695 ppm2      4.681 CV     1
 ASSI { 3879}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 77   and name HB1 ))
      3.700     1.800     1.800 peak  3879 spectrum    1 weight  0.10000E+01 volume  0.93387E-03 ppm1      2.699 ppm2      2.047 CV     1
 ASSI { 3880}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
      2.700     0.900     0.900 peak  3880 spectrum    1 weight  0.10000E+01 volume  0.16589E-02 ppm1      2.699 ppm2      1.268 CV     1
 ASSI { 3881}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HG1 ))
      3.700     1.700     1.700 peak  3881 spectrum    1 weight  0.10000E+01 volume  0.12121E-02 ppm1      2.694 ppm2      0.978 CV     1
 ASSI { 3882}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HG2 ))
      3.400     1.400     1.400 peak  3882 spectrum    1 weight  0.10000E+01 volume  0.16105E-02 ppm1      2.699 ppm2     -0.608 CV     1
 ASSI { 3883}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HB2 ))
      2.800     1.000     1.000 peak  3883 spectrum    1 weight  0.10000E+01 volume  0.13396E-02 ppm1      2.703 ppm2     -0.840 CV     1
 ASSI { 3884}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 88   and name HN  ))
      4.600     2.600     1.400 peak  3884 spectrum    1 weight  0.10000E+01 volume  0.41591E-03 ppm1      2.681 ppm2      7.306 CV     1
 ASSI { 3886}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 77   and name HB2 ))
      4.800     2.800     1.200 peak  3886 spectrum    1 weight  0.10000E+01 volume  0.61076E-03 ppm1      2.684 ppm2      1.628 CV     1
 ASSI { 3887}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HD2 ))
      5.200     3.300     0.800 peak  3887 spectrum    1 weight  0.10000E+01 volume  0.34142E-03 ppm1      2.679 ppm2      0.274 CV     1
 ASSI { 3889}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      5.100     3.300     0.900 peak  3889 spectrum    1 weight  0.10000E+01 volume  0.43172E-03 ppm1      5.115 ppm2      9.450 CV     1
 ASSI { 3890}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      2.200     0.600     0.600 peak  3890 spectrum    1 weight  0.10000E+01 volume  0.83901E-02 ppm1      5.106 ppm2      8.380 CV     1
 ASSI { 3891}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      3.600     1.600     1.600 peak  3891 spectrum    1 weight  0.10000E+01 volume  0.17667E-02 ppm1      5.106 ppm2      8.048 CV     1
 ASSI { 3892}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 55   and name HE% )
      3.100     1.200     1.200 peak  3892 spectrum    1 weight  0.10000E+01 volume  0.22095E-02 ppm1      5.106 ppm2      7.223 CV     1
 ASSI { 3893}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      2.800     1.000     1.000 peak  3893 spectrum    1 weight  0.10000E+01 volume  0.22675E-02 ppm1      5.104 ppm2      6.918 CV     1
 OR { 3893}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 49   and name HE% )
 ASSI { 3894}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 49   and name HD% )
      3.000     1.200     1.200 peak  3894 spectrum    1 weight  0.10000E+01 volume  0.22819E-02 ppm1      5.104 ppm2      6.554 CV     1
 ASSI { 3897}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 54   and name HB1 ))
      4.300     2.300     1.700 peak  3897 spectrum    1 weight  0.10000E+01 volume  0.45298E-03 ppm1      5.099 ppm2      3.034 CV     1
 ASSI { 3898}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HB1 ))
      2.800     0.900     0.900 peak  3898 spectrum    1 weight  0.10000E+01 volume  0.43135E-02 ppm1      5.097 ppm2      2.703 CV     1
 ASSI { 3899}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HB2 ))
      2.300     0.700     0.700 peak  3899 spectrum    1 weight  0.10000E+01 volume  0.45550E-02 ppm1      5.103 ppm2      2.532 CV     1
 ASSI { 3901}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 44   and name HB% )
      3.800     1.800     1.800 peak  3901 spectrum    1 weight  0.10000E+01 volume  0.78192E-03 ppm1      5.100 ppm2      1.516 CV     1
 ASSI { 3902}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      5.000     3.100     1.000 peak  3902 spectrum    1 weight  0.10000E+01 volume  0.47144E-03 ppm1      5.100 ppm2      7.771 CV     1
 ASSI { 3907}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
      3.000     1.100     1.100 peak  3907 spectrum    1 weight  0.10000E+01 volume  0.16858E-02 ppm1      4.933 ppm2      9.493 CV     1
 ASSI { 3908}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      3.800     1.800     1.800 peak  3908 spectrum    1 weight  0.10000E+01 volume  0.10650E-02 ppm1      4.940 ppm2      8.960 CV     1
 ASSI { 3909}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
      2.200     0.600     0.600 peak  3909 spectrum    1 weight  0.10000E+01 volume  0.89874E-02 ppm1      4.937 ppm2      8.720 CV     1
 ASSI { 3910}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      3.600     1.600     1.600 peak  3910 spectrum    1 weight  0.10000E+01 volume  0.21028E-02 ppm1      4.936 ppm2      8.134 CV     1
 ASSI { 3911}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 112  and name HD% )
      2.800     1.000     1.000 peak  3911 spectrum    1 weight  0.10000E+01 volume  0.19165E-02 ppm1      4.945 ppm2      6.729 CV     1
 ASSI { 3913}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HA  ))
      4.200     2.200     1.800 peak  3913 spectrum    1 weight  0.10000E+01 volume  0.62393E-03 ppm1      4.943 ppm2      5.801 CV     1
 ASSI { 3914}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 111  and name HA  ))
      4.800     2.900     1.200 peak  3914 spectrum    1 weight  0.10000E+01 volume  0.33474E-03 ppm1      4.944 ppm2      5.553 CV     1
 ASSI { 3915}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HB2 ))
      2.600     0.800     0.800 peak  3915 spectrum    1 weight  0.10000E+01 volume  0.36826E-02 ppm1      4.942 ppm2      2.691 CV     1
 OR { 3915}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI { 3918}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 113  and name HG2%)
      4.500     2.500     1.500 peak  3918 spectrum    1 weight  0.10000E+01 volume  0.96030E-03 ppm1      4.940 ppm2      1.180 CV     1
 ASSI { 3920}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 140  and name HD2%)
      4.500     2.500     1.500 peak  3920 spectrum    1 weight  0.10000E+01 volume  0.12463E-02 ppm1      4.944 ppm2      0.642 CV     1
 OR { 3920}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 3921}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 140  and name HG  ))
      5.400     3.600     0.600 peak  3921 spectrum    1 weight  0.10000E+01 volume  0.38710E-03 ppm1      4.934 ppm2      0.392 CV     1
 ASSI { 3922}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
      3.400     1.400     1.400 peak  3922 spectrum    1 weight  0.10000E+01 volume  0.21571E-02 ppm1      4.934 ppm2      3.467 CV     1
 OR { 3922}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 58   and name HB1 ))
 ASSI { 3924}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
      3.400     1.400     1.400 peak  3924 spectrum    1 weight  0.10000E+01 volume  0.20340E-02 ppm1      4.297 ppm2      8.717 CV     1
 ASSI { 3925}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 112  and name HD% )
      3.400     1.400     1.400 peak  3925 spectrum    1 weight  0.10000E+01 volume  0.12456E-02 ppm1      4.293 ppm2      6.766 CV     1
 ASSI { 3926}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 112  and name HA  ))
      2.300     0.700     0.700 peak  3926 spectrum    1 weight  0.10000E+01 volume  0.59731E-02 ppm1      4.303 ppm2      4.935 CV     1
 ASSI { 3927}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 90   and name HA1 ))
      3.000     1.100     1.100 peak  3927 spectrum    1 weight  0.10000E+01 volume  0.45133E-02 ppm1      4.293 ppm2      4.690 CV     1
 ASSI { 3928}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
      2.500     0.800     0.800 peak  3928 spectrum    1 weight  0.10000E+01 volume  0.49658E-02 ppm1      4.297 ppm2      3.479 CV     1
 OR { 3928}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB1 ))
 ASSI { 3934}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 126  and name HG2 ))
      3.400     1.400     1.400 peak  3934 spectrum    1 weight  0.10000E+01 volume  0.43895E-02 ppm1      3.908 ppm2      1.420 CV     1
 OR { 3934}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 126  and name HG1 ))
 ASSI { 3935}
   (( segid "    " and resid 123  and name HA  ))
   (  segid "    " and resid 122  and name HB% )
      4.700     2.700     1.300 peak  3935 spectrum    1 weight  0.10000E+01 volume  0.54455E-03 ppm1      3.908 ppm2      1.214 CV     1
 ASSI { 3938}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 49   and name HD% )
      4.500     2.600     1.500 peak  3938 spectrum    1 weight  0.10000E+01 volume  0.40851E-03 ppm1      3.884 ppm2      6.570 CV     1
 ASSI { 3941}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
      2.500     0.800     0.800 peak  3941 spectrum    1 weight  0.10000E+01 volume  0.63231E-02 ppm1      3.886 ppm2      2.008 CV     1
 ASSI { 3943}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 101  and name HA  ))
      4.100     2.100     1.900 peak  3943 spectrum    1 weight  0.10000E+01 volume  0.10630E-02 ppm1      3.855 ppm2      4.904 CV     1
 ASSI { 3944}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB2 ))
      2.400     0.800     0.800 peak  3944 spectrum    1 weight  0.10000E+01 volume  0.73366E-02 ppm1      3.851 ppm2      2.550 CV     1
 OR { 3944}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB1 ))
 ASSI { 3946}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 100  and name HG1%)
      3.100     1.200     1.200 peak  3946 spectrum    1 weight  0.10000E+01 volume  0.28069E-02 ppm1      3.855 ppm2      0.904 CV     1
 ASSI { 3949}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 86   and name HN  ))
      4.400     2.400     1.600 peak  3949 spectrum    1 weight  0.10000E+01 volume  0.45298E-03 ppm1      6.341 ppm2      8.489 CV     1
 ASSI { 3951}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 77   and name HH2 ))
      2.500     0.800     0.800 peak  3951 spectrum    1 weight  0.10000E+01 volume  0.41600E-02 ppm1      6.342 ppm2      6.625 CV     1
 ASSI { 3952}
   (( segid "    " and resid 77   and name HZ3 ))
   (  segid "    " and resid 85   and name HD% )
      5.100     3.300     0.900 peak  3952 spectrum    1 weight  0.10000E+01 volume  0.51965E-03 ppm1      6.348 ppm2      5.968 CV     1
 ASSI { 3958}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 42   and name HG  ))
      3.600     1.600     1.600 peak  3958 spectrum    1 weight  0.10000E+01 volume  0.51482E-03 ppm1      6.351 ppm2      1.861 CV     1
 OR { 3958}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 42   and name HB1 ))
 ASSI { 3959}
   (( segid "    " and resid 77   and name HZ3 ))
   (  segid "    " and resid 41   and name HB% )
      5.100     3.300     0.900 peak  3959 spectrum    1 weight  0.10000E+01 volume  0.25983E-03 ppm1      6.341 ppm2      1.458 CV     1
 ASSI { 3961}
   (( segid "    " and resid 77   and name HZ3 ))
   (  segid "    " and resid 42   and name HD1%)
      3.200     1.300     1.300 peak  3961 spectrum    1 weight  0.10000E+01 volume  0.13149E-02 ppm1      6.349 ppm2      0.871 CV     1
 OR { 3961}
   (( segid "    " and resid 77   and name HZ3 ))
   (  segid "    " and resid 42   and name HD2%)
 ASSI { 3963}
   (( segid "    " and resid 77   and name HZ3 ))
   (  segid "    " and resid 96   and name HD1%)
      4.100     2.100     1.900 peak  3963 spectrum    1 weight  0.10000E+01 volume  0.70171E-03 ppm1      6.345 ppm2      0.113 CV     1
 ASSI { 3979}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      2.800     1.000     1.000 peak  3979 spectrum    1 weight  0.10000E+01 volume  0.17584E-02 ppm1      5.394 ppm2      8.969 CV     1
 ASSI { 3980}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 58   and name HN  ))
      2.200     0.600     0.600 peak  3980 spectrum    1 weight  0.10000E+01 volume  0.79637E-02 ppm1      5.391 ppm2      8.504 CV     1
 ASSI { 3983}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 55   and name HD% )
      3.300     1.400     1.400 peak  3983 spectrum    1 weight  0.10000E+01 volume  0.12415E-02 ppm1      5.392 ppm2      6.685 CV     1
 ASSI { 3988}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB  ))
      2.300     0.600     0.600 peak  3988 spectrum    1 weight  0.10000E+01 volume  0.46124E-02 ppm1      5.389 ppm2      2.056 CV     1
 ASSI { 3989}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HG12))
      3.500     1.500     1.500 peak  3989 spectrum    1 weight  0.10000E+01 volume  0.29611E-02 ppm1      5.399 ppm2      1.763 CV     1
 ASSI { 3990}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 57   and name HD1%)
      2.200     0.600     0.600 peak  3990 spectrum    1 weight  0.10000E+01 volume  0.71587E-02 ppm1      5.393 ppm2      1.007 CV     1
 OR { 3990}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI { 3991}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.600     1.600     1.600 peak  3991 spectrum    1 weight  0.10000E+01 volume  0.13339E-02 ppm1      5.396 ppm2      0.654 CV     1
 OR { 3991}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI { 3992}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
      4.300     2.300     1.700 peak  3992 spectrum    1 weight  0.10000E+01 volume  0.41562E-03 ppm1      5.383 ppm2      8.711 CV     1
 ASSI { 3995}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      2.900     1.000     1.000 peak  3995 spectrum    1 weight  0.10000E+01 volume  0.18027E-02 ppm1      5.032 ppm2      8.950 CV     1
 ASSI { 3996}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 100  and name HG1%)
      3.700     1.700     1.700 peak  3996 spectrum    1 weight  0.10000E+01 volume  0.34843E-02 ppm1      5.017 ppm2      0.886 CV     1
 ASSI { 3997}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      2.100     0.600     0.600 peak  3997 spectrum    1 weight  0.10000E+01 volume  0.88801E-02 ppm1      5.019 ppm2      9.436 CV     1
 ASSI { 3999}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 99   and name HD% )
      3.100     1.200     1.200 peak  3999 spectrum    1 weight  0.10000E+01 volume  0.32603E-02 ppm1      5.021 ppm2      6.809 CV     1
 ASSI { 4000}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 99   and name HE% )
      4.300     2.300     1.700 peak  4000 spectrum    1 weight  0.10000E+01 volume  0.83348E-03 ppm1      5.015 ppm2      6.606 CV     1
 ASSI { 4002}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 100  and name HA  ))
      3.800     1.800     1.800 peak  4002 spectrum    1 weight  0.10000E+01 volume  0.92289E-03 ppm1      5.021 ppm2      3.495 CV     1
 ASSI { 4009}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 58   and name HB1 ))
      4.700     2.800     1.300 peak  4009 spectrum    1 weight  0.10000E+01 volume  0.46946E-03 ppm1      4.381 ppm2      3.489 CV     1
 OR { 4009}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
 ASSI { 4011}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      2.700     0.900     0.900 peak  4011 spectrum    1 weight  0.10000E+01 volume  0.37351E-02 ppm1      4.351 ppm2      7.777 CV     1
 ASSI { 4012}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      2.900     1.100     1.100 peak  4012 spectrum    1 weight  0.10000E+01 volume  0.29904E-02 ppm1      4.353 ppm2      7.576 CV     1
 ASSI { 4014}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG1 ))
      2.700     0.900     0.900 peak  4014 spectrum    1 weight  0.10000E+01 volume  0.50682E-02 ppm1      4.350 ppm2      2.500 CV     1
 ASSI { 4019}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
      4.400     2.400     1.600 peak  4019 spectrum    1 weight  0.10000E+01 volume  0.53782E-03 ppm1      4.249 ppm2      8.956 CV     1
 ASSI { 4022}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 35   and name HB1 ))
      3.800     1.800     1.800 peak  4022 spectrum    1 weight  0.10000E+01 volume  0.22137E-02 ppm1      4.322 ppm2      3.270 CV     1
 ASSI { 4027}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 112  and name HE% )
      3.700     1.700     1.700 peak  4027 spectrum    1 weight  0.10000E+01 volume  0.11284E-02 ppm1      4.274 ppm2      6.331 CV     1
 ASSI { 4035}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      3.900     1.900     1.900 peak  4035 spectrum    1 weight  0.10000E+01 volume  0.58484E-03 ppm1      4.284 ppm2      8.619 CV     1
 ASSI { 4037}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 2    and name HG1 ))
      2.800     1.000     1.000 peak  4037 spectrum    1 weight  0.10000E+01 volume  0.49835E-02 ppm1      4.231 ppm2      2.315 CV     1
 OR { 4037}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 2    and name HG2 ))
 ASSI { 4038}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 2    and name HB1 ))
      2.500     0.800     0.800 peak  4038 spectrum    1 weight  0.10000E+01 volume  0.86427E-02 ppm1      4.233 ppm2      1.957 CV     1
 ASSI { 4040}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 3    and name HB1 ))
      4.800     2.900     1.200 peak  4040 spectrum    1 weight  0.10000E+01 volume  0.73671E-03 ppm1      4.221 ppm2      2.951 CV     1
 ASSI { 4041}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HN  ))
      2.300     0.700     0.700 peak  4041 spectrum    1 weight  0.10000E+01 volume  0.44968E-02 ppm1      4.088 ppm2      7.923 CV     1
 ASSI { 4042}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 128  and name HN  ))
      2.300     0.600     0.600 peak  4042 spectrum    1 weight  0.10000E+01 volume  0.57328E-02 ppm1      4.084 ppm2      7.347 CV     1
 ASSI { 4044}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HB2 ))
      2.300     0.700     0.700 peak  4044 spectrum    1 weight  0.10000E+01 volume  0.79492E-02 ppm1      4.084 ppm2      1.913 CV     1
 OR { 4044}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HB1 ))
 ASSI { 4048}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 85   and name HN  ))
      2.100     0.600     0.600 peak  4048 spectrum    1 weight  0.10000E+01 volume  0.80475E-02 ppm1      5.600 ppm2      9.153 CV     1
 ASSI { 4050}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 54   and name HZ  ))
      4.200     2.200     1.800 peak  4050 spectrum    1 weight  0.10000E+01 volume  0.69510E-03 ppm1      5.591 ppm2      6.728 CV     1
 ASSI { 4051}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 85   and name HD% )
      4.300     2.300     1.700 peak  4051 spectrum    1 weight  0.10000E+01 volume  0.96616E-03 ppm1      5.601 ppm2      5.994 CV     1
 ASSI { 4053}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
      2.800     1.000     1.000 peak  4053 spectrum    1 weight  0.10000E+01 volume  0.22380E-02 ppm1      5.601 ppm2      3.070 CV     1
 ASSI { 4054}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
      2.600     0.800     0.800 peak  4054 spectrum    1 weight  0.10000E+01 volume  0.33392E-02 ppm1      5.595 ppm2      2.678 CV     1
 ASSI { 4056}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 77   and name HB1 ))
      4.400     2.400     1.600 peak  4056 spectrum    1 weight  0.10000E+01 volume  0.32120E-03 ppm1      5.597 ppm2      2.037 CV     1
 ASSI { 4062}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      2.300     0.700     0.700 peak  4062 spectrum    1 weight  0.10000E+01 volume  0.51024E-02 ppm1      5.297 ppm2      8.908 CV     1
 ASSI { 4063}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      2.500     0.800     0.800 peak  4063 spectrum    1 weight  0.10000E+01 volume  0.27700E-02 ppm1      5.292 ppm2      8.734 CV     1
 ASSI { 4064}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      2.900     1.100     1.100 peak  4064 spectrum    1 weight  0.10000E+01 volume  0.14715E-02 ppm1      5.292 ppm2      8.040 CV     1
 ASSI { 4065}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 55   and name HD% )
      3.900     1.900     1.900 peak  4065 spectrum    1 weight  0.10000E+01 volume  0.12057E-02 ppm1      5.292 ppm2      6.655 CV     1
 ASSI { 4066}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 66   and name HA  ))
      2.500     0.800     0.800 peak  4066 spectrum    1 weight  0.10000E+01 volume  0.27008E-02 ppm1      5.286 ppm2      4.839 CV     1
 ASSI { 4069}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB2 ))
      2.500     0.800     0.800 peak  4069 spectrum    1 weight  0.10000E+01 volume  0.34774E-02 ppm1      5.292 ppm2      2.236 CV     1
 ASSI { 4073}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      3.200     1.200     1.200 peak  4073 spectrum    1 weight  0.10000E+01 volume  0.18277E-02 ppm1      5.287 ppm2      0.652 CV     1
 ASSI { 4081}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HB1 ))
      2.200     0.600     0.600 peak  4081 spectrum    1 weight  0.10000E+01 volume  0.81721E-02 ppm1      5.024 ppm2      2.541 CV     1
 OR { 4081}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 4085}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HB2 ))
      2.900     1.100     1.100 peak  4085 spectrum    1 weight  0.10000E+01 volume  0.23790E-02 ppm1      4.959 ppm2      2.332 CV     1
 ASSI { 4086}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 35   and name HB1 ))
      3.900     1.900     1.900 peak  4086 spectrum    1 weight  0.10000E+01 volume  0.74666E-03 ppm1      4.955 ppm2      3.277 CV     1
 ASSI { 4097}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 55   and name HE% )
      4.000     2.000     2.000 peak  4097 spectrum    1 weight  0.10000E+01 volume  0.98721E-03 ppm1      4.395 ppm2      7.226 CV     1
 ASSI { 4099}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
      2.200     0.600     0.600 peak  4099 spectrum    1 weight  0.10000E+01 volume  0.12769E-01 ppm1      4.408 ppm2      2.250 CV     1
 OR { 4099}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB2 ))
 OR { 4099}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG1 ))
 ASSI { 4101}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 126  and name HG1 ))
      4.700     2.800     1.300 peak  4101 spectrum    1 weight  0.10000E+01 volume  0.37298E-03 ppm1      4.104 ppm2      1.410 CV     1
 OR { 4101}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI { 4106}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HN  ))
      3.000     1.100     1.100 peak  4106 spectrum    1 weight  0.10000E+01 volume  0.21947E-02 ppm1      3.951 ppm2      7.940 CV     1
 ASSI { 4108}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HD21))
      3.500     1.600     1.600 peak  4108 spectrum    1 weight  0.10000E+01 volume  0.90655E-03 ppm1      3.951 ppm2      7.109 CV     1
 ASSI { 4111}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 85   and name HE% )
      3.100     1.200     1.200 peak  4111 spectrum    1 weight  0.10000E+01 volume  0.15365E-02 ppm1      3.958 ppm2      5.661 CV     1
 ASSI { 4113}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HB1 ))
      2.800     1.000     1.000 peak  4113 spectrum    1 weight  0.10000E+01 volume  0.58756E-02 ppm1      3.953 ppm2      2.674 CV     1
 ASSI { 4114}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
      2.600     0.900     0.900 peak  4114 spectrum    1 weight  0.10000E+01 volume  0.41004E-02 ppm1      3.963 ppm2      2.269 CV     1
 ASSI { 4117}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HD22))
      4.900     3.000     1.100 peak  4117 spectrum    1 weight  0.10000E+01 volume  0.48729E-03 ppm1      3.947 ppm2      6.253 CV     1
 ASSI { 4119}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 92   and name HE3 ))
      2.600     0.800     0.800 peak  4119 spectrum    1 weight  0.10000E+01 volume  0.34938E-02 ppm1      6.708 ppm2      7.337 CV     1
 ASSI { 4126}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 30   and name HA  ))
      5.100     3.300     0.900 peak  4126 spectrum    1 weight  0.10000E+01 volume  0.37708E-03 ppm1      6.698 ppm2      4.922 CV     1
 ASSI { 4127}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 93   and name HA1 ))
      5.500     3.800     0.500 peak  4127 spectrum    1 weight  0.10000E+01 volume  0.42070E-03 ppm1      6.697 ppm2      4.315 CV     1
 ASSI { 4128}
   (( segid "    " and resid 92   and name HZ3 ))
   (  segid "    " and resid 96   and name HG2%)
      3.900     1.900     1.900 peak  4128 spectrum    1 weight  0.10000E+01 volume  0.62104E-03 ppm1      6.704 ppm2      0.284 CV     1
 ASSI { 4129}
   (( segid "    " and resid 92   and name HZ3 ))
   (  segid "    " and resid 96   and name HD1%)
      3.900     1.900     1.900 peak  4129 spectrum    1 weight  0.10000E+01 volume  0.73155E-03 ppm1      6.695 ppm2      0.104 CV     1
 ASSI { 4131}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 84   and name HE% )
      4.300     2.300     1.700 peak  4131 spectrum    1 weight  0.10000E+01 volume  0.47635E-03 ppm1      5.598 ppm2      6.238 CV     1
 ASSI { 4133}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      4.300     2.300     1.700 peak  4133 spectrum    1 weight  0.10000E+01 volume  0.77973E-03 ppm1      5.100 ppm2      8.907 CV     1
 ASSI { 4134}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      2.100     0.600     0.600 peak  4134 spectrum    1 weight  0.10000E+01 volume  0.80627E-02 ppm1      5.086 ppm2      8.494 CV     1
 ASSI { 4135}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HN  ))
      3.000     1.100     1.100 peak  4135 spectrum    1 weight  0.10000E+01 volume  0.18016E-02 ppm1      5.082 ppm2      8.231 CV     1
 ASSI { 4138}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 57   and name HA  ))
      2.700     0.900     0.900 peak  4138 spectrum    1 weight  0.10000E+01 volume  0.23516E-02 ppm1      5.088 ppm2      5.397 CV     1
 ASSI { 4141}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB1 ))
      2.600     0.800     0.800 peak  4141 spectrum    1 weight  0.10000E+01 volume  0.38354E-02 ppm1      5.084 ppm2      1.035 CV     1
 ASSI { 4142}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      2.400     0.700     0.700 peak  4142 spectrum    1 weight  0.10000E+01 volume  0.52997E-02 ppm1      5.086 ppm2      0.658 CV     1
 OR { 4142}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI { 4143}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HG2 ))
      4.300     2.300     1.700 peak  4143 spectrum    1 weight  0.10000E+01 volume  0.63483E-03 ppm1      5.082 ppm2     -0.129 CV     1
 ASSI { 4147}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HB1 ))
      3.100     1.200     1.200 peak  4147 spectrum    1 weight  0.10000E+01 volume  0.25733E-02 ppm1      4.959 ppm2      2.915 CV     1
 ASSI { 4153}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB1 ))
      2.700     0.900     0.900 peak  4153 spectrum    1 weight  0.10000E+01 volume  0.39921E-02 ppm1      4.888 ppm2      1.861 CV     1
 OR { 4153}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI { 4154}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HN  ))
      3.300     1.400     1.400 peak  4154 spectrum    1 weight  0.10000E+01 volume  0.94758E-03 ppm1      4.846 ppm2      9.116 CV     1
 ASSI { 4156}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      4.500     2.500     1.500 peak  4156 spectrum    1 weight  0.10000E+01 volume  0.23632E-03 ppm1      4.854 ppm2      6.624 CV     1
 ASSI { 4160}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 130  and name HN  ))
      3.800     1.800     1.800 peak  4160 spectrum    1 weight  0.10000E+01 volume  0.80322E-03 ppm1      4.842 ppm2      8.013 CV     1
 ASSI { 4177}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      4.700     2.700     1.300 peak  4177 spectrum    1 weight  0.10000E+01 volume  0.93297E-03 ppm1      4.290 ppm2      7.913 CV     1
 ASSI { 4178}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 58   and name HB1 ))
      3.800     1.800     1.800 peak  4178 spectrum    1 weight  0.10000E+01 volume  0.81490E-03 ppm1      4.293 ppm2      3.509 CV     1
 OR { 4178}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
 ASSI { 4181}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 57   and name HA  ))
      4.900     3.100     1.100 peak  4181 spectrum    1 weight  0.10000E+01 volume  0.73688E-03 ppm1      4.292 ppm2      5.402 CV     1
 ASSI { 4182}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 57   and name HG12))
      3.200     1.300     1.300 peak  4182 spectrum    1 weight  0.10000E+01 volume  0.30065E-02 ppm1      4.288 ppm2      1.761 CV     1
 ASSI { 4183}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 57   and name HD1%)
      2.400     0.700     0.700 peak  4183 spectrum    1 weight  0.10000E+01 volume  0.45497E-02 ppm1      4.288 ppm2      0.995 CV     1
 ASSI { 4185}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 128  and name HN  ))
      4.200     2.200     1.800 peak  4185 spectrum    1 weight  0.10000E+01 volume  0.33655E-03 ppm1      6.948 ppm2      7.433 CV     1
 ASSI { 4186}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 121  and name HE1 ))
      5.200     3.300     0.800 peak  4186 spectrum    1 weight  0.10000E+01 volume  0.33355E-03 ppm1      6.927 ppm2      9.462 CV     1
 ASSI { 4187}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 126  and name HN  ))
      3.900     1.900     1.900 peak  4187 spectrum    1 weight  0.10000E+01 volume  0.86580E-03 ppm1      6.934 ppm2      8.352 CV     1
 ASSI { 4188}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 121  and name HZ3 ))
      2.200     0.600     0.600 peak  4188 spectrum    1 weight  0.10000E+01 volume  0.57514E-02 ppm1      6.936 ppm2      7.099 CV     1
 ASSI { 4189}
   (( segid "    " and resid 121  and name HH2 ))
   (  segid "    " and resid 85   and name HE% )
      4.100     2.100     1.900 peak  4189 spectrum    1 weight  0.10000E+01 volume  0.33622E-03 ppm1      6.927 ppm2      5.662 CV     1
 ASSI { 4191}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 128  and name HA1 ))
      4.600     2.700     1.400 peak  4191 spectrum    1 weight  0.10000E+01 volume  0.69960E-03 ppm1      6.935 ppm2      3.320 CV     1
 ASSI { 4194}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 125  and name HB2 ))
      4.900     3.000     1.100 peak  4194 spectrum    1 weight  0.10000E+01 volume  0.41612E-03 ppm1      6.933 ppm2      2.715 CV     1
 OR { 4194}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 125  and name HB1 ))
 ASSI { 4195}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 128  and name HA2 ))
      4.500     2.500     1.500 peak  4195 spectrum    1 weight  0.10000E+01 volume  0.80041E-03 ppm1      6.938 ppm2      2.383 CV     1
 ASSI { 4196}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 127  and name HG2 ))
      4.200     2.200     1.800 peak  4196 spectrum    1 weight  0.10000E+01 volume  0.12358E-02 ppm1      6.933 ppm2      2.229 CV     1
 OR { 4196}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 127  and name HG1 ))
 ASSI { 4203}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 121  and name HN  ))
      2.400     0.700     0.700 peak  4203 spectrum    1 weight  0.10000E+01 volume  0.47808E-02 ppm1      5.745 ppm2      9.079 CV     1
 ASSI { 4204}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      2.400     0.700     0.700 peak  4204 spectrum    1 weight  0.10000E+01 volume  0.26636E-02 ppm1      5.747 ppm2      8.762 CV     1
 ASSI { 4207}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 84   and name HD% )
      4.500     2.500     1.500 peak  4207 spectrum    1 weight  0.10000E+01 volume  0.72165E-03 ppm1      5.746 ppm2      6.921 CV     1
 ASSI { 4209}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 121  and name HA  ))
      4.400     2.400     1.600 peak  4209 spectrum    1 weight  0.10000E+01 volume  0.41280E-03 ppm1      5.742 ppm2      4.852 CV     1
 ASSI { 4212}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HB1 ))
      2.500     0.800     0.800 peak  4212 spectrum    1 weight  0.10000E+01 volume  0.37372E-02 ppm1      5.746 ppm2      2.988 CV     1
 ASSI { 4213}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
      2.500     0.800     0.800 peak  4213 spectrum    1 weight  0.10000E+01 volume  0.45715E-02 ppm1      5.750 ppm2      2.753 CV     1
 ASSI { 4214}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 41   and name HB% )
      2.800     1.000     1.000 peak  4214 spectrum    1 weight  0.10000E+01 volume  0.40804E-02 ppm1      5.750 ppm2      1.473 CV     1
 ASSI { 4222}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 77   and name HZ3 ))
      3.800     1.800     1.800 peak  4222 spectrum    1 weight  0.10000E+01 volume  0.29016E-03 ppm1      5.707 ppm2      6.313 CV     1
 ASSI { 4223}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 85   and name HD% )
      3.500     1.600     1.600 peak  4223 spectrum    1 weight  0.10000E+01 volume  0.21854E-02 ppm1      5.691 ppm2      5.998 CV     1
 ASSI { 4225}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name HB2 ))
      2.600     0.800     0.800 peak  4225 spectrum    1 weight  0.10000E+01 volume  0.26113E-02 ppm1      5.695 ppm2      2.385 CV     1
 ASSI { 4233}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
      3.700     1.700     1.700 peak  4233 spectrum    1 weight  0.10000E+01 volume  0.76656E-03 ppm1      4.951 ppm2      9.487 CV     1
 ASSI { 4234}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
      1.900     0.500     0.500 peak  4234 spectrum    1 weight  0.10000E+01 volume  0.14584E-01 ppm1      4.953 ppm2      9.252 CV     1
 ASSI { 4237}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
      2.700     0.900     0.900 peak  4237 spectrum    1 weight  0.10000E+01 volume  0.44006E-02 ppm1      4.953 ppm2      1.864 CV     1
 ASSI { 4241}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
      4.100     2.100     1.900 peak  4241 spectrum    1 weight  0.10000E+01 volume  0.80937E-03 ppm1      4.959 ppm2      0.567 CV     1
 ASSI { 4242}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HG  ))
      4.600     2.600     1.400 peak  4242 spectrum    1 weight  0.10000E+01 volume  0.74708E-03 ppm1      4.947 ppm2      0.392 CV     1
 ASSI { 4249}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
      2.900     1.000     1.000 peak  4249 spectrum    1 weight  0.10000E+01 volume  0.25830E-02 ppm1      4.556 ppm2      2.822 CV     1
 OR { 4249}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 4255}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 82   and name HN  ))
      2.700     0.900     0.900 peak  4255 spectrum    1 weight  0.10000E+01 volume  0.28390E-02 ppm1      4.068 ppm2      5.641 CV     1
 ASSI { 4259}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
      2.700     0.900     0.900 peak  4259 spectrum    1 weight  0.10000E+01 volume  0.32658E-02 ppm1      4.841 ppm2      0.826 CV     1
 OR { 4259}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI { 4261}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 5    and name HN  ))
      3.500     1.500     1.500 peak  4261 spectrum    1 weight  0.10000E+01 volume  0.59400E-03 ppm1      4.746 ppm2      9.301 CV     1
 ASSI { 4274}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 123  and name HN  ))
      3.800     1.900     1.900 peak  4274 spectrum    1 weight  0.10000E+01 volume  0.12195E-02 ppm1      4.446 ppm2      8.265 CV     1
 ASSI { 4279}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HB1 ))
      2.000     0.500     0.500 peak  4279 spectrum    1 weight  0.10000E+01 volume  0.21577E-01 ppm1      4.428 ppm2      2.620 CV     1
 ASSI { 4281}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 126  and name HG1 ))
      3.900     1.900     1.900 peak  4281 spectrum    1 weight  0.10000E+01 volume  0.14371E-02 ppm1      4.430 ppm2      1.404 CV     1
 OR { 4281}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI { 4282}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 121  and name HH2 ))
      4.900     3.000     1.100 peak  4282 spectrum    1 weight  0.10000E+01 volume  0.71232E-03 ppm1      4.414 ppm2      6.967 CV     1
 ASSI { 4284}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 121  and name HD1 ))
      4.400     2.400     1.600 peak  4284 spectrum    1 weight  0.10000E+01 volume  0.93709E-03 ppm1      4.418 ppm2      6.381 CV     1
 ASSI { 4289}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 126  and name HE2 ))
      4.800     2.900     1.200 peak  4289 spectrum    1 weight  0.10000E+01 volume  0.52911E-03 ppm1      4.414 ppm2      2.964 CV     1
 ASSI { 4290}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 125  and name HB1 ))
      4.500     2.500     1.500 peak  4290 spectrum    1 weight  0.10000E+01 volume  0.70567E-03 ppm1      4.409 ppm2      2.799 CV     1
 ASSI { 4291}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HB2 ))
      3.200     1.300     1.300 peak  4291 spectrum    1 weight  0.10000E+01 volume  0.83591E-03 ppm1      4.414 ppm2      2.216 CV     1
 ASSI { 4297}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 99   and name HE% )
      4.600     2.600     1.400 peak  4297 spectrum    1 weight  0.10000E+01 volume  0.69262E-03 ppm1      4.074 ppm2      6.585 CV     1
 ASSI { 4298}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 83   and name HN  ))
      4.100     2.100     1.900 peak  4298 spectrum    1 weight  0.10000E+01 volume  0.13164E-02 ppm1      4.066 ppm2      7.461 CV     1
 ASSI { 4299}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 99   and name HB1 ))
      2.100     0.600     0.600 peak  4299 spectrum    1 weight  0.10000E+01 volume  0.55231E-02 ppm1      4.040 ppm2      2.532 CV     1
 OR { 4299}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 4300}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      3.900     1.900     1.900 peak  4300 spectrum    1 weight  0.10000E+01 volume  0.93305E-03 ppm1      4.038 ppm2      9.429 CV     1
 ASSI { 4301}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      6.000     5.600     0.000 peak  4301 spectrum    1 weight  0.10000E+01 volume  0.30947E-03 ppm1      4.028 ppm2      8.948 CV     1
 ASSI { 4302}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 99   and name HD% )
      2.700     0.900     0.900 peak  4302 spectrum    1 weight  0.10000E+01 volume  0.27370E-02 ppm1      4.032 ppm2      6.804 CV     1
 ASSI { 4304}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 100  and name HG1%)
      3.800     1.800     1.800 peak  4304 spectrum    1 weight  0.10000E+01 volume  0.10150E-02 ppm1      4.036 ppm2      0.875 CV     1
 ASSI { 4315}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 71   and name HG2 ))
      3.700     1.700     1.700 peak  4315 spectrum    1 weight  0.10000E+01 volume  0.10987E-02 ppm1      6.630 ppm2      1.889 CV     1
 OR { 4315}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI { 4317}
   (( segid "    " and resid 77   and name HH2 ))
   (  segid "    " and resid 40   and name HG1%)
      3.200     1.300     1.300 peak  4317 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      6.626 ppm2      1.247 CV     1
 OR { 4317}
   (( segid "    " and resid 77   and name HH2 ))
   (  segid "    " and resid 40   and name HG2%)
 ASSI { 4318}
   (( segid "    " and resid 77   and name HH2 ))
   (  segid "    " and resid 42   and name HD2%)
      3.300     1.400     1.400 peak  4318 spectrum    1 weight  0.10000E+01 volume  0.14598E-02 ppm1      6.627 ppm2      0.897 CV     1
 OR { 4318}
   (( segid "    " and resid 77   and name HH2 ))
   (  segid "    " and resid 42   and name HD1%)
 ASSI { 4320}
   (( segid "    " and resid 77   and name HH2 ))
   (  segid "    " and resid 96   and name HD1%)
      4.400     2.400     1.600 peak  4320 spectrum    1 weight  0.10000E+01 volume  0.28401E-03 ppm1      6.621 ppm2      0.125 CV     1
 ASSI { 4321}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 41   and name HN  ))
      4.700     2.800     1.300 peak  4321 spectrum    1 weight  0.10000E+01 volume  0.33560E-03 ppm1      6.609 ppm2      8.784 CV     1
 ASSI { 4329}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
      4.200     2.200     1.800 peak  4329 spectrum    1 weight  0.10000E+01 volume  0.70864E-03 ppm1      4.856 ppm2      0.631 CV     1
 ASSI { 4332}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HN  ))
      2.700     0.900     0.900 peak  4332 spectrum    1 weight  0.10000E+01 volume  0.46780E-02 ppm1      4.501 ppm2      8.317 CV     1
 ASSI { 4336}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HG1 ))
      4.700     2.700     1.300 peak  4336 spectrum    1 weight  0.10000E+01 volume  0.69832E-03 ppm1      4.503 ppm2      1.367 CV     1
 OR { 4336}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI { 4338}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
      2.400     0.700     0.700 peak  4338 spectrum    1 weight  0.10000E+01 volume  0.64424E-02 ppm1      4.036 ppm2      8.572 CV     1
 ASSI { 4340}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 22   and name HB% )
      2.300     0.600     0.600 peak  4340 spectrum    1 weight  0.10000E+01 volume  0.76767E-02 ppm1      4.038 ppm2      1.491 CV     1
 ASSI { 4342}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      3.000     1.100     1.100 peak  4342 spectrum    1 weight  0.10000E+01 volume  0.13857E-02 ppm1      5.339 ppm2      9.135 CV     1
 ASSI { 4343}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      2.200     0.600     0.600 peak  4343 spectrum    1 weight  0.10000E+01 volume  0.71075E-02 ppm1      5.339 ppm2      8.852 CV     1
 ASSI { 4347}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB1 ))
      2.700     0.900     0.900 peak  4347 spectrum    1 weight  0.10000E+01 volume  0.20391E-02 ppm1      5.342 ppm2      1.815 CV     1
 OR { 4347}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HG  ))
 ASSI { 4349}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB2 ))
      2.900     1.100     1.100 peak  4349 spectrum    1 weight  0.10000E+01 volume  0.35832E-02 ppm1      5.330 ppm2      1.274 CV     1
 ASSI { 4350}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 42   and name HD2%)
      2.700     0.900     0.900 peak  4350 spectrum    1 weight  0.10000E+01 volume  0.46673E-02 ppm1      5.334 ppm2      0.923 CV     1
 OR { 4350}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 42   and name HD1%)
 ASSI { 4352}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name HB2 ))
      5.200     3.400     0.800 peak  4352 spectrum    1 weight  0.10000E+01 volume  0.37570E-03 ppm1      5.331 ppm2     -0.423 CV     1
 ASSI { 4354}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 139  and name HN  ))
      4.800     2.900     1.200 peak  4354 spectrum    1 weight  0.10000E+01 volume  0.50054E-03 ppm1      5.051 ppm2      9.154 CV     1
 ASSI { 4355}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HN  ))
      2.800     1.000     1.000 peak  4355 spectrum    1 weight  0.10000E+01 volume  0.22995E-02 ppm1      5.049 ppm2      7.860 CV     1
 ASSI { 4360}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 138  and name HN  ))
      5.200     3.300     0.800 peak  4360 spectrum    1 weight  0.10000E+01 volume  0.25124E-03 ppm1      5.001 ppm2      9.551 CV     1
 ASSI { 4365}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HB2 ))
      2.500     0.800     0.800 peak  4365 spectrum    1 weight  0.10000E+01 volume  0.67706E-02 ppm1      4.498 ppm2      2.750 CV     1
 OR { 4365}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HB1 ))
 ASSI { 4370}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      4.300     2.300     1.700 peak  4370 spectrum    1 weight  0.10000E+01 volume  0.95460E-03 ppm1      4.375 ppm2      9.420 CV     1
 ASSI { 4374}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      2.700     0.900     0.900 peak  4374 spectrum    1 weight  0.10000E+01 volume  0.42025E-02 ppm1      4.383 ppm2      1.066 CV     1
 ASSI { 4376}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 19   and name HD2%)
      2.200     0.600     0.600 peak  4376 spectrum    1 weight  0.10000E+01 volume  0.10473E-01 ppm1      4.382 ppm2      0.408 CV     1
 ASSI { 4383}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      2.800     1.000     1.000 peak  4383 spectrum    1 weight  0.10000E+01 volume  0.21228E-02 ppm1      4.313 ppm2      7.806 CV     1
 ASSI { 4384}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 55   and name HE% )
      2.600     0.900     0.900 peak  4384 spectrum    1 weight  0.10000E+01 volume  0.42809E-02 ppm1      4.315 ppm2      7.160 CV     1
 ASSI { 4386}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 55   and name HD% )
      3.500     1.600     1.600 peak  4386 spectrum    1 weight  0.10000E+01 volume  0.99988E-03 ppm1      4.316 ppm2      6.641 CV     1
 ASSI { 4387}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HB1 ))
      2.600     0.900     0.900 peak  4387 spectrum    1 weight  0.10000E+01 volume  0.35950E-02 ppm1      4.312 ppm2      3.581 CV     1
 ASSI { 4388}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HB2 ))
      2.900     1.000     1.000 peak  4388 spectrum    1 weight  0.10000E+01 volume  0.29000E-02 ppm1      4.311 ppm2      2.648 CV     1
 ASSI { 4391}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 57   and name HG2%)
      3.500     1.500     1.500 peak  4391 spectrum    1 weight  0.10000E+01 volume  0.13024E-02 ppm1      4.308 ppm2      1.000 CV     1
 OR { 4391}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 57   and name HD1%)
 ASSI { 4402}
   (( segid "    " and resid 92   and name HE3 ))
   (( segid "    " and resid 94   and name HN  ))
      3.700     1.700     1.700 peak  4402 spectrum    1 weight  0.10000E+01 volume  0.37732E-03 ppm1      7.347 ppm2      7.937 CV     1
 ASSI { 4403}
   (( segid "    " and resid 92   and name HE3 ))
   (( segid "    " and resid 92   and name HN  ))
      4.500     2.600     1.500 peak  4403 spectrum    1 weight  0.10000E+01 volume  0.53641E-03 ppm1      7.347 ppm2      7.557 CV     1
 ASSI { 4406}
   (( segid "    " and resid 92   and name HE3 ))
   (( segid "    " and resid 92   and name HA  ))
      3.900     1.900     1.900 peak  4406 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      7.343 ppm2      4.585 CV     1
 ASSI { 4410}
   (( segid "    " and resid 92   and name HE3 ))
   (( segid "    " and resid 92   and name HB2 ))
      3.900     1.900     1.900 peak  4410 spectrum    1 weight  0.10000E+01 volume  0.22812E-02 ppm1      7.344 ppm2      2.951 CV     1
 ASSI { 4411}
   (( segid "    " and resid 92   and name HE3 ))
   (( segid "    " and resid 30   and name HB  ))
      3.600     1.700     1.700 peak  4411 spectrum    1 weight  0.10000E+01 volume  0.16403E-02 ppm1      7.344 ppm2      2.169 CV     1
 ASSI { 4415}
   (( segid "    " and resid 92   and name HE3 ))
   (  segid "    " and resid 96   and name HG2%)
      4.300     2.300     1.700 peak  4415 spectrum    1 weight  0.10000E+01 volume  0.41728E-03 ppm1      7.344 ppm2      0.285 CV     1
 ASSI { 4416}
   (( segid "    " and resid 92   and name HE3 ))
   (  segid "    " and resid 96   and name HD1%)
      4.600     2.700     1.400 peak  4416 spectrum    1 weight  0.10000E+01 volume  0.32597E-03 ppm1      7.343 ppm2      0.115 CV     1
 ASSI { 4417}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 121  and name HZ3 ))
      3.100     1.200     1.200 peak  4417 spectrum    1 weight  0.10000E+01 volume  0.90543E-03 ppm1      6.847 ppm2      7.112 CV     1
 ASSI { 4421}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 121  and name HA  ))
      3.400     1.500     1.500 peak  4421 spectrum    1 weight  0.10000E+01 volume  0.16566E-02 ppm1      6.840 ppm2      4.827 CV     1
 ASSI { 4422}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 129  and name HA  ))
      3.300     1.400     1.400 peak  4422 spectrum    1 weight  0.10000E+01 volume  0.12400E-02 ppm1      6.839 ppm2      4.675 CV     1
 ASSI { 4423}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 129  and name HB1 ))
      3.600     1.600     1.600 peak  4423 spectrum    1 weight  0.10000E+01 volume  0.10240E-02 ppm1      6.841 ppm2      3.110 CV     1
 ASSI { 4425}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 121  and name HB1 ))
      4.100     2.100     1.900 peak  4425 spectrum    1 weight  0.10000E+01 volume  0.15235E-02 ppm1      6.839 ppm2      2.755 CV     1
 ASSI { 4426}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 121  and name HB2 ))
      2.700     0.900     0.900 peak  4426 spectrum    1 weight  0.10000E+01 volume  0.14925E-02 ppm1      6.839 ppm2      2.507 CV     1
 ASSI { 4428}
   (( segid "    " and resid 121  and name HE3 ))
   (  segid "    " and resid 41   and name HB% )
      3.800     1.800     1.800 peak  4428 spectrum    1 weight  0.10000E+01 volume  0.81069E-03 ppm1      6.845 ppm2      1.485 CV     1
 ASSI { 4430}
   (( segid "    " and resid 121  and name HE3 ))
   (  segid "    " and resid 83   and name HG2%)
      3.700     1.700     1.700 peak  4430 spectrum    1 weight  0.10000E+01 volume  0.12308E-02 ppm1      6.844 ppm2      0.850 CV     1
 ASSI { 4431}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 121  and name HN  ))
      5.000     3.100     1.000 peak  4431 spectrum    1 weight  0.10000E+01 volume  0.53893E-03 ppm1      6.834 ppm2      9.077 CV     1
 ASSI { 4436}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 128  and name HA1 ))
      4.300     2.400     1.700 peak  4436 spectrum    1 weight  0.10000E+01 volume  0.31929E-03 ppm1      6.839 ppm2      3.297 CV     1
 ASSI { 4438}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 137  and name HN  ))
      2.400     0.700     0.700 peak  4438 spectrum    1 weight  0.10000E+01 volume  0.37343E-02 ppm1      5.049 ppm2      9.420 CV     1
 ASSI { 4439}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      2.300     0.600     0.600 peak  4439 spectrum    1 weight  0.10000E+01 volume  0.70670E-02 ppm1      5.047 ppm2      8.401 CV     1
 ASSI { 4440}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 138  and name HA  ))
      3.900     1.900     1.900 peak  4440 spectrum    1 weight  0.10000E+01 volume  0.10057E-02 ppm1      5.045 ppm2      5.285 CV     1
 ASSI { 4441}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 136  and name HA2 ))
      3.900     1.900     1.900 peak  4441 spectrum    1 weight  0.10000E+01 volume  0.97767E-03 ppm1      5.039 ppm2      3.480 CV     1
 ASSI { 4442}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB1 ))
      2.600     0.800     0.800 peak  4442 spectrum    1 weight  0.10000E+01 volume  0.36997E-02 ppm1      5.048 ppm2      2.970 CV     1
 ASSI { 4443}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB2 ))
      2.900     1.100     1.100 peak  4443 spectrum    1 weight  0.10000E+01 volume  0.32062E-02 ppm1      5.051 ppm2      2.508 CV     1
 ASSI { 4444}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 10   and name HB1 ))
      4.300     2.400     1.700 peak  4444 spectrum    1 weight  0.10000E+01 volume  0.51961E-03 ppm1      5.047 ppm2      1.807 CV     1
 ASSI { 4445}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 10   and name HB2 ))
      4.500     2.500     1.500 peak  4445 spectrum    1 weight  0.10000E+01 volume  0.64693E-03 ppm1      5.047 ppm2      1.465 CV     1
 ASSI { 4447}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 10   and name HD1%)
      4.500     2.500     1.500 peak  4447 spectrum    1 weight  0.10000E+01 volume  0.73320E-03 ppm1      5.041 ppm2      0.479 CV     1
 ASSI { 4448}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 117  and name HN  ))
      2.200     0.600     0.600 peak  4448 spectrum    1 weight  0.10000E+01 volume  0.76066E-02 ppm1      4.958 ppm2      9.045 CV     1
 ASSI { 4450}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HN  ))
      3.000     1.100     1.100 peak  4450 spectrum    1 weight  0.10000E+01 volume  0.13377E-02 ppm1      4.966 ppm2      8.695 CV     1
 ASSI { 4451}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 44   and name HA  ))
      2.500     0.800     0.800 peak  4451 spectrum    1 weight  0.10000E+01 volume  0.29962E-02 ppm1      4.964 ppm2      5.288 CV     1
 ASSI { 4453}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
      2.900     1.000     1.000 peak  4453 spectrum    1 weight  0.10000E+01 volume  0.31618E-02 ppm1      4.964 ppm2      1.006 CV     1
 ASSI { 4454}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 116  and name HD2%)
      2.400     0.700     0.700 peak  4454 spectrum    1 weight  0.10000E+01 volume  0.73783E-02 ppm1      4.962 ppm2      0.490 CV     1
 OR { 4454}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 4456}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB1 ))
      2.800     1.000     1.000 peak  4456 spectrum    1 weight  0.10000E+01 volume  0.18240E-02 ppm1      4.960 ppm2      1.750 CV     1
 ASSI { 4459}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 102  and name HN  ))
      2.200     0.600     0.600 peak  4459 spectrum    1 weight  0.10000E+01 volume  0.10076E-01 ppm1      4.911 ppm2      8.472 CV     1
 ASSI { 4468}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
      2.700     0.900     0.900 peak  4468 spectrum    1 weight  0.10000E+01 volume  0.34122E-02 ppm1      4.868 ppm2      1.614 CV     1
 OR { 4468}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 4469}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      2.500     0.800     0.800 peak  4469 spectrum    1 weight  0.10000E+01 volume  0.38715E-02 ppm1      4.859 ppm2      8.192 CV     1
 ASSI { 4470}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      3.200     1.300     1.300 peak  4470 spectrum    1 weight  0.10000E+01 volume  0.10673E-02 ppm1      4.862 ppm2      7.380 CV     1
 ASSI { 4471}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      4.600     2.600     1.400 peak  4471 spectrum    1 weight  0.10000E+01 volume  0.44700E-03 ppm1      4.854 ppm2      6.646 CV     1
 ASSI { 4481}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
      4.800     2.900     1.200 peak  4481 spectrum    1 weight  0.10000E+01 volume  0.36993E-03 ppm1      5.594 ppm2      9.241 CV     1
 ASSI { 4485}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 140  and name HG  ))
      4.800     2.800     1.200 peak  4485 spectrum    1 weight  0.10000E+01 volume  0.43527E-03 ppm1      5.588 ppm2      0.367 CV     1
 ASSI { 4486}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
      2.100     0.600     0.600 peak  4486 spectrum    1 weight  0.10000E+01 volume  0.10681E-01 ppm1      5.590 ppm2      9.439 CV     1
 ASSI { 4487}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
      2.900     1.100     1.100 peak  4487 spectrum    1 weight  0.10000E+01 volume  0.21249E-02 ppm1      5.594 ppm2      8.507 CV     1
 ASSI { 4489}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 112  and name HE% )
      4.600     2.700     1.400 peak  4489 spectrum    1 weight  0.10000E+01 volume  0.44762E-03 ppm1      5.586 ppm2      6.335 CV     1
 ASSI { 4490}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 141  and name HA  ))
      2.600     0.900     0.900 peak  4490 spectrum    1 weight  0.10000E+01 volume  0.38122E-02 ppm1      5.588 ppm2      5.133 CV     1
 ASSI { 4494}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB1 ))
      2.900     1.000     1.000 peak  4494 spectrum    1 weight  0.10000E+01 volume  0.44617E-02 ppm1      5.585 ppm2      2.704 CV     1
 ASSI { 4495}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB2 ))
      2.500     0.800     0.800 peak  4495 spectrum    1 weight  0.10000E+01 volume  0.45336E-02 ppm1      5.581 ppm2      2.527 CV     1
 ASSI { 4496}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 141  and name HG2%)
      3.300     1.300     1.300 peak  4496 spectrum    1 weight  0.10000E+01 volume  0.15647E-02 ppm1      5.590 ppm2      1.178 CV     1
 ASSI { 4499}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
      2.900     1.000     1.000 peak  4499 spectrum    1 weight  0.10000E+01 volume  0.20508E-02 ppm1      5.393 ppm2      9.257 CV     1
 ASSI { 4503}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 141  and name HB  ))
      4.000     2.000     2.000 peak  4503 spectrum    1 weight  0.10000E+01 volume  0.15159E-02 ppm1      5.392 ppm2      3.927 CV     1
 ASSI { 4506}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
      3.000     1.200     1.200 peak  4506 spectrum    1 weight  0.10000E+01 volume  0.26275E-02 ppm1      5.394 ppm2      1.702 CV     1
 ASSI { 4509}
   (( segid "    " and resid 140  and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
      2.500     0.800     0.800 peak  4509 spectrum    1 weight  0.10000E+01 volume  0.81688E-02 ppm1      5.392 ppm2      0.644 CV     1
 OR { 4509}
   (( segid "    " and resid 140  and name HA  ))
   (  segid "    " and resid 140  and name HD2%)
 ASSI { 4511}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 89   and name HN  ))
      2.200     0.600     0.600 peak  4511 spectrum    1 weight  0.10000E+01 volume  0.12295E-01 ppm1      4.939 ppm2      8.150 CV     1
 ASSI { 4512}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HN  ))
      3.000     1.100     1.100 peak  4512 spectrum    1 weight  0.10000E+01 volume  0.19916E-02 ppm1      4.938 ppm2      7.301 CV     1
 ASSI { 4516}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
      4.700     2.700     1.300 peak  4516 spectrum    1 weight  0.10000E+01 volume  0.80970E-03 ppm1      4.936 ppm2      1.843 CV     1
 ASSI { 4518}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      2.900     1.100     1.100 peak  4518 spectrum    1 weight  0.10000E+01 volume  0.14217E-02 ppm1      4.841 ppm2      7.211 CV     1
 ASSI { 4525}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HN  ))
      2.800     1.000     1.000 peak  4525 spectrum    1 weight  0.10000E+01 volume  0.26642E-02 ppm1      5.156 ppm2      9.450 CV     1
 ASSI { 4526}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
      1.900     0.400     0.400 peak  4526 spectrum    1 weight  0.10000E+01 volume  0.13867E-01 ppm1      5.157 ppm2      8.016 CV     1
 ASSI { 4527}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 54   and name HE% )
      3.500     1.500     1.500 peak  4527 spectrum    1 weight  0.10000E+01 volume  0.78332E-03 ppm1      5.155 ppm2      7.266 CV     1
 OR { 4527}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 4529}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
      2.400     0.700     0.700 peak  4529 spectrum    1 weight  0.10000E+01 volume  0.61295E-02 ppm1      5.164 ppm2      2.540 CV     1
 OR { 4529}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 4533}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 69   and name HG12))
      4.500     2.500     1.500 peak  4533 spectrum    1 weight  0.10000E+01 volume  0.86807E-03 ppm1      5.156 ppm2      0.134 CV     1
 ASSI { 4554}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 66   and name HB2 ))
      3.500     1.600     1.600 peak  4554 spectrum    1 weight  0.10000E+01 volume  0.23005E-02 ppm1      6.618 ppm2      3.010 CV     1
 ASSI { 4556}
   (  segid "    " and resid 99   and name HE% )
   (  segid "    " and resid 22   and name HB% )
      2.800     1.000     1.000 peak  4556 spectrum    1 weight  0.10000E+01 volume  0.41073E-02 ppm1      6.625 ppm2      1.493 CV     1
 ASSI { 4558}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 64   and name HD2 ))
      2.600     0.900     0.900 peak  4558 spectrum    1 weight  0.10000E+01 volume  0.33438E-02 ppm1      6.629 ppm2      0.731 CV     1
 ASSI { 4560}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 97   and name HN  ))
      3.000     1.100     1.100 peak  4560 spectrum    1 weight  0.10000E+01 volume  0.16467E-02 ppm1      6.607 ppm2      9.276 CV     1
 ASSI { 4561}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 99   and name HN  ))
      3.900     1.900     1.900 peak  4561 spectrum    1 weight  0.10000E+01 volume  0.18123E-02 ppm1      6.613 ppm2      8.987 CV     1
 ASSI { 4562}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 70   and name HN  ))
      2.400     0.700     0.700 peak  4562 spectrum    1 weight  0.10000E+01 volume  0.28107E-02 ppm1      6.611 ppm2      8.577 CV     1
 ASSI { 4566}
   (  segid "    " and resid 99   and name HE% )
   (  segid "    " and resid 99   and name HD% )
      1.900     0.400     0.400 peak  4566 spectrum    1 weight  0.10000E+01 volume  0.20208E-01 ppm1      6.614 ppm2      6.818 CV     1
 ASSI { 4568}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 97   and name HA1 ))
      2.600     0.900     0.900 peak  4568 spectrum    1 weight  0.10000E+01 volume  0.31440E-02 ppm1      6.609 ppm2      4.355 CV     1
 ASSI { 4569}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 24   and name HA  ))
      3.200     1.300     1.300 peak  4569 spectrum    1 weight  0.10000E+01 volume  0.22043E-02 ppm1      6.609 ppm2      4.180 CV     1
 ASSI { 4570}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 24   and name HD1 ))
      2.500     0.800     0.800 peak  4570 spectrum    1 weight  0.10000E+01 volume  0.28330E-02 ppm1      6.612 ppm2      4.007 CV     1
 ASSI { 4572}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 99   and name HB1 ))
      3.400     1.400     1.400 peak  4572 spectrum    1 weight  0.10000E+01 volume  0.26275E-02 ppm1      6.609 ppm2      2.538 CV     1
 OR { 4572}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 4573}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 24   and name HB2 ))
      3.500     1.500     1.500 peak  4573 spectrum    1 weight  0.10000E+01 volume  0.37834E-02 ppm1      6.610 ppm2      1.663 CV     1
 ASSI { 4576}
   (  segid "    " and resid 112  and name HE% )
   (  segid "    " and resid 112  and name HD% )
      2.200     0.600     0.600 peak  4576 spectrum    1 weight  0.10000E+01 volume  0.82085E-02 ppm1      6.339 ppm2      6.760 CV     1
 ASSI { 4578}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 109  and name HA  ))
      3.000     1.200     1.200 peak  4578 spectrum    1 weight  0.10000E+01 volume  0.19138E-02 ppm1      6.338 ppm2      4.260 CV     1
 ASSI { 4580}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 63   and name HB1 ))
      3.500     1.500     1.500 peak  4580 spectrum    1 weight  0.10000E+01 volume  0.18107E-02 ppm1      6.339 ppm2      2.916 CV     1
 ASSI { 4582}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 109  and name HG2 ))
      3.500     1.500     1.500 peak  4582 spectrum    1 weight  0.10000E+01 volume  0.31394E-02 ppm1      6.338 ppm2      2.171 CV     1
 ASSI { 4583}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 56   and name HB2 ))
      3.500     1.500     1.500 peak  4583 spectrum    1 weight  0.10000E+01 volume  0.56015E-03 ppm1      6.343 ppm2      1.528 CV     1
 ASSI { 4587}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 110  and name HN  ))
      3.500     1.600     1.600 peak  4587 spectrum    1 weight  0.10000E+01 volume  0.15082E-02 ppm1      6.335 ppm2      8.681 CV     1
 ASSI { 4589}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 64   and name HN  ))
      3.900     1.900     1.900 peak  4589 spectrum    1 weight  0.10000E+01 volume  0.57427E-03 ppm1      6.328 ppm2      8.260 CV     1
 ASSI { 4590}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 63   and name HN  ))
      3.800     1.800     1.800 peak  4590 spectrum    1 weight  0.10000E+01 volume  0.50075E-03 ppm1      6.335 ppm2      7.915 CV     1
 ASSI { 4591}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 57   and name HA  ))
      3.500     1.600     1.600 peak  4591 spectrum    1 weight  0.10000E+01 volume  0.42504E-03 ppm1      6.334 ppm2      5.390 CV     1
 ASSI { 4592}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 64   and name HA  ))
      3.000     1.100     1.100 peak  4592 spectrum    1 weight  0.10000E+01 volume  0.11356E-02 ppm1      6.336 ppm2      5.106 CV     1
 ASSI { 4593}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 112  and name HA  ))
      4.500     2.500     1.500 peak  4593 spectrum    1 weight  0.10000E+01 volume  0.45125E-03 ppm1      6.336 ppm2      4.925 CV     1
 ASSI { 4599}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      4.600     2.700     1.400 peak  4599 spectrum    1 weight  0.10000E+01 volume  0.44064E-03 ppm1      5.639 ppm2      9.479 CV     1
 ASSI { 4601}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      4.100     2.100     1.900 peak  4601 spectrum    1 weight  0.10000E+01 volume  0.11869E-02 ppm1      5.640 ppm2      8.500 CV     1
 ASSI { 4603}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 85   and name HD% )
      4.500     2.500     1.500 peak  4603 spectrum    1 weight  0.10000E+01 volume  0.88756E-03 ppm1      5.652 ppm2      5.999 CV     1
 ASSI { 4605}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 85   and name HB2 ))
      3.700     1.800     1.800 peak  4605 spectrum    1 weight  0.10000E+01 volume  0.10552E-02 ppm1      5.643 ppm2      2.357 CV     1
 ASSI { 4606}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 41   and name HB% )
      2.300     0.700     0.700 peak  4606 spectrum    1 weight  0.10000E+01 volume  0.53076E-02 ppm1      5.641 ppm2      1.471 CV     1
 ASSI { 4609}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 93   and name HA1 ))
      4.800     2.900     1.200 peak  4609 spectrum    1 weight  0.10000E+01 volume  0.59953E-03 ppm1      5.625 ppm2      4.396 CV     1
 ASSI { 4615}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      2.900     1.000     1.000 peak  4615 spectrum    1 weight  0.10000E+01 volume  0.18130E-02 ppm1      5.284 ppm2      8.787 CV     1
 ASSI { 4618}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 44   and name HB% )
      2.200     0.600     0.600 peak  4618 spectrum    1 weight  0.10000E+01 volume  0.65820E-02 ppm1      5.284 ppm2      1.527 CV     1
 ASSI { 4619}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
      4.600     2.600     1.400 peak  4619 spectrum    1 weight  0.10000E+01 volume  0.69923E-03 ppm1      5.284 ppm2      1.035 CV     1
 ASSI { 4620}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 116  and name HD2%)
      2.700     0.900     0.900 peak  4620 spectrum    1 weight  0.10000E+01 volume  0.50050E-02 ppm1      5.287 ppm2      0.484 CV     1
 OR { 4620}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 4621}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
      4.600     2.700     1.400 peak  4621 spectrum    1 weight  0.10000E+01 volume  0.81746E-03 ppm1      5.278 ppm2      2.793 CV     1
 ASSI { 4625}
   (( segid "    " and resid 23   and name HA  ))
   (  segid "    " and resid 99   and name HE% )
      4.900     2.900     1.100 peak  4625 spectrum    1 weight  0.10000E+01 volume  0.62046E-03 ppm1      4.551 ppm2      6.611 CV     1
 ASSI { 4626}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HG2 ))
      4.900     3.000     1.100 peak  4626 spectrum    1 weight  0.10000E+01 volume  0.84421E-03 ppm1      4.542 ppm2      2.155 CV     1
 OR { 4626}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HG1 ))
 ASSI { 4628}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HD1 ))
      2.400     0.700     0.700 peak  4628 spectrum    1 weight  0.10000E+01 volume  0.70158E-02 ppm1      4.545 ppm2      4.011 CV     1
 ASSI { 4632}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HN  ))
      2.000     0.500     0.500 peak  4632 spectrum    1 weight  0.10000E+01 volume  0.16364E-01 ppm1      4.383 ppm2      8.265 CV     1
 ASSI { 4634}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 122  and name HN  ))
      2.400     0.700     0.700 peak  4634 spectrum    1 weight  0.10000E+01 volume  0.51747E-02 ppm1      4.383 ppm2      7.681 CV     1
 ASSI { 4636}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 121  and name HA  ))
      3.800     1.800     1.800 peak  4636 spectrum    1 weight  0.10000E+01 volume  0.10502E-02 ppm1      4.378 ppm2      4.861 CV     1
 ASSI { 4637}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HA  ))
      4.700     2.800     1.300 peak  4637 spectrum    1 weight  0.10000E+01 volume  0.84921E-03 ppm1      4.385 ppm2      3.933 CV     1
 ASSI { 4638}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
      3.400     1.500     1.500 peak  4638 spectrum    1 weight  0.10000E+01 volume  0.20972E-02 ppm1      4.375 ppm2      1.766 CV     1
 OR { 4638}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HB2 ))
 ASSI { 4641}
   (( segid "    " and resid 122  and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      3.100     1.200     1.200 peak  4641 spectrum    1 weight  0.10000E+01 volume  0.17251E-02 ppm1      4.375 ppm2      6.614 CV     1
 ASSI { 4642}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 121  and name HD1 ))
      3.500     1.500     1.500 peak  4642 spectrum    1 weight  0.10000E+01 volume  0.73283E-03 ppm1      4.365 ppm2      6.353 CV     1
 ASSI { 4650}
   (( segid "    " and resid 131  and name HD1 ))
   (( segid "    " and resid 130  and name HN  ))
      4.600     2.600     1.400 peak  4650 spectrum    1 weight  0.10000E+01 volume  0.31500E-03 ppm1      3.861 ppm2      8.035 CV     1
 ASSI { 4660}
   (( segid "    " and resid 131  and name HD2 ))
   (( segid "    " and resid 130  and name HN  ))
      4.800     2.900     1.200 peak  4660 spectrum    1 weight  0.10000E+01 volume  0.47821E-03 ppm1      3.682 ppm2      8.009 CV     1
 ASSI { 4666}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 106  and name HD22))
      3.400     1.500     1.500 peak  4666 spectrum    1 weight  0.10000E+01 volume  0.12077E-02 ppm1      3.673 ppm2      6.914 CV     1
 ASSI { 4673}
   (( segid "    " and resid 109  and name HD2 ))
   (  segid "    " and resid 112  and name HE% )
      5.300     3.500     0.700 peak  4673 spectrum    1 weight  0.10000E+01 volume  0.56478E-03 ppm1      3.629 ppm2      6.321 CV     1
 ASSI { 4694}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 141  and name HN  ))
      2.400     0.700     0.700 peak  4694 spectrum    1 weight  0.10000E+01 volume  0.54075E-02 ppm1      5.507 ppm2      8.913 CV     1
 ASSI { 4695}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      2.000     0.500     0.500 peak  4695 spectrum    1 weight  0.10000E+01 volume  0.13067E-01 ppm1      5.510 ppm2      8.737 CV     1
 ASSI { 4696}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HN  ))
      2.800     1.000     1.000 peak  4696 spectrum    1 weight  0.10000E+01 volume  0.31324E-02 ppm1      5.509 ppm2      8.328 CV     1
 ASSI { 4697}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 14   and name HA  ))
      4.300     2.300     1.700 peak  4697 spectrum    1 weight  0.10000E+01 volume  0.79112E-03 ppm1      5.510 ppm2      4.833 CV     1
 ASSI { 4700}
   (( segid "    " and resid 13   and name HA  ))
   (  segid "    " and resid 13   and name HB% )
      2.200     0.600     0.600 peak  4700 spectrum    1 weight  0.10000E+01 volume  0.12665E-01 ppm1      5.507 ppm2      1.355 CV     1
 ASSI { 4702}
   (( segid "    " and resid 13   and name HA  ))
   (  segid "    " and resid 12   and name HG1%)
      3.600     1.600     1.600 peak  4702 spectrum    1 weight  0.10000E+01 volume  0.13313E-02 ppm1      5.510 ppm2      0.864 CV     1
 OR { 4702}
   (( segid "    " and resid 13   and name HA  ))
   (  segid "    " and resid 12   and name HG2%)
 ASSI { 4708}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 99   and name HB1 ))
      5.200     3.400     0.800 peak  4708 spectrum    1 weight  0.10000E+01 volume  0.26698E-03 ppm1      4.537 ppm2      2.537 CV     1
 OR { 4708}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 4709}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      2.800     1.000     1.000 peak  4709 spectrum    1 weight  0.10000E+01 volume  0.20535E-02 ppm1      4.496 ppm2      7.369 CV     1
 ASSI { 4710}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
      2.700     0.900     0.900 peak  4710 spectrum    1 weight  0.10000E+01 volume  0.25067E-02 ppm1      4.499 ppm2      1.876 CV     1
 ASSI { 4713}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      2.800     1.000     1.000 peak  4713 spectrum    1 weight  0.10000E+01 volume  0.30939E-02 ppm1      4.493 ppm2      8.579 CV     1
 ASSI { 4718}
   (( segid "    " and resid 24   and name HD1 ))
   (( segid "    " and resid 23   and name HN  ))
      3.100     1.200     1.200 peak  4718 spectrum    1 weight  0.10000E+01 volume  0.25582E-02 ppm1      4.027 ppm2      8.176 CV     1
 ASSI { 4723}
   (( segid "    " and resid 24   and name HD2 ))
   (  segid "    " and resid 99   and name HD% )
      4.900     3.000     1.100 peak  4723 spectrum    1 weight  0.10000E+01 volume  0.47623E-03 ppm1      3.813 ppm2      6.774 CV     1
 ASSI { 4724}
   (( segid "    " and resid 24   and name HD2 ))
   (( segid "    " and resid 24   and name HD1 ))
      1.500     0.300     0.700 peak  4724 spectrum    1 weight  0.10000E+01 volume  0.25959E-01 ppm1      3.816 ppm2      4.014 CV     1
 ASSI { 4727}
   (( segid "    " and resid 24   and name HD2 ))
   (( segid "    " and resid 24   and name HA  ))
      3.400     1.500     1.500 peak  4727 spectrum    1 weight  0.10000E+01 volume  0.18073E-02 ppm1      3.783 ppm2      4.218 CV     1
 ASSI { 4731}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 16   and name HE  ))
      4.300     2.400     1.700 peak  4731 spectrum    1 weight  0.10000E+01 volume  0.62959E-03 ppm1      3.684 ppm2      7.280 CV     1
 ASSI { 4732}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 16   and name HD1 ))
      4.200     2.200     1.800 peak  4732 spectrum    1 weight  0.10000E+01 volume  0.17020E-02 ppm1      3.684 ppm2      3.283 CV     1
 ASSI { 4733}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 16   and name HD2 ))
      4.200     2.200     1.800 peak  4733 spectrum    1 weight  0.10000E+01 volume  0.11783E-02 ppm1      3.684 ppm2      3.115 CV     1
 ASSI { 4737}
   (( segid "    " and resid 24   and name HD1 ))
   (( segid "    " and resid 24   and name HG1 ))
      2.600     0.800     0.800 peak  4737 spectrum    1 weight  0.10000E+01 volume  0.36461E-02 ppm1      4.050 ppm2      2.172 CV     1
 OR { 4737}
   (( segid "    " and resid 24   and name HD1 ))
   (( segid "    " and resid 24   and name HG2 ))
 ASSI { 4739}
   (( segid "    " and resid 24   and name HD1 ))
   (  segid "    " and resid 99   and name HD% )
      3.400     1.500     1.500 peak  4739 spectrum    1 weight  0.10000E+01 volume  0.56114E-03 ppm1      4.037 ppm2      6.823 CV     1
 ASSI { 4747}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 84   and name HE% )
      3.500     1.500     1.500 peak  4747 spectrum    1 weight  0.10000E+01 volume  0.11154E-02 ppm1      3.896 ppm2      6.226 CV     1
 ASSI { 4748}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 70   and name HA  ))
      2.200     0.600     0.600 peak  4748 spectrum    1 weight  0.10000E+01 volume  0.79723E-02 ppm1      3.896 ppm2      4.862 CV     1
 ASSI { 4749}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HD2 ))
      1.700     0.400     0.500 peak  4749 spectrum    1 weight  0.10000E+01 volume  0.10661E-01 ppm1      3.901 ppm2      3.084 CV     1
 ASSI { 4752}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HG2 ))
      2.500     0.800     0.800 peak  4752 spectrum    1 weight  0.10000E+01 volume  0.47230E-02 ppm1      3.892 ppm2      1.826 CV     1
 OR { 4752}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI { 4753}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 77   and name HB2 ))
      2.900     1.100     1.100 peak  4753 spectrum    1 weight  0.10000E+01 volume  0.27763E-02 ppm1      3.889 ppm2      1.665 CV     1
 ASSI { 4754}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 96   and name HD1%)
      4.500     2.500     1.500 peak  4754 spectrum    1 weight  0.10000E+01 volume  0.44733E-03 ppm1      3.900 ppm2      0.118 CV     1
 ASSI { 4756}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 84   and name HZ  ))
      3.800     1.800     1.800 peak  4756 spectrum    1 weight  0.10000E+01 volume  0.17020E-02 ppm1      3.896 ppm2      6.388 CV     1
 ASSI { 4757}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HB1 ))
      2.900     1.000     1.000 peak  4757 spectrum    1 weight  0.10000E+01 volume  0.25781E-02 ppm1      3.897 ppm2      1.460 CV     1
 ASSI { 4759}
   (( segid "    " and resid 24   and name HD2 ))
   (( segid "    " and resid 23   and name HA  ))
      1.900     0.400     0.400 peak  4759 spectrum    1 weight  0.10000E+01 volume  0.16994E-01 ppm1      3.809 ppm2      4.632 CV     1
 ASSI { 4762}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 71   and name HB1 ))
      3.600     1.600     1.600 peak  4762 spectrum    1 weight  0.10000E+01 volume  0.19062E-02 ppm1      3.094 ppm2      1.468 CV     1
 ASSI { 4765}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 70   and name HN  ))
      4.500     2.500     1.500 peak  4765 spectrum    1 weight  0.10000E+01 volume  0.46491E-03 ppm1      3.078 ppm2      8.571 CV     1
 ASSI { 4768}
   (( segid "    " and resid 71   and name HD2 ))
   (  segid "    " and resid 84   and name HE% )
      2.600     0.900     0.900 peak  4768 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      3.081 ppm2      6.211 CV     1
 ASSI { 4769}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 70   and name HA  ))
      2.100     0.600     0.600 peak  4769 spectrum    1 weight  0.10000E+01 volume  0.72099E-02 ppm1      3.079 ppm2      4.867 CV     1
 ASSI { 4772}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 77   and name HB1 ))
      3.300     1.400     1.400 peak  4772 spectrum    1 weight  0.10000E+01 volume  0.24074E-02 ppm1      3.087 ppm2      2.051 CV     1
 ASSI { 4774}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 77   and name HB2 ))
      2.800     1.000     1.000 peak  4774 spectrum    1 weight  0.10000E+01 volume  0.15331E-02 ppm1      3.087 ppm2      1.645 CV     1
 ASSI { 4775}
   (( segid "    " and resid 71   and name HD2 ))
   (  segid "    " and resid 96   and name HG2%)
      4.500     2.500     1.500 peak  4775 spectrum    1 weight  0.10000E+01 volume  0.49067E-03 ppm1      3.079 ppm2      0.294 CV     1
 ASSI { 4779}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 121  and name HE1 ))
      3.200     1.200     1.200 peak  4779 spectrum    1 weight  0.10000E+01 volume  0.13724E-02 ppm1      5.688 ppm2      9.510 CV     1
 ASSI { 4784}
   (  segid "    " and resid 85   and name HE% )
   (  segid "    " and resid 85   and name HD% )
      2.100     0.600     0.600 peak  4784 spectrum    1 weight  0.10000E+01 volume  0.10589E-01 ppm1      5.687 ppm2      6.017 CV     1
 ASSI { 4790}
   (  segid "    " and resid 85   and name HE% )
   (  segid "    " and resid 41   and name HB% )
      4.800     2.800     1.200 peak  4790 spectrum    1 weight  0.10000E+01 volume  0.51160E-03 ppm1      5.685 ppm2      1.468 CV     1
 ASSI { 4793}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 121  and name HZ2 ))
      3.800     1.800     1.800 peak  4793 spectrum    1 weight  0.10000E+01 volume  0.86811E-03 ppm1      5.680 ppm2      7.191 CV     1
 ASSI { 4794}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 121  and name HE3 ))
      3.800     1.800     1.800 peak  4794 spectrum    1 weight  0.10000E+01 volume  0.68148E-03 ppm1      5.678 ppm2      6.905 CV     1
 OR { 4794}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 121  and name HH2 ))
 ASSI { 4796}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 26   and name HN  ))
      3.100     1.200     1.200 peak  4796 spectrum    1 weight  0.10000E+01 volume  0.69300E-03 ppm1      3.562 ppm2      6.851 CV     1
 ASSI { 4798}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 27   and name HA  ))
      3.800     1.800     1.800 peak  4798 spectrum    1 weight  0.10000E+01 volume  0.59214E-03 ppm1      3.569 ppm2      5.104 CV     1
 ASSI { 4799}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 26   and name HA2 ))
      2.800     0.900     0.900 peak  4799 spectrum    1 weight  0.10000E+01 volume  0.46830E-02 ppm1      3.569 ppm2      3.738 CV     1
 ASSI { 4800}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 27   and name HG1 ))
      2.400     0.700     0.700 peak  4800 spectrum    1 weight  0.10000E+01 volume  0.41781E-02 ppm1      3.569 ppm2      2.165 CV     1
 ASSI { 4801}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 27   and name HG2 ))
      2.900     1.100     1.100 peak  4801 spectrum    1 weight  0.10000E+01 volume  0.44675E-02 ppm1      3.568 ppm2      1.993 CV     1
 OR { 4801}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 27   and name HB1 ))
 ASSI { 4808}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 26   and name HN  ))
      4.200     2.200     1.800 peak  4808 spectrum    1 weight  0.10000E+01 volume  0.64837E-03 ppm1      3.465 ppm2      6.855 CV     1
 ASSI { 4809}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 27   and name HG1 ))
      3.100     1.200     1.200 peak  4809 spectrum    1 weight  0.10000E+01 volume  0.30296E-02 ppm1      3.465 ppm2      2.169 CV     1
 ASSI { 4810}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 27   and name HG2 ))
      2.600     0.800     0.800 peak  4810 spectrum    1 weight  0.10000E+01 volume  0.38985E-02 ppm1      3.451 ppm2      1.997 CV     1
 OR { 4810}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 27   and name HB1 ))
 ASSI { 4812}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 27   and name HA  ))
      4.200     2.200     1.800 peak  4812 spectrum    1 weight  0.10000E+01 volume  0.53328E-03 ppm1      3.466 ppm2      5.095 CV     1
 ASSI { 4813}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 26   and name HA1 ))
      3.400     1.400     1.400 peak  4813 spectrum    1 weight  0.10000E+01 volume  0.48948E-02 ppm1      3.459 ppm2      4.216 CV     1
 ASSI { 4822}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 71   and name HB1 ))
      2.700     0.900     0.900 peak  4822 spectrum    1 weight  0.10000E+01 volume  0.14826E-02 ppm1      7.640 ppm2      1.463 CV     1
 ASSI { 4824}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 92   and name HE1 ))
      2.800     1.000     1.000 peak  4824 spectrum    1 weight  0.10000E+01 volume  0.22766E-02 ppm1      7.639 ppm2     11.185 CV     1
 ASSI { 4826}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 72   and name HN  ))
      4.600     2.700     1.400 peak  4826 spectrum    1 weight  0.10000E+01 volume  0.51553E-03 ppm1      7.631 ppm2      8.734 CV     1
 ASSI { 4827}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 95   and name HN  ))
      4.300     2.300     1.700 peak  4827 spectrum    1 weight  0.10000E+01 volume  0.65890E-03 ppm1      7.638 ppm2      8.424 CV     1
 ASSI { 4829}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 92   and name HH2 ))
      2.400     0.700     0.700 peak  4829 spectrum    1 weight  0.10000E+01 volume  0.46421E-02 ppm1      7.639 ppm2      6.776 CV     1
 ASSI { 4831}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 94   and name HA1 ))
      4.100     2.100     1.900 peak  4831 spectrum    1 weight  0.10000E+01 volume  0.60808E-03 ppm1      7.637 ppm2      3.651 CV     1
 ASSI { 4832}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 74   and name HB2 ))
      3.900     1.900     1.900 peak  4832 spectrum    1 weight  0.10000E+01 volume  0.34466E-03 ppm1      7.634 ppm2      2.912 CV     1
 ASSI { 4833}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 71   and name HB2 ))
      3.400     1.500     1.500 peak  4833 spectrum    1 weight  0.10000E+01 volume  0.13310E-02 ppm1      7.631 ppm2      2.391 CV     1
 ASSI { 4836}
   (( segid "    " and resid 92   and name HZ2 ))
   (  segid "    " and resid 96   and name HG2%)
      5.100     3.200     0.900 peak  4836 spectrum    1 weight  0.10000E+01 volume  0.31362E-03 ppm1      7.638 ppm2      0.286 CV     1
 ASSI { 4838}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 121  and name HH2 ))
      2.800     1.000     1.000 peak  4838 spectrum    1 weight  0.10000E+01 volume  0.12616E-02 ppm1      7.236 ppm2      6.901 CV     1
 ASSI { 4841}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 123  and name HA  ))
      4.200     2.200     1.800 peak  4841 spectrum    1 weight  0.10000E+01 volume  0.76272E-03 ppm1      7.234 ppm2      3.904 CV     1
 ASSI { 4842}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 128  and name HA1 ))
      4.300     2.300     1.700 peak  4842 spectrum    1 weight  0.10000E+01 volume  0.30651E-03 ppm1      7.238 ppm2      3.273 CV     1
 ASSI { 4847}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 124  and name HB2 ))
      4.800     2.900     1.200 peak  4847 spectrum    1 weight  0.10000E+01 volume  0.59363E-03 ppm1      7.223 ppm2      2.325 CV     1
 ASSI { 4848}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 127  and name HB2 ))
      4.900     3.000     1.100 peak  4848 spectrum    1 weight  0.10000E+01 volume  0.53831E-03 ppm1      7.217 ppm2      1.926 CV     1
 OR { 4848}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 127  and name HB1 ))
 ASSI { 4857}
   (( segid "    " and resid 119  and name HA1 ))
   (  segid "    " and resid 120  and name HD% )
      4.500     2.500     1.500 peak  4857 spectrum    1 weight  0.10000E+01 volume  0.65361E-03 ppm1      4.278 ppm2      6.667 CV     1
 ASSI { 4865}
   (( segid "    " and resid 119  and name HA1 ))
   (  segid "    " and resid 5    and name HG2%)
      4.600     2.600     1.400 peak  4865 spectrum    1 weight  0.10000E+01 volume  0.41823E-03 ppm1      4.262 ppm2      1.120 CV     1
 ASSI { 4866}
   (( segid "    " and resid 119  and name HA1 ))
   (  segid "    " and resid 117  and name HG2%)
      3.700     1.700     1.700 peak  4866 spectrum    1 weight  0.10000E+01 volume  0.82328E-03 ppm1      4.254 ppm2      1.402 CV     1
 ASSI { 4869}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 132  and name HN  ))
      2.300     0.700     0.700 peak  4869 spectrum    1 weight  0.10000E+01 volume  0.18740E-02 ppm1      4.029 ppm2      9.000 CV     1
 ASSI { 4871}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 120  and name HN  ))
      3.000     1.100     1.100 peak  4871 spectrum    1 weight  0.10000E+01 volume  0.18910E-02 ppm1      4.041 ppm2      7.657 CV     1
 ASSI { 4872}
   (( segid "    " and resid 119  and name HA2 ))
   (  segid "    " and resid 5    and name HG2%)
      3.900     1.900     1.900 peak  4872 spectrum    1 weight  0.10000E+01 volume  0.36822E-03 ppm1      4.037 ppm2      1.101 CV     1
 ASSI { 4876}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 119  and name HA1 ))
      2.200     0.600     0.600 peak  4876 spectrum    1 weight  0.10000E+01 volume  0.29517E-02 ppm1      4.039 ppm2      4.257 CV     1
 ASSI { 4881}
   (( segid "    " and resid 116  and name HB1 ))
   (  segid "    " and resid 138  and name HG2%)
      4.200     2.200     1.800 peak  4881 spectrum    1 weight  0.10000E+01 volume  0.35734E-03 ppm1      1.741 ppm2      0.710 CV     1
 ASSI { 4882}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 136  and name HN  ))
      4.100     2.100     1.900 peak  4882 spectrum    1 weight  0.10000E+01 volume  0.47668E-03 ppm1      1.737 ppm2      9.383 CV     1
 ASSI { 4883}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 117  and name HN  ))
      3.700     1.700     1.700 peak  4883 spectrum    1 weight  0.10000E+01 volume  0.81333E-03 ppm1      1.735 ppm2      9.046 CV     1
 ASSI { 4885}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 44   and name HA  ))
      3.900     1.900     1.900 peak  4885 spectrum    1 weight  0.10000E+01 volume  0.93326E-03 ppm1      1.731 ppm2      5.318 CV     1
 ASSI { 4886}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 116  and name HB2 ))
      1.800     0.400     0.400 peak  4886 spectrum    1 weight  0.10000E+01 volume  0.10163E-01 ppm1      1.736 ppm2      0.993 CV     1
 ASSI { 4887}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 116  and name HG  ))
      2.500     0.800     0.800 peak  4887 spectrum    1 weight  0.10000E+01 volume  0.66563E-02 ppm1      1.729 ppm2      0.525 CV     1
 OR { 4887}
   (( segid "    " and resid 116  and name HB1 ))
   (  segid "    " and resid 116  and name HD2%)
 ASSI { 4891}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 114  and name HN  ))
      3.200     1.300     1.300 peak  4891 spectrum    1 weight  0.10000E+01 volume  0.21194E-02 ppm1      1.509 ppm2      8.850 CV     1
 OR { 4891}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 114  and name HN  ))
 ASSI { 4895}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 114  and name HA  ))
      2.700     0.900     0.900 peak  4895 spectrum    1 weight  0.10000E+01 volume  0.24937E-02 ppm1      1.510 ppm2      4.697 CV     1
 OR { 4895}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 4901}
   (( segid "    " and resid 114  and name HB2 ))
   (  segid "    " and resid 114  and name HD1%)
      2.400     0.700     0.700 peak  4901 spectrum    1 weight  0.10000E+01 volume  0.65167E-02 ppm1      1.515 ppm2      0.539 CV     1
 OR { 4901}
   (( segid "    " and resid 114  and name HB1 ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 4902}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 138  and name HN  ))
      3.900     1.900     1.900 peak  4902 spectrum    1 weight  0.10000E+01 volume  0.62521E-03 ppm1      1.506 ppm2      9.510 CV     1
 OR { 4902}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 138  and name HN  ))
 ASSI { 4911}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HN  ))
      3.000     1.200     1.200 peak  4911 spectrum    1 weight  0.10000E+01 volume  0.11170E-02 ppm1      1.030 ppm2      8.667 CV     1
 ASSI { 4914}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 118  and name HA1 ))
      3.900     1.900     1.900 peak  4914 spectrum    1 weight  0.10000E+01 volume  0.53006E-03 ppm1      1.031 ppm2      4.673 CV     1
 ASSI { 4917}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HG  ))
      2.500     0.800     0.800 peak  4917 spectrum    1 weight  0.10000E+01 volume  0.66790E-02 ppm1      1.025 ppm2      0.525 CV     1
 OR { 4917}
   (( segid "    " and resid 116  and name HB2 ))
   (  segid "    " and resid 116  and name HD2%)
 ASSI { 4919}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 117  and name HN  ))
      4.300     2.300     1.700 peak  4919 spectrum    1 weight  0.10000E+01 volume  0.92351E-03 ppm1      1.020 ppm2      9.018 CV     1
 ASSI { 4926}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 84   and name HN  ))
      4.900     3.000     1.100 peak  4926 spectrum    1 weight  0.10000E+01 volume  0.51689E-03 ppm1      1.802 ppm2      9.477 CV     1
 ASSI { 4927}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 42   and name HA  ))
      2.600     0.800     0.800 peak  4927 spectrum    1 weight  0.10000E+01 volume  0.23013E-02 ppm1      1.805 ppm2      5.312 CV     1
 ASSI { 4933}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 84   and name HB1 ))
      4.300     2.300     1.700 peak  4933 spectrum    1 weight  0.10000E+01 volume  0.11829E-02 ppm1      1.797 ppm2      3.032 CV     1
 ASSI { 4934}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 84   and name HB2 ))
      4.600     2.700     1.400 peak  4934 spectrum    1 weight  0.10000E+01 volume  0.68284E-03 ppm1      1.784 ppm2      2.675 CV     1
 ASSI { 4935}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 42   and name HB2 ))
      1.800     0.400     0.400 peak  4935 spectrum    1 weight  0.10000E+01 volume  0.90510E-02 ppm1      1.788 ppm2      1.273 CV     1
 ASSI { 4936}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 42   and name HD2%)
      2.500     0.800     0.800 peak  4936 spectrum    1 weight  0.10000E+01 volume  0.43445E-02 ppm1      1.797 ppm2      0.862 CV     1
 ASSI { 4938}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 69   and name HD1%)
      3.700     1.700     1.700 peak  4938 spectrum    1 weight  0.10000E+01 volume  0.48295E-03 ppm1      1.776 ppm2     -0.611 CV     1
 ASSI { 4940}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 84   and name HN  ))
      3.500     1.500     1.500 peak  4940 spectrum    1 weight  0.10000E+01 volume  0.60874E-03 ppm1      1.273 ppm2      9.469 CV     1
 ASSI { 4941}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HN  ))
      2.900     1.100     1.100 peak  4941 spectrum    1 weight  0.10000E+01 volume  0.13438E-02 ppm1      1.285 ppm2      9.122 CV     1
 ASSI { 4942}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 43   and name HN  ))
      3.900     1.900     1.900 peak  4942 spectrum    1 weight  0.10000E+01 volume  0.13140E-02 ppm1      1.283 ppm2      8.830 CV     1
 ASSI { 4943}
   (( segid "    " and resid 42   and name HB2 ))
   (  segid "    " and resid 84   and name HD% )
      4.400     2.400     1.600 peak  4943 spectrum    1 weight  0.10000E+01 volume  0.63132E-03 ppm1      1.273 ppm2      6.952 CV     1
 ASSI { 4946}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
      4.300     2.300     1.700 peak  4946 spectrum    1 weight  0.10000E+01 volume  0.61807E-03 ppm1      1.277 ppm2      4.675 CV     1
 ASSI { 4947}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 84   and name HB1 ))
      3.400     1.400     1.400 peak  4947 spectrum    1 weight  0.10000E+01 volume  0.86316E-03 ppm1      1.282 ppm2      3.024 CV     1
 ASSI { 4948}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 84   and name HB2 ))
      3.100     1.200     1.200 peak  4948 spectrum    1 weight  0.10000E+01 volume  0.64610E-03 ppm1      1.277 ppm2      2.671 CV     1
 ASSI { 4949}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HB1 ))
      1.800     0.400     0.400 peak  4949 spectrum    1 weight  0.10000E+01 volume  0.98098E-02 ppm1      1.273 ppm2      1.800 CV     1
 OR { 4949}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HG  ))
 ASSI { 4950}
   (( segid "    " and resid 42   and name HB2 ))
   (  segid "    " and resid 42   and name HD1%)
      2.600     0.800     0.800 peak  4950 spectrum    1 weight  0.10000E+01 volume  0.47358E-02 ppm1      1.274 ppm2      0.922 CV     1
 OR { 4950}
   (( segid "    " and resid 42   and name HB2 ))
   (  segid "    " and resid 42   and name HD2%)
 ASSI { 4951}
   (( segid "    " and resid 42   and name HB2 ))
   (  segid "    " and resid 116  and name HD2%)
      3.300     1.400     1.400 peak  4951 spectrum    1 weight  0.10000E+01 volume  0.32101E-02 ppm1      1.272 ppm2      0.514 CV     1
 OR { 4951}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 4952}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 43   and name HE1 ))
      4.400     2.400     1.600 peak  4952 spectrum    1 weight  0.10000E+01 volume  0.33779E-03 ppm1      1.262 ppm2      2.865 CV     1
 OR { 4952}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 43   and name HE2 ))
 ASSI { 4953}
   (( segid "    " and resid 42   and name HB2 ))
   (  segid "    " and resid 69   and name HD1%)
      3.400     1.500     1.500 peak  4953 spectrum    1 weight  0.10000E+01 volume  0.63363E-03 ppm1      1.266 ppm2     -0.602 CV     1
 ASSI { 4958}
   (( segid "    " and resid 133  and name HA1 ))
   (  segid "    " and resid 134  and name HG2%)
      4.200     2.200     1.800 peak  4958 spectrum    1 weight  0.10000E+01 volume  0.71376E-03 ppm1      5.208 ppm2      1.250 CV     1
 ASSI { 4959}
   (( segid "    " and resid 133  and name HA1 ))
   (  segid "    " and resid 5    and name HG2%)
      4.600     2.700     1.400 peak  4959 spectrum    1 weight  0.10000E+01 volume  0.41385E-03 ppm1      5.214 ppm2      1.057 CV     1
 ASSI { 4961}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 5    and name HN  ))
      2.700     0.900     0.900 peak  4961 spectrum    1 weight  0.10000E+01 volume  0.18472E-02 ppm1      5.216 ppm2      9.269 CV     1
 ASSI { 4965}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 6    and name HA  ))
      3.900     1.900     1.900 peak  4965 spectrum    1 weight  0.10000E+01 volume  0.51619E-03 ppm1      5.205 ppm2      4.933 CV     1
 ASSI { 4967}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 4    and name HB1 ))
      4.000     2.000     2.000 peak  4967 spectrum    1 weight  0.10000E+01 volume  0.93445E-03 ppm1      5.205 ppm2      1.975 CV     1
 OR { 4967}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 4970}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 130  and name HN  ))
      3.200     1.300     1.300 peak  4970 spectrum    1 weight  0.10000E+01 volume  0.13561E-02 ppm1      4.284 ppm2      8.031 CV     1
 ASSI { 4972}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 34   and name HA2 ))
      1.900     0.400     0.400 peak  4972 spectrum    1 weight  0.10000E+01 volume  0.12753E-01 ppm1      4.278 ppm2      3.770 CV     1
 ASSI { 4974}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 3    and name HA  ))
      3.400     1.400     1.400 peak  4974 spectrum    1 weight  0.10000E+01 volume  0.14756E-02 ppm1      4.272 ppm2      4.973 CV     1
 ASSI { 4981}
   (( segid "    " and resid 52   and name HA1 ))
   (( segid "    " and resid 52   and name HA2 ))
      1.800     0.400     0.400 peak  4981 spectrum    1 weight  0.10000E+01 volume  0.14889E-01 ppm1      4.060 ppm2      3.735 CV     1
 ASSI { 4987}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 5    and name HN  ))
      3.200     1.300     1.300 peak  4987 spectrum    1 weight  0.10000E+01 volume  0.28950E-02 ppm1      3.785 ppm2      9.301 CV     1
 ASSI { 4989}
   (( segid "    " and resid 34   and name HA2 ))
   (( segid "    " and resid 34   and name HN  ))
      2.500     0.800     0.800 peak  4989 spectrum    1 weight  0.10000E+01 volume  0.50393E-02 ppm1      3.779 ppm2      8.790 CV     1
 ASSI { 4993}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 133  and name HA1 ))
      1.800     0.400     0.400 peak  4993 spectrum    1 weight  0.10000E+01 volume  0.10376E-01 ppm1      3.782 ppm2      5.200 CV     1
 ASSI { 5006}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 26   and name HN  ))
      2.400     0.700     0.700 peak  5006 spectrum    1 weight  0.10000E+01 volume  0.44985E-02 ppm1      4.219 ppm2      6.867 CV     1
 ASSI { 5008}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 26   and name HA2 ))
      1.900     0.400     0.400 peak  5008 spectrum    1 weight  0.10000E+01 volume  0.11885E-01 ppm1      4.225 ppm2      3.730 CV     1
 ASSI { 5009}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 27   and name HD1 ))
      3.200     1.200     1.200 peak  5009 spectrum    1 weight  0.10000E+01 volume  0.56886E-02 ppm1      4.222 ppm2      3.512 CV     1
 OR { 5009}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 27   and name HD2 ))
 ASSI { 5015}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 118  and name HN  ))
      3.100     1.200     1.200 peak  5015 spectrum    1 weight  0.10000E+01 volume  0.26371E-02 ppm1      4.178 ppm2      9.061 CV     1
 ASSI { 5016}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 117  and name HA  ))
      4.100     2.100     1.900 peak  5016 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      4.177 ppm2      4.909 CV     1
 ASSI { 5023}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 27   and name HD2 ))
      2.300     0.600     0.600 peak  5023 spectrum    1 weight  0.10000E+01 volume  0.66195E-02 ppm1      3.741 ppm2      3.488 CV     1
 ASSI { 5031}
   (( segid "    " and resid 94   and name HA1 ))
   (( segid "    " and resid 92   and name HH2 ))
      4.200     2.200     1.800 peak  5031 spectrum    1 weight  0.10000E+01 volume  0.51470E-03 ppm1      3.647 ppm2      6.816 CV     1
 ASSI { 5033}
   (( segid "    " and resid 94   and name HA1 ))
   (( segid "    " and resid 94   and name HA2 ))
      1.800     0.400     0.400 peak  5033 spectrum    1 weight  0.10000E+01 volume  0.13298E-01 ppm1      3.644 ppm2      3.227 CV     1
 ASSI { 5036}
   (( segid "    " and resid 94   and name HA1 ))
   (( segid "    " and resid 95   and name HA  ))
      4.100     2.100     1.900 peak  5036 spectrum    1 weight  0.10000E+01 volume  0.68994E-03 ppm1      3.632 ppm2      5.204 CV     1
 ASSI { 5044}
   (( segid "    " and resid 128  and name HA1 ))
   (( segid "    " and resid 128  and name HA2 ))
      1.800     0.400     0.400 peak  5044 spectrum    1 weight  0.10000E+01 volume  0.11086E-01 ppm1      3.335 ppm2      2.322 CV     1
 ASSI { 5049}
   (( segid "    " and resid 94   and name HA2 ))
   (( segid "    " and resid 92   and name HE3 ))
      5.000     3.100     1.000 peak  5049 spectrum    1 weight  0.10000E+01 volume  0.43932E-03 ppm1      3.225 ppm2      7.320 CV     1
 ASSI { 5065}
   (( segid "    " and resid 140  and name HB1 ))
   (  segid "    " and resid 112  and name HD% )
      4.700     2.800     1.300 peak  5065 spectrum    1 weight  0.10000E+01 volume  0.35849E-03 ppm1      1.711 ppm2      6.805 CV     1
 ASSI { 5066}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 113  and name HA  ))
      4.700     2.700     1.300 peak  5066 spectrum    1 weight  0.10000E+01 volume  0.30188E-03 ppm1      1.720 ppm2      5.803 CV     1
 ASSI { 5067}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 112  and name HN  ))
      4.200     2.200     1.800 peak  5067 spectrum    1 weight  0.10000E+01 volume  0.49109E-03 ppm1      1.702 ppm2      9.490 CV     1
 ASSI { 5072}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 112  and name HB1 ))
      3.000     1.100     1.100 peak  5072 spectrum    1 weight  0.10000E+01 volume  0.15038E-02 ppm1      1.707 ppm2      2.695 CV     1
 ASSI { 5076}
   (( segid "    " and resid 140  and name HB1 ))
   (  segid "    " and resid 140  and name HD2%)
      2.600     0.800     0.800 peak  5076 spectrum    1 weight  0.10000E+01 volume  0.50892E-02 ppm1      1.706 ppm2      0.645 CV     1
 OR { 5076}
   (( segid "    " and resid 140  and name HB1 ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 5077}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 140  and name HG  ))
      2.300     0.700     0.700 peak  5077 spectrum    1 weight  0.10000E+01 volume  0.39531E-02 ppm1      1.707 ppm2      0.353 CV     1
 ASSI { 5078}
   (( segid "    " and resid 140  and name HB2 ))
   (  segid "    " and resid 112  and name HD% )
      5.600     4.000     0.400 peak  5078 spectrum    1 weight  0.10000E+01 volume  0.30003E-03 ppm1      0.806 ppm2      6.785 CV     1
 ASSI { 5079}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 112  and name HN  ))
      5.200     3.300     0.800 peak  5079 spectrum    1 weight  0.10000E+01 volume  0.41137E-03 ppm1      0.785 ppm2      9.439 CV     1
 ASSI { 5080}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 140  and name HN  ))
      3.400     1.500     1.500 peak  5080 spectrum    1 weight  0.10000E+01 volume  0.19788E-02 ppm1      0.782 ppm2      9.255 CV     1
 ASSI { 5081}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 140  and name HA  ))
      2.600     0.800     0.800 peak  5081 spectrum    1 weight  0.10000E+01 volume  0.21037E-02 ppm1      0.781 ppm2      5.387 CV     1
 ASSI { 5082}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 139  and name HA  ))
      4.700     2.700     1.300 peak  5082 spectrum    1 weight  0.10000E+01 volume  0.67946E-03 ppm1      0.786 ppm2      4.922 CV     1
 ASSI { 5083}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 112  and name HB1 ))
      4.600     2.700     1.400 peak  5083 spectrum    1 weight  0.10000E+01 volume  0.10216E-02 ppm1      0.782 ppm2      2.697 CV     1
 ASSI { 5084}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 140  and name HB1 ))
      1.800     0.400     0.400 peak  5084 spectrum    1 weight  0.10000E+01 volume  0.61287E-02 ppm1      0.781 ppm2      1.699 CV     1
 ASSI { 5087}
   (( segid "    " and resid 140  and name HB2 ))
   (  segid "    " and resid 140  and name HD1%)
      2.400     0.700     0.700 peak  5087 spectrum    1 weight  0.10000E+01 volume  0.58579E-02 ppm1      0.783 ppm2      0.644 CV     1
 OR { 5087}
   (( segid "    " and resid 140  and name HB2 ))
   (  segid "    " and resid 140  and name HD2%)
 ASSI { 5088}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 140  and name HG  ))
      2.800     0.900     0.900 peak  5088 spectrum    1 weight  0.10000E+01 volume  0.41253E-02 ppm1      0.784 ppm2      0.351 CV     1
 ASSI { 5089}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 141  and name HN  ))
      4.500     2.500     1.500 peak  5089 spectrum    1 weight  0.10000E+01 volume  0.79909E-03 ppm1      0.772 ppm2      8.844 CV     1
 ASSI { 5091}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 98   and name HN  ))
      2.400     0.700     0.700 peak  5091 spectrum    1 weight  0.10000E+01 volume  0.46293E-02 ppm1      4.333 ppm2      7.672 CV     1
 ASSI { 5096}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 97   and name HA2 ))
      1.800     0.400     0.400 peak  5096 spectrum    1 weight  0.10000E+01 volume  0.76520E-02 ppm1      4.328 ppm2      3.336 CV     1
 ASSI { 5098}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 98   and name HG12))
      4.300     2.300     1.700 peak  5098 spectrum    1 weight  0.10000E+01 volume  0.79013E-03 ppm1      4.321 ppm2      0.579 CV     1
 OR { 5098}
   (( segid "    " and resid 97   and name HA1 ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 5100}
   (( segid "    " and resid 110  and name HA1 ))
   (( segid "    " and resid 110  and name HN  ))
      2.800     0.900     0.900 peak  5100 spectrum    1 weight  0.10000E+01 volume  0.29147E-02 ppm1      4.284 ppm2      8.689 CV     1
 ASSI { 5102}
   (( segid "    " and resid 110  and name HA1 ))
   (( segid "    " and resid 111  and name HA  ))
      4.500     2.600     1.500 peak  5102 spectrum    1 weight  0.10000E+01 volume  0.40989E-03 ppm1      4.282 ppm2      5.564 CV     1
 ASSI { 5103}
   (( segid "    " and resid 110  and name HA1 ))
   (( segid "    " and resid 110  and name HA2 ))
      1.800     0.400     0.400 peak  5103 spectrum    1 weight  0.10000E+01 volume  0.17372E-01 ppm1      4.280 ppm2      3.862 CV     1
 ASSI { 5105}
   (( segid "    " and resid 110  and name HA1 ))
   (  segid "    " and resid 112  and name HE% )
      4.400     2.400     1.600 peak  5105 spectrum    1 weight  0.10000E+01 volume  0.90271E-03 ppm1      4.266 ppm2      6.316 CV     1
 ASSI { 5108}
   (( segid "    " and resid 8    and name HA1 ))
   (( segid "    " and resid 7    and name HA  ))
      5.200     3.400     0.800 peak  5108 spectrum    1 weight  0.10000E+01 volume  0.36678E-03 ppm1      4.195 ppm2      4.444 CV     1
 ASSI { 5117}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 111  and name HN  ))
      3.100     1.200     1.200 peak  5117 spectrum    1 weight  0.10000E+01 volume  0.78567E-02 ppm1      3.883 ppm2      8.491 CV     1
 ASSI { 5122}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 111  and name HA  ))
      4.100     2.100     1.900 peak  5122 spectrum    1 weight  0.10000E+01 volume  0.67434E-03 ppm1      3.868 ppm2      5.581 CV     1
 ASSI { 5123}
   (( segid "    " and resid 90   and name HA2 ))
   (( segid "    " and resid 90   and name HA1 ))
      1.800     0.400     0.400 peak  5123 spectrum    1 weight  0.10000E+01 volume  0.10627E-01 ppm1      3.858 ppm2      4.690 CV     1
 ASSI { 5124}
   (( segid "    " and resid 8    and name HA2 ))
   (  segid "    " and resid 7    and name HG1%)
      3.500     1.600     1.600 peak  5124 spectrum    1 weight  0.10000E+01 volume  0.97986E-03 ppm1      3.852 ppm2      0.862 CV     1
 ASSI { 5126}
   (( segid "    " and resid 97   and name HA2 ))
   (( segid "    " and resid 28   and name HN  ))
      4.300     2.300     1.700 peak  5126 spectrum    1 weight  0.10000E+01 volume  0.96319E-03 ppm1      3.374 ppm2      8.958 CV     1
 ASSI { 5128}
   (( segid "    " and resid 97   and name HA2 ))
   (  segid "    " and resid 98   and name HD1%)
      3.900     1.900     1.900 peak  5128 spectrum    1 weight  0.10000E+01 volume  0.49835E-03 ppm1      3.366 ppm2      0.522 CV     1
 OR { 5128}
   (( segid "    " and resid 97   and name HA2 ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 5129}
   (( segid "    " and resid 97   and name HA2 ))
   (( segid "    " and resid 97   and name HN  ))
      2.800     1.000     1.000 peak  5129 spectrum    1 weight  0.10000E+01 volume  0.41723E-02 ppm1      3.367 ppm2      9.235 CV     1
 ASSI { 5130}
   (( segid "    " and resid 97   and name HA2 ))
   (( segid "    " and resid 98   and name HN  ))
      2.300     0.700     0.700 peak  5130 spectrum    1 weight  0.10000E+01 volume  0.40681E-02 ppm1      3.366 ppm2      7.670 CV     1
 ASSI { 5131}
   (( segid "    " and resid 97   and name HA2 ))
   (( segid "    " and resid 26   and name HN  ))
      3.600     1.600     1.600 peak  5131 spectrum    1 weight  0.10000E+01 volume  0.10390E-02 ppm1      3.363 ppm2      6.793 CV     1
 ASSI { 5132}
   (( segid "    " and resid 97   and name HA2 ))
   (  segid "    " and resid 99   and name HE% )
      3.400     1.400     1.400 peak  5132 spectrum    1 weight  0.10000E+01 volume  0.27098E-02 ppm1      3.356 ppm2      6.615 CV     1
 ASSI { 5135}
   (( segid "    " and resid 128  and name HA1 ))
   (( segid "    " and resid 121  and name HZ3 ))
      4.900     3.000     1.100 peak  5135 spectrum    1 weight  0.10000E+01 volume  0.37999E-03 ppm1      3.311 ppm2      7.096 CV     1
 ASSI { 5138}
   (( segid "    " and resid 16   and name HD1 ))
   (  segid "    " and resid 112  and name HD% )
      3.600     1.600     1.600 peak  5138 spectrum    1 weight  0.10000E+01 volume  0.20456E-02 ppm1      3.299 ppm2      6.734 CV     1
 ASSI { 5139}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 16   and name HD2 ))
      1.500     0.300     0.700 peak  5139 spectrum    1 weight  0.10000E+01 volume  0.23571E-01 ppm1      3.302 ppm2      3.083 CV     1
 ASSI { 5140}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 16   and name HB1 ))
      3.400     1.500     1.500 peak  5140 spectrum    1 weight  0.10000E+01 volume  0.20726E-02 ppm1      3.303 ppm2      2.027 CV     1
 ASSI { 5141}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 16   and name HG2 ))
      2.200     0.600     0.600 peak  5141 spectrum    1 weight  0.10000E+01 volume  0.60639E-02 ppm1      3.296 ppm2      1.750 CV     1
 OR { 5141}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 16   and name HB2 ))
 ASSI { 5143}
   (( segid "    " and resid 128  and name HA1 ))
   (( segid "    " and resid 129  and name HA  ))
      3.900     1.900     1.900 peak  5143 spectrum    1 weight  0.10000E+01 volume  0.76293E-03 ppm1      3.287 ppm2      4.631 CV     1
 ASSI { 5145}
   (( segid "    " and resid 128  and name HA1 ))
   (  segid "    " and resid 122  and name HB% )
      4.200     2.200     1.800 peak  5145 spectrum    1 weight  0.10000E+01 volume  0.40646E-03 ppm1      3.283 ppm2      1.224 CV     1
 ASSI { 5146}
   (( segid "    " and resid 16   and name HD1 ))
   (  segid "    " and resid 140  and name HD2%)
      3.500     1.600     1.600 peak  5146 spectrum    1 weight  0.10000E+01 volume  0.15660E-02 ppm1      3.284 ppm2      0.680 CV     1
 OR { 5146}
   (( segid "    " and resid 16   and name HD1 ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 5149}
   (( segid "    " and resid 82   and name HA1 ))
   (  segid "    " and resid 44   and name HB% )
      4.800     2.800     1.200 peak  5149 spectrum    1 weight  0.10000E+01 volume  0.79818E-03 ppm1      3.168 ppm2      1.532 CV     1
 ASSI { 5151}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 82   and name HN  ))
      2.700     0.900     0.900 peak  5151 spectrum    1 weight  0.10000E+01 volume  0.20914E-02 ppm1      3.156 ppm2      5.634 CV     1
 ASSI { 5153}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 82   and name HA2 ))
      1.900     0.400     0.400 peak  5153 spectrum    1 weight  0.10000E+01 volume  0.99617E-02 ppm1      3.152 ppm2      2.175 CV     1
 ASSI { 5156}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 112  and name HD% )
      3.700     1.700     1.700 peak  5156 spectrum    1 weight  0.10000E+01 volume  0.18331E-02 ppm1      3.131 ppm2      6.734 CV     1
 ASSI { 5160}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name HG1 ))
      2.300     0.700     0.700 peak  5160 spectrum    1 weight  0.10000E+01 volume  0.61105E-02 ppm1      3.125 ppm2      1.779 CV     1
 OR { 5160}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name HB2 ))
 OR { 5160}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 5162}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 140  and name HD2%)
      3.200     1.300     1.300 peak  5162 spectrum    1 weight  0.10000E+01 volume  0.16019E-02 ppm1      3.125 ppm2      0.680 CV     1
 OR { 5162}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 5165}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 44   and name HN  ))
      4.100     2.100     1.900 peak  5165 spectrum    1 weight  0.10000E+01 volume  0.38028E-03 ppm1      2.171 ppm2      8.786 CV     1
 ASSI { 5166}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 83   and name HN  ))
      3.800     1.800     1.800 peak  5166 spectrum    1 weight  0.10000E+01 volume  0.10723E-02 ppm1      2.168 ppm2      7.445 CV     1
 ASSI { 5167}
   (( segid "    " and resid 82   and name HA2 ))
   (  segid "    " and resid 54   and name HE% )
      3.100     1.200     1.200 peak  5167 spectrum    1 weight  0.10000E+01 volume  0.11811E-02 ppm1      2.176 ppm2      7.213 CV     1
 ASSI { 5170}
   (( segid "    " and resid 82   and name HA2 ))
   (  segid "    " and resid 49   and name HD% )
      3.600     1.600     1.600 peak  5170 spectrum    1 weight  0.10000E+01 volume  0.89074E-03 ppm1      2.166 ppm2      6.569 CV     1
 ASSI { 5171}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 82   and name HN  ))
      2.900     1.100     1.100 peak  5171 spectrum    1 weight  0.10000E+01 volume  0.26197E-02 ppm1      2.175 ppm2      5.631 CV     1
 ASSI { 5174}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 80   and name HB1 ))
      4.700     2.700     1.300 peak  5174 spectrum    1 weight  0.10000E+01 volume  0.65390E-03 ppm1      2.165 ppm2      2.704 CV     1
 ASSI { 5177}
   (( segid "    " and resid 82   and name HA2 ))
   (  segid "    " and resid 83   and name HG2%)
      4.900     3.100     1.100 peak  5177 spectrum    1 weight  0.10000E+01 volume  0.37523E-03 ppm1      2.176 ppm2      0.829 CV     1
 ASSI { 5182}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 32   and name HN  ))
      3.000     1.100     1.100 peak  5182 spectrum    1 weight  0.10000E+01 volume  0.98176E-03 ppm1      4.372 ppm2      8.725 CV     1
 ASSI { 5183}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 94   and name HN  ))
      2.900     1.100     1.100 peak  5183 spectrum    1 weight  0.10000E+01 volume  0.51293E-02 ppm1      4.370 ppm2      7.949 CV     1
 ASSI { 5184}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 92   and name HE3 ))
      4.100     2.100     1.900 peak  5184 spectrum    1 weight  0.10000E+01 volume  0.97900E-03 ppm1      4.373 ppm2      7.342 CV     1
 ASSI { 5186}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 31   and name HA  ))
      2.400     0.700     0.700 peak  5186 spectrum    1 weight  0.10000E+01 volume  0.33114E-02 ppm1      4.370 ppm2      4.750 CV     1
 ASSI { 5188}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 30   and name HB  ))
      4.500     2.600     1.500 peak  5188 spectrum    1 weight  0.10000E+01 volume  0.10186E-02 ppm1      4.371 ppm2      2.162 CV     1
 ASSI { 5200}
   (( segid "    " and resid 8    and name HA1 ))
   (( segid "    " and resid 8    and name HA2 ))
      2.000     0.500     0.500 peak  5200 spectrum    1 weight  0.10000E+01 volume  0.85841E-02 ppm1      4.196 ppm2      3.884 CV     1
 ASSI { 5202}
   (( segid "    " and resid 8    and name HA1 ))
   (( segid "    " and resid 9    and name HB2 ))
      4.700     2.700     1.300 peak  5202 spectrum    1 weight  0.10000E+01 volume  0.52581E-03 ppm1      4.178 ppm2      2.535 CV     1
 ASSI { 5207}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 9    and name HB1 ))
      4.700     2.700     1.300 peak  5207 spectrum    1 weight  0.10000E+01 volume  0.49315E-03 ppm1      3.855 ppm2      2.941 CV     1
 ASSI { 5209}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 31   and name HN  ))
      4.300     2.300     1.700 peak  5209 spectrum    1 weight  0.10000E+01 volume  0.35648E-03 ppm1      3.456 ppm2      8.958 CV     1
 ASSI { 5211}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 32   and name HN  ))
      3.100     1.200     1.200 peak  5211 spectrum    1 weight  0.10000E+01 volume  0.17292E-02 ppm1      3.446 ppm2      8.732 CV     1
 ASSI { 5212}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 94   and name HN  ))
      2.200     0.600     0.600 peak  5212 spectrum    1 weight  0.10000E+01 volume  0.51107E-02 ppm1      3.443 ppm2      7.969 CV     1
 ASSI { 5213}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 92   and name HN  ))
      5.300     3.400     0.700 peak  5213 spectrum    1 weight  0.10000E+01 volume  0.37933E-03 ppm1      3.450 ppm2      7.563 CV     1
 ASSI { 5214}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 92   and name HE3 ))
      3.700     1.700     1.700 peak  5214 spectrum    1 weight  0.10000E+01 volume  0.45472E-03 ppm1      3.448 ppm2      7.323 CV     1
 ASSI { 5216}
   (( segid "    " and resid 136  and name HA2 ))
   (( segid "    " and resid 135  and name HA  ))
      3.700     1.700     1.700 peak  5216 spectrum    1 weight  0.10000E+01 volume  0.20397E-02 ppm1      3.442 ppm2      5.281 CV     1
 ASSI { 5218}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 31   and name HA  ))
      2.400     0.700     0.700 peak  5218 spectrum    1 weight  0.10000E+01 volume  0.41225E-02 ppm1      3.446 ppm2      4.749 CV     1
 ASSI { 5219}
   (( segid "    " and resid 136  and name HA2 ))
   (( segid "    " and resid 136  and name HA1 ))
      1.800     0.400     0.400 peak  5219 spectrum    1 weight  0.10000E+01 volume  0.10272E-01 ppm1      3.445 ppm2      4.518 CV     1
 ASSI { 5220}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 93   and name HA1 ))
      1.600     0.300     0.600 peak  5220 spectrum    1 weight  0.10000E+01 volume  0.12993E-01 ppm1      3.448 ppm2      4.387 CV     1
 ASSI { 5221}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 30   and name HB  ))
      3.800     1.800     1.800 peak  5221 spectrum    1 weight  0.10000E+01 volume  0.88607E-03 ppm1      3.447 ppm2      2.149 CV     1
 ASSI { 5222}
   (( segid "    " and resid 136  and name HA2 ))
   (( segid "    " and resid 7    and name HB  ))
      3.400     1.400     1.400 peak  5222 spectrum    1 weight  0.10000E+01 volume  0.30366E-02 ppm1      3.445 ppm2      1.887 CV     1
 ASSI { 5230}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 139  and name HN  ))
      4.200     2.200     1.800 peak  5230 spectrum    1 weight  0.10000E+01 volume  0.75686E-03 ppm1      1.816 ppm2      9.170 CV     1
 ASSI { 5238}
   (( segid "    " and resid 10   and name HB1 ))
   (  segid "    " and resid 10   and name HD1%)
      2.800     1.000     1.000 peak  5238 spectrum    1 weight  0.10000E+01 volume  0.50252E-02 ppm1      1.823 ppm2      0.460 CV     1
 ASSI { 5240}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HA  ))
      3.200     1.300     1.300 peak  5240 spectrum    1 weight  0.10000E+01 volume  0.11855E-02 ppm1      1.532 ppm2      4.704 CV     1
 ASSI { 5243}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
      3.300     1.400     1.400 peak  5243 spectrum    1 weight  0.10000E+01 volume  0.15995E-02 ppm1      1.529 ppm2      8.513 CV     1
 ASSI { 5245}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HG  ))
      3.000     1.100     1.100 peak  5245 spectrum    1 weight  0.10000E+01 volume  0.12543E-02 ppm1      1.530 ppm2      1.217 CV     1
 ASSI { 5246}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HB2 ))
      1.800     0.400     0.400 peak  5246 spectrum    1 weight  0.10000E+01 volume  0.96149E-02 ppm1      1.532 ppm2      0.671 CV     1
 ASSI { 5247}
   (( segid "    " and resid 65   and name HB1 ))
   (  segid "    " and resid 65   and name HD2%)
      2.900     1.000     1.000 peak  5247 spectrum    1 weight  0.10000E+01 volume  0.24847E-02 ppm1      1.532 ppm2      0.420 CV     1
 ASSI { 5249}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 139  and name HN  ))
      4.300     2.300     1.700 peak  5249 spectrum    1 weight  0.10000E+01 volume  0.37866E-03 ppm1      1.459 ppm2      9.121 CV     1
 ASSI { 5251}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HN  ))
      3.600     1.600     1.600 peak  5251 spectrum    1 weight  0.10000E+01 volume  0.10676E-02 ppm1      1.457 ppm2      8.413 CV     1
 ASSI { 5256}
   (( segid "    " and resid 10   and name HB2 ))
   (  segid "    " and resid 10   and name HD1%)
      2.500     0.800     0.800 peak  5256 spectrum    1 weight  0.10000E+01 volume  0.50649E-02 ppm1      1.452 ppm2      0.477 CV     1
 ASSI { 5257}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      3.900     1.900     1.900 peak  5257 spectrum    1 weight  0.10000E+01 volume  0.59409E-03 ppm1      0.695 ppm2      8.926 CV     1
 ASSI { 5259}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HG  ))
      3.300     1.400     1.400 peak  5259 spectrum    1 weight  0.10000E+01 volume  0.13427E-02 ppm1      0.692 ppm2      1.253 CV     1
 ASSI { 5260}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 66   and name HN  ))
      4.500     2.500     1.500 peak  5260 spectrum    1 weight  0.10000E+01 volume  0.62996E-03 ppm1      0.681 ppm2      9.627 CV     1
 ASSI { 5261}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      2.800     1.000     1.000 peak  5261 spectrum    1 weight  0.10000E+01 volume  0.17629E-02 ppm1      0.680 ppm2      8.513 CV     1
 ASSI { 5262}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 112  and name HE% )
      3.800     1.800     1.800 peak  5262 spectrum    1 weight  0.10000E+01 volume  0.40364E-03 ppm1      0.679 ppm2      6.322 CV     1
 ASSI { 5263}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HA  ))
      3.000     1.100     1.100 peak  5263 spectrum    1 weight  0.10000E+01 volume  0.20377E-02 ppm1      0.682 ppm2      4.704 CV     1
 ASSI { 5267}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 65   and name HD2%)
      2.900     1.100     1.100 peak  5267 spectrum    1 weight  0.10000E+01 volume  0.26017E-02 ppm1      0.682 ppm2      0.431 CV     1
 ASSI { 5268}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 55   and name HD% )
      4.200     2.200     1.800 peak  5268 spectrum    1 weight  0.10000E+01 volume  0.43631E-03 ppm1      0.674 ppm2      6.726 CV     1
 ASSI { 5272}
   (( segid "    " and resid 48   and name HB1 ))
   (  segid "    " and resid 55   and name HE% )
      4.100     2.100     1.900 peak  5272 spectrum    1 weight  0.10000E+01 volume  0.81783E-03 ppm1      3.585 ppm2      7.183 CV     1
 ASSI { 5273}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 10   and name HN  ))
      3.100     1.200     1.200 peak  5273 spectrum    1 weight  0.10000E+01 volume  0.28706E-02 ppm1      2.973 ppm2      8.412 CV     1
 ASSI { 5274}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.100     1.200     1.200 peak  5274 spectrum    1 weight  0.10000E+01 volume  0.25101E-02 ppm1      2.972 ppm2      7.826 CV     1
 ASSI { 5276}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HB2 ))
      1.900     0.400     0.400 peak  5276 spectrum    1 weight  0.10000E+01 volume  0.12858E-01 ppm1      2.977 ppm2      2.494 CV     1
 ASSI { 5277}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      3.400     1.500     1.500 peak  5277 spectrum    1 weight  0.10000E+01 volume  0.12548E-02 ppm1      2.659 ppm2      7.761 CV     1
 ASSI { 5278}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 137  and name HN  ))
      4.700     2.800     1.300 peak  5278 spectrum    1 weight  0.10000E+01 volume  0.57968E-03 ppm1      2.529 ppm2      9.363 CV     1
 ASSI { 5279}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 10   and name HN  ))
      3.300     1.400     1.400 peak  5279 spectrum    1 weight  0.10000E+01 volume  0.22642E-02 ppm1      2.518 ppm2      8.415 CV     1
 ASSI { 5287}
   (( segid "    " and resid 56   and name HB1 ))
   (  segid "    " and resid 112  and name HD% )
      3.100     1.200     1.200 peak  5287 spectrum    1 weight  0.10000E+01 volume  0.92475E-03 ppm1      1.784 ppm2      6.759 CV     1
 ASSI { 5289}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 112  and name HB2 ))
      2.600     0.800     0.800 peak  5289 spectrum    1 weight  0.10000E+01 volume  0.21950E-02 ppm1      1.775 ppm2      2.680 CV     1
 OR { 5289}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI { 5290}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HN  ))
      3.200     1.300     1.300 peak  5290 spectrum    1 weight  0.10000E+01 volume  0.32365E-02 ppm1      1.717 ppm2      8.984 CV     1
 ASSI { 5291}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 34   and name HN  ))
      3.700     1.700     1.700 peak  5291 spectrum    1 weight  0.10000E+01 volume  0.94560E-03 ppm1      1.719 ppm2      8.779 CV     1
 ASSI { 5292}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 32   and name HA  ))
      5.100     3.300     0.900 peak  5292 spectrum    1 weight  0.10000E+01 volume  0.78249E-03 ppm1      1.719 ppm2      5.628 CV     1
 ASSI { 5293}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HA  ))
      2.700     0.900     0.900 peak  5293 spectrum    1 weight  0.10000E+01 volume  0.31055E-02 ppm1      1.717 ppm2      4.670 CV     1
 ASSI { 5294}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 4    and name HG2 ))
      3.600     1.600     1.600 peak  5294 spectrum    1 weight  0.10000E+01 volume  0.11813E-02 ppm1      1.721 ppm2      2.298 CV     1
 OR { 5294}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 4    and name HG1 ))
 ASSI { 5295}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 4    and name HB2 ))
      3.600     1.600     1.600 peak  5295 spectrum    1 weight  0.10000E+01 volume  0.12550E-02 ppm1      1.714 ppm2      1.997 CV     1
 OR { 5295}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 5296}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HB2 ))
      1.500     0.300     0.700 peak  5296 spectrum    1 weight  0.10000E+01 volume  0.35755E-01 ppm1      1.717 ppm2      1.560 CV     1
 OR { 5296}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HG  ))
 ASSI { 5298}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 34   and name HA2 ))
      4.300     2.300     1.700 peak  5298 spectrum    1 weight  0.10000E+01 volume  0.58286E-03 ppm1      1.700 ppm2      3.804 CV     1
 ASSI { 5299}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 32   and name HA  ))
      4.500     2.600     1.500 peak  5299 spectrum    1 weight  0.10000E+01 volume  0.66505E-03 ppm1      1.612 ppm2      5.629 CV     1
 ASSI { 5300}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 4    and name HG2 ))
      3.500     1.500     1.500 peak  5300 spectrum    1 weight  0.10000E+01 volume  0.89164E-03 ppm1      1.618 ppm2      2.284 CV     1
 OR { 5300}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 4    and name HG1 ))
 ASSI { 5301}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 4    and name HB2 ))
      3.200     1.300     1.300 peak  5301 spectrum    1 weight  0.10000E+01 volume  0.13985E-02 ppm1      1.613 ppm2      1.993 CV     1
 OR { 5301}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 5302}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HN  ))
      2.600     0.900     0.900 peak  5302 spectrum    1 weight  0.10000E+01 volume  0.28384E-02 ppm1      1.610 ppm2      8.984 CV     1
 ASSI { 5303}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 34   and name HN  ))
      4.200     2.200     1.800 peak  5303 spectrum    1 weight  0.10000E+01 volume  0.12162E-02 ppm1      1.605 ppm2      8.766 CV     1
 ASSI { 5304}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HA  ))
      2.700     0.900     0.900 peak  5304 spectrum    1 weight  0.10000E+01 volume  0.37802E-02 ppm1      1.607 ppm2      4.670 CV     1
 ASSI { 5305}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HB1 ))
      1.500     0.300     0.700 peak  5305 spectrum    1 weight  0.10000E+01 volume  0.40082E-01 ppm1      1.612 ppm2      1.734 CV     1
 ASSI { 5307}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 34   and name HA2 ))
      4.900     3.000     1.100 peak  5307 spectrum    1 weight  0.10000E+01 volume  0.48300E-03 ppm1      1.595 ppm2      3.798 CV     1
 ASSI { 5310}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 112  and name HB2 ))
      3.800     1.800     1.800 peak  5310 spectrum    1 weight  0.10000E+01 volume  0.16289E-02 ppm1      1.483 ppm2      2.679 CV     1
 OR { 5310}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI { 5315}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 101  and name HA  ))
      4.500     2.500     1.500 peak  5315 spectrum    1 weight  0.10000E+01 volume  0.11930E-02 ppm1      4.241 ppm2      4.919 CV     1
 ASSI { 5316}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 102  and name HA2 ))
      1.800     0.400     0.400 peak  5316 spectrum    1 weight  0.10000E+01 volume  0.13887E-01 ppm1      4.247 ppm2      3.449 CV     1
 ASSI { 5319}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 103  and name HB1 ))
      3.800     1.800     1.800 peak  5319 spectrum    1 weight  0.10000E+01 volume  0.13821E-02 ppm1      4.238 ppm2      2.158 CV     1
 OR { 5319}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI { 5322}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 114  and name HA  ))
      3.000     1.100     1.100 peak  5322 spectrum    1 weight  0.10000E+01 volume  0.11076E-02 ppm1      3.605 ppm2      4.683 CV     1
 ASSI { 5325}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 115  and name HN  ))
      3.400     1.400     1.400 peak  5325 spectrum    1 weight  0.10000E+01 volume  0.11207E-02 ppm1      3.582 ppm2      7.987 CV     1
 ASSI { 5327}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 48   and name HB2 ))
      2.000     0.500     0.500 peak  5327 spectrum    1 weight  0.10000E+01 volume  0.64152E-02 ppm1      3.584 ppm2      2.639 CV     1
 ASSI { 5331}
   (( segid "    " and resid 102  and name HA2 ))
   (( segid "    " and resid 101  and name HA  ))
      4.400     2.400     1.600 peak  5331 spectrum    1 weight  0.10000E+01 volume  0.13673E-02 ppm1      3.457 ppm2      4.916 CV     1
 ASSI { 5335}
   (( segid "    " and resid 102  and name HA2 ))
   (  segid "    " and resid 100  and name HG1%)
      3.900     1.900     1.900 peak  5335 spectrum    1 weight  0.10000E+01 volume  0.12614E-02 ppm1      3.463 ppm2      0.852 CV     1
 OR { 5335}
   (( segid "    " and resid 102  and name HA2 ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 5339}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 92   and name HN  ))
      5.300     3.600     0.700 peak  5339 spectrum    1 weight  0.10000E+01 volume  0.30508E-03 ppm1      3.298 ppm2      7.565 CV     1
 ASSI { 5340}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 38   and name HN  ))
      3.700     1.700     1.700 peak  5340 spectrum    1 weight  0.10000E+01 volume  0.45113E-03 ppm1      3.306 ppm2      7.331 CV     1
 ASSI { 5342}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HA  ))
      2.700     0.900     0.900 peak  5342 spectrum    1 weight  0.10000E+01 volume  0.31330E-02 ppm1      3.298 ppm2      4.341 CV     1
 ASSI { 5344}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HB2 ))
      2.000     0.500     0.500 peak  5344 spectrum    1 weight  0.10000E+01 volume  0.62364E-02 ppm1      3.297 ppm2      2.698 CV     1
 ASSI { 5346}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 38   and name HB1 ))
      3.000     1.100     1.100 peak  5346 spectrum    1 weight  0.10000E+01 volume  0.13067E-02 ppm1      3.301 ppm2      1.583 CV     1
 OR { 5346}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 5349}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 38   and name HA  ))
      5.000     3.100     1.000 peak  5349 spectrum    1 weight  0.10000E+01 volume  0.34089E-03 ppm1      3.280 ppm2      4.807 CV     1
 ASSI { 5352}
   (( segid "    " and resid 80   and name HB2 ))
   (  segid "    " and resid 83   and name HG1%)
      5.300     3.500     0.700 peak  5352 spectrum    1 weight  0.10000E+01 volume  0.33603E-03 ppm1      2.356 ppm2      1.109 CV     1
 ASSI { 5368}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 80   and name HN  ))
      3.000     1.100     1.100 peak  5368 spectrum    1 weight  0.10000E+01 volume  0.18813E-02 ppm1      2.703 ppm2      9.485 CV     1
 ASSI { 5371}
   (( segid "    " and resid 80   and name HB1 ))
   (  segid "    " and resid 85   and name HD% )
      3.800     1.800     1.800 peak  5371 spectrum    1 weight  0.10000E+01 volume  0.69692E-03 ppm1      2.694 ppm2      6.023 CV     1
 ASSI { 5372}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 82   and name HN  ))
      2.900     1.100     1.100 peak  5372 spectrum    1 weight  0.10000E+01 volume  0.30345E-02 ppm1      2.702 ppm2      5.683 CV     1
 ASSI { 5377}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 88   and name HA  ))
      2.500     0.800     0.800 peak  5377 spectrum    1 weight  0.10000E+01 volume  0.63372E-02 ppm1      2.671 ppm2      4.929 CV     1
 ASSI { 5385}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 137  and name HB  ))
      4.200     2.200     1.800 peak  5385 spectrum    1 weight  0.10000E+01 volume  0.69981E-03 ppm1      2.524 ppm2      3.744 CV     1
 ASSI { 5387}
   (( segid "    " and resid 80   and name HB2 ))
   (  segid "    " and resid 83   and name HG2%)
      3.300     1.400     1.400 peak  5387 spectrum    1 weight  0.10000E+01 volume  0.19730E-02 ppm1      2.361 ppm2      0.815 CV     1
 ASSI { 5389}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 81   and name HN  ))
      4.300     2.300     1.700 peak  5389 spectrum    1 weight  0.10000E+01 volume  0.88533E-03 ppm1      2.351 ppm2      9.255 CV     1
 ASSI { 5390}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 83   and name HN  ))
      5.100     3.300     0.900 peak  5390 spectrum    1 weight  0.10000E+01 volume  0.35367E-03 ppm1      2.350 ppm2      7.434 CV     1
 ASSI { 5395}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HA  ))
      2.600     0.800     0.800 peak  5395 spectrum    1 weight  0.10000E+01 volume  0.46103E-02 ppm1      2.354 ppm2      4.689 CV     1
 ASSI { 5397}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 89   and name HN  ))
      3.500     1.500     1.500 peak  5397 spectrum    1 weight  0.10000E+01 volume  0.26073E-02 ppm1      2.249 ppm2      8.145 CV     1
 ASSI { 5398}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HN  ))
      2.700     0.900     0.900 peak  5398 spectrum    1 weight  0.10000E+01 volume  0.29029E-02 ppm1      2.249 ppm2      7.298 CV     1
 ASSI { 5399}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      2.800     1.000     1.000 peak  5399 spectrum    1 weight  0.10000E+01 volume  0.50467E-02 ppm1      2.244 ppm2      4.926 CV     1
 ASSI { 5401}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 92   and name HB2 ))
      4.100     2.100     1.900 peak  5401 spectrum    1 weight  0.10000E+01 volume  0.65386E-03 ppm1      2.246 ppm2      2.970 CV     1
 ASSI { 5402}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HB1 ))
      1.600     0.300     0.600 peak  5402 spectrum    1 weight  0.10000E+01 volume  0.28281E-01 ppm1      2.243 ppm2      2.696 CV     1
 ASSI { 5403}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 89   and name HG2%)
      4.000     2.000     2.000 peak  5403 spectrum    1 weight  0.10000E+01 volume  0.26300E-02 ppm1      2.241 ppm2      0.860 CV     1
 OR { 5403}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 89   and name HG1%)
 ASSI { 5404}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 64   and name HA  ))
      3.900     1.900     1.900 peak  5404 spectrum    1 weight  0.10000E+01 volume  0.61146E-03 ppm1      2.053 ppm2      5.089 CV     1
 ASSI { 5405}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 57   and name HN  ))
      2.900     1.100     1.100 peak  5405 spectrum    1 weight  0.10000E+01 volume  0.17303E-02 ppm1      2.041 ppm2      8.956 CV     1
 ASSI { 5406}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 113  and name HN  ))
      4.600     2.600     1.400 peak  5406 spectrum    1 weight  0.10000E+01 volume  0.42520E-03 ppm1      2.041 ppm2      8.724 CV     1
 ASSI { 5409}
   (( segid "    " and resid 57   and name HB  ))
   (  segid "    " and resid 55   and name HE% )
      2.300     0.700     0.700 peak  5409 spectrum    1 weight  0.10000E+01 volume  0.30915E-02 ppm1      2.037 ppm2      7.198 CV     1
 ASSI { 5413}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 56   and name HA  ))
      4.300     2.300     1.700 peak  5413 spectrum    1 weight  0.10000E+01 volume  0.47164E-03 ppm1      2.042 ppm2      4.551 CV     1
 ASSI { 5414}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 57   and name HG12))
      2.500     0.800     0.800 peak  5414 spectrum    1 weight  0.10000E+01 volume  0.28713E-02 ppm1      2.038 ppm2      1.752 CV     1
 ASSI { 5415}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 57   and name HG11))
      2.800     1.000     1.000 peak  5415 spectrum    1 weight  0.10000E+01 volume  0.32783E-02 ppm1      2.042 ppm2      1.635 CV     1
 ASSI { 5416}
   (( segid "    " and resid 57   and name HB  ))
   (  segid "    " and resid 57   and name HG2%)
      2.100     0.500     0.500 peak  5416 spectrum    1 weight  0.10000E+01 volume  0.11400E-01 ppm1      2.041 ppm2      0.990 CV     1
 OR { 5416}
   (( segid "    " and resid 57   and name HB  ))
   (  segid "    " and resid 57   and name HD1%)
 ASSI { 5417}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 64   and name HB2 ))
      4.200     2.200     1.800 peak  5417 spectrum    1 weight  0.10000E+01 volume  0.59276E-03 ppm1      2.035 ppm2      0.698 CV     1
 OR { 5417}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 64   and name HD2 ))
 OR { 5417}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 64   and name HG1 ))
 ASSI { 5418}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 55   and name HZ  ))
      5.300     3.600     0.700 peak  5418 spectrum    1 weight  0.10000E+01 volume  0.40088E-03 ppm1      2.025 ppm2      6.946 CV     1
 ASSI { 5420}
   (( segid "    " and resid 56   and name HB2 ))
   (  segid "    " and resid 112  and name HD% )
      3.500     1.600     1.600 peak  5420 spectrum    1 weight  0.10000E+01 volume  0.62595E-03 ppm1      1.481 ppm2      6.770 CV     1
 ASSI { 5422}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 3    and name HB2 ))
      3.500     1.500     1.500 peak  5422 spectrum    1 weight  0.10000E+01 volume  0.79286E-03 ppm1      3.310 ppm2      2.348 CV     1
 ASSI { 5429}
   (( segid "    " and resid 85   and name HB1 ))
   (  segid "    " and resid 85   and name HD% )
      2.900     1.100     1.100 peak  5429 spectrum    1 weight  0.10000E+01 volume  0.22774E-02 ppm1      2.767 ppm2      5.998 CV     1
 ASSI { 5435}
   (( segid "    " and resid 14   and name HE2 ))
   (( segid "    " and resid 14   and name HE1 ))
      1.700     0.400     0.500 peak  5435 spectrum    1 weight  0.10000E+01 volume  0.17709E-01 ppm1      2.715 ppm2      2.964 CV     1
 ASSI { 5440}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 92   and name HE1 ))
      4.600     2.600     1.400 peak  5440 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      2.684 ppm2     11.182 CV     1
 ASSI { 5444}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 86   and name HD2 ))
      2.900     1.000     1.000 peak  5444 spectrum    1 weight  0.10000E+01 volume  0.21943E-02 ppm1      2.680 ppm2      0.282 CV     1
 ASSI { 5448}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 85   and name HD% )
      2.600     0.800     0.800 peak  5448 spectrum    1 weight  0.10000E+01 volume  0.24815E-02 ppm1      2.373 ppm2      6.012 CV     1
 ASSI { 5451}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 41   and name HB% )
      3.300     1.300     1.300 peak  5451 spectrum    1 weight  0.10000E+01 volume  0.24219E-02 ppm1      2.370 ppm2      1.480 CV     1
 ASSI { 5459}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 86   and name HG1 ))
      3.500     1.600     1.600 peak  5459 spectrum    1 weight  0.10000E+01 volume  0.10372E-02 ppm1      2.198 ppm2      0.992 CV     1
 ASSI { 5462}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 92   and name HD1 ))
      3.800     1.800     1.800 peak  5462 spectrum    1 weight  0.10000E+01 volume  0.89565E-03 ppm1      2.190 ppm2      7.548 CV     1
 OR { 5462}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 92   and name HN  ))
 ASSI { 5463}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 39   and name HA  ))
      2.900     1.100     1.100 peak  5463 spectrum    1 weight  0.10000E+01 volume  0.45604E-02 ppm1      2.186 ppm2      4.678 CV     1
 ASSI { 5465}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 86   and name HD2 ))
      2.900     1.000     1.000 peak  5465 spectrum    1 weight  0.10000E+01 volume  0.18188E-02 ppm1      2.182 ppm2      0.286 CV     1
 ASSI { 5466}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 86   and name HG2 ))
      3.400     1.400     1.400 peak  5466 spectrum    1 weight  0.10000E+01 volume  0.11367E-02 ppm1      2.185 ppm2     -0.589 CV     1
 ASSI { 5467}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 86   and name HB2 ))
      5.200     3.300     0.800 peak  5467 spectrum    1 weight  0.10000E+01 volume  0.38290E-03 ppm1      2.190 ppm2     -0.822 CV     1
 ASSI { 5477}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 54   and name HZ  ))
      4.000     2.000     2.000 peak  5477 spectrum    1 weight  0.10000E+01 volume  0.17526E-02 ppm1      3.086 ppm2      6.702 CV     1
 ASSI { 5478}
   (( segid "    " and resid 84   and name HB1 ))
   (  segid "    " and resid 84   and name HE% )
      3.800     1.800     1.800 peak  5478 spectrum    1 weight  0.10000E+01 volume  0.17557E-02 ppm1      3.083 ppm2      6.215 CV     1
 ASSI { 5483}
   (( segid "    " and resid 54   and name HB1 ))
   (  segid "    " and resid 54   and name HD% )
      2.700     0.900     0.900 peak  5483 spectrum    1 weight  0.10000E+01 volume  0.28444E-02 ppm1      3.019 ppm2      7.283 CV     1
 ASSI { 5485}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 55   and name HN  ))
      3.800     1.800     1.800 peak  5485 spectrum    1 weight  0.10000E+01 volume  0.12949E-02 ppm1      3.019 ppm2      8.043 CV     1
 ASSI { 5491}
   (( segid "    " and resid 43   and name HE2 ))
   (( segid "    " and resid 121  and name HZ3 ))
      4.600     2.600     1.400 peak  5491 spectrum    1 weight  0.10000E+01 volume  0.57126E-03 ppm1      2.912 ppm2      7.117 CV     1
 OR { 5491}
   (( segid "    " and resid 43   and name HE1 ))
   (( segid "    " and resid 121  and name HZ3 ))
 ASSI { 5492}
   (( segid "    " and resid 43   and name HE2 ))
   (  segid "    " and resid 43   and name HZ% )
      2.600     0.900     0.900 peak  5492 spectrum    1 weight  0.10000E+01 volume  0.26450E-02 ppm1      2.909 ppm2      6.898 CV     1
 OR { 5492}
   (( segid "    " and resid 43   and name HE1 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI { 5494}
   (( segid "    " and resid 43   and name HE1 ))
   (( segid "    " and resid 43   and name HB2 ))
      3.600     1.600     1.600 peak  5494 spectrum    1 weight  0.10000E+01 volume  0.16086E-02 ppm1      2.913 ppm2     -0.438 CV     1
 OR { 5494}
   (( segid "    " and resid 43   and name HE2 ))
   (( segid "    " and resid 43   and name HB2 ))
 ASSI { 5495}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 116  and name HB1 ))
      4.800     2.900     1.200 peak  5495 spectrum    1 weight  0.10000E+01 volume  0.42623E-03 ppm1      2.849 ppm2      1.791 CV     1
 OR { 5495}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 116  and name HB1 ))
 ASSI { 5496}
   (( segid "    " and resid 139  and name HE1 ))
   (( segid "    " and resid 139  and name HD1 ))
      2.400     0.700     0.700 peak  5496 spectrum    1 weight  0.10000E+01 volume  0.68837E-02 ppm1      2.857 ppm2      1.612 CV     1
 OR { 5496}
   (( segid "    " and resid 139  and name HE1 ))
   (( segid "    " and resid 139  and name HB2 ))
 ASSI { 5501}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 44   and name HB% )
      2.900     1.100     1.100 peak  5501 spectrum    1 weight  0.10000E+01 volume  0.59693E-02 ppm1      2.821 ppm2      1.494 CV     1
 ASSI { 5502}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      3.700     1.700     1.700 peak  5502 spectrum    1 weight  0.10000E+01 volume  0.76218E-03 ppm1      2.811 ppm2      5.245 CV     1
 ASSI { 5508}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 16   and name HE  ))
      3.400     1.400     1.400 peak  5508 spectrum    1 weight  0.10000E+01 volume  0.31012E-02 ppm1      2.754 ppm2      7.285 CV     1
 ASSI { 5510}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 140  and name HG  ))
      3.300     1.400     1.400 peak  5510 spectrum    1 weight  0.10000E+01 volume  0.43767E-02 ppm1      2.742 ppm2      0.431 CV     1
 ASSI { 5516}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 84   and name HZ  ))
      3.200     1.300     1.300 peak  5516 spectrum    1 weight  0.10000E+01 volume  0.32705E-02 ppm1      2.507 ppm2      6.402 CV     1
 ASSI { 5529}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HB1 ))
      2.100     0.600     0.600 peak  5529 spectrum    1 weight  0.10000E+01 volume  0.48419E-02 ppm1      2.634 ppm2      2.896 CV     1
 ASSI { 5530}
   (( segid "    " and resid 63   and name HB2 ))
   (  segid "    " and resid 107  and name HG2%)
      4.200     2.200     1.800 peak  5530 spectrum    1 weight  0.10000E+01 volume  0.81849E-03 ppm1      2.640 ppm2      0.916 CV     1
 ASSI { 5535}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HA  ))
      2.400     0.700     0.700 peak  5535 spectrum    1 weight  0.10000E+01 volume  0.48279E-02 ppm1      2.566 ppm2      5.131 CV     1
 ASSI { 5537}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 24   and name HD2 ))
      4.800     2.900     1.200 peak  5537 spectrum    1 weight  0.10000E+01 volume  0.67405E-03 ppm1      2.566 ppm2      3.756 CV     1
 OR { 5537}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 24   and name HD2 ))
 ASSI { 5544}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      5.200     3.300     0.800 peak  5544 spectrum    1 weight  0.10000E+01 volume  0.30747E-03 ppm1      2.517 ppm2      7.820 CV     1
 ASSI { 5549}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 69   and name HN  ))
      3.200     1.300     1.300 peak  5549 spectrum    1 weight  0.10000E+01 volume  0.30061E-02 ppm1      2.496 ppm2      8.035 CV     1
 ASSI { 5553}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 52   and name HA2 ))
      4.300     2.300     1.700 peak  5553 spectrum    1 weight  0.10000E+01 volume  0.63896E-03 ppm1      2.487 ppm2      3.761 CV     1
 ASSI { 5560}
   (( segid "    " and resid 64   and name HE1 ))
   (( segid "    " and resid 64   and name HD2 ))
      2.600     0.900     0.900 peak  5560 spectrum    1 weight  0.10000E+01 volume  0.46467E-02 ppm1      2.423 ppm2      0.674 CV     1
 OR { 5560}
   (( segid "    " and resid 64   and name HE1 ))
   (( segid "    " and resid 64   and name HB2 ))
 ASSI { 5561}
   (( segid "    " and resid 64   and name HE1 ))
   (( segid "    " and resid 64   and name HG2 ))
      3.000     1.100     1.100 peak  5561 spectrum    1 weight  0.10000E+01 volume  0.32793E-02 ppm1      2.437 ppm2     -0.159 CV     1
 ASSI { 5567}
   (( segid "    " and resid 64   and name HE2 ))
   (( segid "    " and resid 64   and name HD2 ))
      2.500     0.800     0.800 peak  5567 spectrum    1 weight  0.10000E+01 volume  0.47272E-02 ppm1      2.349 ppm2      0.674 CV     1
 ASSI { 5568}
   (( segid "    " and resid 64   and name HE2 ))
   (( segid "    " and resid 64   and name HG2 ))
      3.100     1.200     1.200 peak  5568 spectrum    1 weight  0.10000E+01 volume  0.31597E-02 ppm1      2.356 ppm2     -0.159 CV     1
 ASSI { 5576}
   (( segid "    " and resid 92   and name HD1 ))
   (( segid "    " and resid 92   and name HE1 ))
      6.000     4.500     0.000 peak  5576 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.546 ppm2     11.196 CV     1
 ASSI { 5593}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 86   and name HD1 ))
      2.700     0.900     0.900 peak  5593 spectrum    1 weight  0.10000E+01 volume  0.25749E-02 ppm1      2.193 ppm2      1.354 CV     1
 ASSI { 5612}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 42   and name HN  ))
      6.000     4.500     0.000 peak  5612 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.799 ppm2      9.172 CV     1
 ASSI { 5613}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 43   and name HN  ))
      6.000     4.500     0.000 peak  5613 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.793 ppm2      8.865 CV     1 
ASSI {    9}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 77   and name HD1 ))
      4.300     2.300     1.700 peak     9 spectrum    1 weight  0.10000E+01 volume  0.92467E-03 ppm1     11.214 ppm2      6.822 CV     1
 OR {    9}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 92   and name HH2 ))
 ASSI {   11}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 74   and name HB2 ))
      4.100     2.100     1.900 peak    11 spectrum    1 weight  0.10000E+01 volume  0.64325E-03 ppm1     11.213 ppm2      2.975 CV     1
 OR {   11}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI {   12}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 86   and name HE1 ))
      2.700     2.700     3.300 peak    12 spectrum    1 weight  0.10000E+01 volume  0.84834E-03 ppm1     11.214 ppm2      2.712 CV     1
 OR {   12}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 86   and name HA  ))
 OR {   12}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI {   13}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 74   and name HB1 ))
      3.800     1.800     1.800 peak    13 spectrum    1 weight  0.10000E+01 volume  0.68660E-03 ppm1     11.207 ppm2      3.158 CV     1
 OR {   13}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 92   and name HB1 ))
 ASSI {   17}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 74   and name HN  ))
      4.400     2.400     1.600 peak    17 spectrum    1 weight  0.10000E+01 volume  0.55185E-03 ppm1     11.199 ppm2      8.055 CV     1
 OR {   17}
   (( segid "    " and resid 92   and name HE1 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI {   19}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HB  ))
      4.400     2.500     1.600 peak    19 spectrum    1 weight  0.10000E+01 volume  0.43366E-03 ppm1      9.490 ppm2      2.294 CV     1
 OR {   19}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
 ASSI {   31}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 83   and name HG2%)
      3.500     1.500     1.500 peak    31 spectrum    1 weight  0.10000E+01 volume  0.26471E-02 ppm1      9.486 ppm2      0.864 CV     1
 OR {   31}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 42   and name HD2%)
 ASSI {   36}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HE2 ))
      4.400     2.400     1.600 peak    36 spectrum    1 weight  0.10000E+01 volume  0.81424E-03 ppm1      8.809 ppm2      2.908 CV     1
 OR {   36}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HE1 ))
 OR {   36}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {   50}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.000     3.000     3.000 peak    50 spectrum    1 weight  0.10000E+01 volume  0.96335E-03 ppm1      8.592 ppm2      5.051 CV     1
 OR {   50}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI {   52}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
      3.100     1.200     1.200 peak    52 spectrum    1 weight  0.10000E+01 volume  0.28382E-02 ppm1      8.587 ppm2      2.488 CV     1
 OR {   52}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HB  ))
 ASSI {   56}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      3.000     1.100     1.100 peak    56 spectrum    1 weight  0.10000E+01 volume  0.28909E-02 ppm1      8.582 ppm2      2.182 CV     1
 OR {   56}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI {   57}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.700     1.700     1.700 peak    57 spectrum    1 weight  0.10000E+01 volume  0.16342E-02 ppm1      8.546 ppm2      9.461 CV     1
 OR {   57}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
 ASSI {   63}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      2.300     2.300     3.700 peak    63 spectrum    1 weight  0.10000E+01 volume  0.23992E-02 ppm1      8.547 ppm2      0.623 CV     1
 OR {   63}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
 OR {   63}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI {   79}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 130  and name HN  ))
      4.400     2.500     1.600 peak    79 spectrum    1 weight  0.10000E+01 volume  0.80652E-03 ppm1      7.685 ppm2      8.029 CV     1
 OR {   79}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 124  and name HN  ))
 OR {   79}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  100}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 114  and name HD1%)
      3.700     1.700     1.700 peak   100 spectrum    1 weight  0.10000E+01 volume  0.13729E-02 ppm1      9.534 ppm2      0.560 CV     1
 OR {  100}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 116  and name HD2%)
 OR {  100}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI {  115}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 110  and name HA2 ))
      4.200     2.200     1.800 peak   115 spectrum    1 weight  0.10000E+01 volume  0.59194E-03 ppm1      9.416 ppm2      3.929 CV     1
 OR {  115}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 141  and name HB  ))
 ASSI {  124}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HA  ))
      3.600     1.600     1.600 peak   124 spectrum    1 weight  0.10000E+01 volume  0.80615E-03 ppm1      8.954 ppm2      4.708 CV     1
 OR {  124}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 33   and name HA  ))
 ASSI {  128}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 34   and name HA1 ))
      3.900     1.900     1.900 peak   128 spectrum    1 weight  0.10000E+01 volume  0.79042E-03 ppm1      8.948 ppm2      4.269 CV     1
 OR {  128}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 2    and name HA  ))
 ASSI {  129}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 34   and name HA2 ))
      4.900     3.000     1.100 peak   129 spectrum    1 weight  0.10000E+01 volume  0.46174E-03 ppm1      8.957 ppm2      3.793 CV     1
 OR {  129}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 133  and name HA2 ))
 ASSI {  132}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      3.800     1.900     1.900 peak   132 spectrum    1 weight  0.10000E+01 volume  0.97879E-03 ppm1      8.950 ppm2      1.781 CV     1
 OR {  132}
   (( segid "    " and resid 4    and name HN  ))
   (  segid "    " and resid 32   and name HB% )
 ASSI {  139}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
      3.900     1.900     1.900 peak   139 spectrum    1 weight  0.10000E+01 volume  0.91006E-03 ppm1      9.640 ppm2      8.526 CV     1
 OR {  139}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
 ASSI {  147}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.700     1.700     1.700 peak   147 spectrum    1 weight  0.10000E+01 volume  0.94543E-03 ppm1      9.638 ppm2      2.686 CV     1
 OR {  147}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI {  148}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      4.100     2.100     1.900 peak   148 spectrum    1 weight  0.10000E+01 volume  0.86271E-03 ppm1      9.637 ppm2      2.228 CV     1
 OR {  148}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
 ASSI {  151}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      3.300     1.400     1.400 peak   151 spectrum    1 weight  0.10000E+01 volume  0.34531E-02 ppm1      9.642 ppm2      0.673 CV     1
 OR {  151}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI {  152}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 65   and name HD2%)
      3.700     1.700     1.700 peak   152 spectrum    1 weight  0.10000E+01 volume  0.14671E-02 ppm1      9.634 ppm2      0.454 CV     1
 OR {  152}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
 ASSI {  158}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.700     1.700     1.700 peak   158 spectrum    1 weight  0.10000E+01 volume  0.15124E-02 ppm1      9.275 ppm2      8.868 CV     1
 OR {  158}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 141  and name HN  ))
 ASSI {  165}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 114  and name HD2%)
      3.000     1.100     1.100 peak   165 spectrum    1 weight  0.10000E+01 volume  0.37062E-02 ppm1      9.272 ppm2      0.780 CV     1
 OR {  165}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI {  177}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 92   and name HA  ))
      3.500     1.600     1.600 peak   177 spectrum    1 weight  0.10000E+01 volume  0.11821E-02 ppm1      9.169 ppm2      4.581 CV     1
 OR {  177}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  179}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HB  ))
      3.900     1.900     1.900 peak   179 spectrum    1 weight  0.10000E+01 volume  0.10190E-02 ppm1      9.169 ppm2      3.951 CV     1
 OR {  179}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 11   and name HB  ))
 ASSI {  180}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 74   and name HB2 ))
      4.500     2.500     1.500 peak   180 spectrum    1 weight  0.10000E+01 volume  0.58211E-03 ppm1      9.174 ppm2      2.895 CV     1
 OR {  180}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HE1 ))
 ASSI {  181}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HB1 ))
      2.500     0.800     0.800 peak   181 spectrum    1 weight  0.10000E+01 volume  0.46108E-02 ppm1      9.170 ppm2      1.877 CV     1
 OR {  181}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI {  183}
   (( segid "    " and resid 77   and name HE1 ))
   (( segid "    " and resid 86   and name HB1 ))
      2.800     1.000     1.000 peak   183 spectrum    1 weight  0.10000E+01 volume  0.27930E-02 ppm1      9.164 ppm2      1.278 CV     1
 OR {  183}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HG1 ))
 OR {  183}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HG2 ))
 ASSI {  202}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 123  and name HN  ))
      3.300     1.400     1.400 peak   202 spectrum    1 weight  0.10000E+01 volume  0.15642E-02 ppm1      9.543 ppm2      8.257 CV     1
 OR {  202}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
 ASSI {  204}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      3.100     1.200     1.200 peak   204 spectrum    1 weight  0.10000E+01 volume  0.30927E-02 ppm1      9.550 ppm2      7.427 CV     1
 OR {  204}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 128  and name HN  ))
 ASSI {  206}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 84   and name HD% )
      3.100     1.200     1.200 peak   206 spectrum    1 weight  0.10000E+01 volume  0.18789E-02 ppm1      9.544 ppm2      6.928 CV     1
 OR {  206}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 121  and name HH2 ))
 ASSI {  209}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      2.800     1.000     1.000 peak   209 spectrum    1 weight  0.10000E+01 volume  0.30328E-02 ppm1      9.545 ppm2      5.670 CV     1
 OR {  209}
   (( segid "    " and resid 121  and name HE1 ))
   (  segid "    " and resid 85   and name HE% )
 ASSI {  215}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      4.100     2.100     1.900 peak   215 spectrum    1 weight  0.10000E+01 volume  0.10688E-02 ppm1      9.549 ppm2      3.075 CV     1
 OR {  215}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 126  and name HE1 ))
 OR {  215}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HB1 ))
 OR {  215}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 71   and name HD2 ))
 ASSI {  216}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      2.800     1.000     1.000 peak   216 spectrum    1 weight  0.10000E+01 volume  0.32606E-02 ppm1      9.542 ppm2      2.721 CV     1
 OR {  216}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
 OR {  216}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 121  and name HB1 ))
 ASSI {  218}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 123  and name HB2 ))
      3.200     1.300     1.300 peak   218 spectrum    1 weight  0.10000E+01 volume  0.27312E-02 ppm1      9.542 ppm2      1.786 CV     1
 OR {  218}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 123  and name HB1 ))
 OR {  218}
   (( segid "    " and resid 121  and name HE1 ))
   (( segid "    " and resid 126  and name HB1 ))
 ASSI {  221}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 83   and name HG2%)
      3.300     1.300     1.300 peak   221 spectrum    1 weight  0.10000E+01 volume  0.25031E-02 ppm1      9.544 ppm2      0.851 CV     1
 OR {  221}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
 ASSI {  228}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HB  ))
      2.900     1.000     1.000 peak   228 spectrum    1 weight  0.10000E+01 volume  0.36138E-02 ppm1      7.658 ppm2      1.892 CV     1
 OR {  228}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HB1 ))
 OR {  228}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI {  246}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.500     1.500     1.500 peak   246 spectrum    1 weight  0.10000E+01 volume  0.23628E-02 ppm1      8.132 ppm2      8.505 CV     1
 OR {  246}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
 ASSI {  248}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.500     0.800     0.800 peak   248 spectrum    1 weight  0.10000E+01 volume  0.63751E-02 ppm1      8.121 ppm2      4.329 CV     1
 OR {  248}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
 ASSI {  252}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
      2.900     2.900     3.100 peak   252 spectrum    1 weight  0.10000E+01 volume  0.66947E-03 ppm1      8.030 ppm2      1.235 CV     1
 OR {  252}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 122  and name HB% )
 ASSI {  262}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 128  and name HA2 ))
      2.400     2.400     3.600 peak   262 spectrum    1 weight  0.10000E+01 volume  0.29549E-02 ppm1      8.028 ppm2      2.336 CV     1
 OR {  262}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
 OR {  262}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 5    and name HB  ))
 ASSI {  272}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      4.400     2.400     1.600 peak   272 spectrum    1 weight  0.10000E+01 volume  0.53604E-03 ppm1      9.002 ppm2      1.097 CV     1
 OR {  272}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 25   and name HG12))
 ASSI {  273}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      2.800     1.000     1.000 peak   273 spectrum    1 weight  0.10000E+01 volume  0.28419E-02 ppm1      8.993 ppm2      9.444 CV     1
 OR {  273}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
 ASSI {  274}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      4.000     2.000     2.000 peak   274 spectrum    1 weight  0.10000E+01 volume  0.10726E-02 ppm1      8.995 ppm2      8.573 CV     1
 OR {  274}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI {  278}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.200     1.300     1.300 peak   278 spectrum    1 weight  0.10000E+01 volume  0.13080E-02 ppm1      8.993 ppm2      5.004 CV     1
 OR {  278}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI {  282}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      3.300     1.300     1.300 peak   282 spectrum    1 weight  0.10000E+01 volume  0.12835E-02 ppm1      8.993 ppm2      2.163 CV     1
 OR {  282}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 24   and name HG1 ))
 ASSI {  283}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HB  ))
      4.400     2.400     1.600 peak   283 spectrum    1 weight  0.10000E+01 volume  0.11745E-02 ppm1      8.997 ppm2      1.488 CV     1
 OR {  283}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
 ASSI {  290}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      3.600     1.600     1.600 peak   290 spectrum    1 weight  0.10000E+01 volume  0.13770E-02 ppm1      8.505 ppm2      9.179 CV     1
 OR {  290}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
 OR {  290}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
 ASSI {  317}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      3.400     3.400     2.600 peak   317 spectrum    1 weight  0.10000E+01 volume  0.69807E-03 ppm1      8.898 ppm2      4.493 CV     1
 OR {  317}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
 OR {  317}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
 OR {  317}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
 OR {  317}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
 ASSI {  318}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 94   and name HA2 ))
      4.100     2.100     1.900 peak   318 spectrum    1 weight  0.10000E+01 volume  0.51912E-03 ppm1      8.902 ppm2      3.193 CV     1
 OR {  318}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 92   and name HB1 ))
 OR {  318}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 16   and name HD2 ))
 ASSI {  321}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      2.700     0.900     0.900 peak   321 spectrum    1 weight  0.10000E+01 volume  0.79954E-02 ppm1      8.898 ppm2      1.125 CV     1
 OR {  321}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 141  and name HG2%)
 OR {  321}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 30   and name HG2%)
 ASSI {  322}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      3.600     1.600     1.600 peak   322 spectrum    1 weight  0.10000E+01 volume  0.70014E-03 ppm1      8.849 ppm2      4.973 CV     1
 OR {  322}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
 ASSI {  323}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      4.400     2.400     1.600 peak   323 spectrum    1 weight  0.10000E+01 volume  0.45311E-03 ppm1      8.869 ppm2      2.754 CV     1
 OR {  323}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI {  340}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      3.000     1.100     1.100 peak   340 spectrum    1 weight  0.10000E+01 volume  0.34899E-02 ppm1      8.338 ppm2      1.159 CV     1
 OR {  340}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 141  and name HG2%)
 ASSI {  349}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 38   and name HG2 ))
      4.500     2.500     1.500 peak   349 spectrum    1 weight  0.10000E+01 volume  0.61072E-03 ppm1      9.114 ppm2      0.862 CV     1
 OR {  349}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 89   and name HG1%)
 OR {  349}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
 ASSI {  354}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
      3.900     1.900     1.900 peak   354 spectrum    1 weight  0.10000E+01 volume  0.11195E-02 ppm1      8.905 ppm2      9.442 CV     1
 OR {  354}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
 ASSI {  356}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      4.300     2.300     1.700 peak   356 spectrum    1 weight  0.10000E+01 volume  0.55499E-03 ppm1      8.899 ppm2      8.346 CV     1
 OR {  356}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
 ASSI {  359}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HG  ))
      2.500     0.800     0.800 peak   359 spectrum    1 weight  0.10000E+01 volume  0.39252E-02 ppm1      8.892 ppm2      1.354 CV     1
 OR {  359}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 5    and name HG1%)
 OR {  359}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 13   and name HB% )
 ASSI {  365}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 12   and name HG2%)
      2.800     2.800     3.200 peak   365 spectrum    1 weight  0.10000E+01 volume  0.77143E-02 ppm1      8.739 ppm2      0.948 CV     1
 OR {  365}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 10   and name HD2%)
 ASSI {  380}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 6    and name HN  ))
      3.900     1.900     1.900 peak   380 spectrum    1 weight  0.10000E+01 volume  0.12535E-02 ppm1      9.306 ppm2      9.004 CV     1
 OR {  380}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HN  ))
 OR {  380}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
 ASSI {  384}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HB  ))
      2.800     1.000     1.000 peak   384 spectrum    1 weight  0.10000E+01 volume  0.34059E-02 ppm1      9.304 ppm2      2.293 CV     1
 OR {  384}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HB2 ))
 OR {  384}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HG1 ))
 ASSI {  392}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 11   and name HG2%)
      3.100     1.200     1.200 peak   392 spectrum    1 weight  0.10000E+01 volume  0.35969E-02 ppm1      8.737 ppm2      1.192 CV     1
 OR {  392}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HG  ))
 ASSI {  402}
   (( segid "    " and resid 129  and name HN  ))
   (  segid "    " and resid 83   and name HG1%)
      4.200     2.200     1.800 peak   402 spectrum    1 weight  0.10000E+01 volume  0.11419E-02 ppm1      8.382 ppm2      1.127 CV     1
 OR {  402}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
 ASSI {  408}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
      4.000     2.000     2.000 peak   408 spectrum    1 weight  0.10000E+01 volume  0.73469E-03 ppm1      8.005 ppm2      2.864 CV     1
 OR {  408}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
 OR {  408}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI {  414}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      4.500     2.600     1.500 peak   414 spectrum    1 weight  0.10000E+01 volume  0.40580E-03 ppm1      8.003 ppm2      5.349 CV     1
 OR {  414}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
 ASSI {  415}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      3.400     1.400     1.400 peak   415 spectrum    1 weight  0.10000E+01 volume  0.23175E-02 ppm1      8.007 ppm2      1.134 CV     1
 OR {  415}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
 OR {  415}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 137  and name HG2%)
 ASSI {  420}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HD22))
      3.800     1.800     1.800 peak   420 spectrum    1 weight  0.10000E+01 volume  0.20018E-02 ppm1      9.298 ppm2      6.938 CV     1
 OR {  420}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 84   and name HD% )
 ASSI {  423}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HA  ))
      2.500     0.800     0.800 peak   423 spectrum    1 weight  0.10000E+01 volume  0.46487E-02 ppm1      9.303 ppm2      4.692 CV     1
 OR {  423}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI {  427}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 79   and name HG2%)
      3.700     3.700     2.300 peak   427 spectrum    1 weight  0.10000E+01 volume  0.18955E-02 ppm1      9.306 ppm2      1.274 CV     1
 OR {  427}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
 OR {  427}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 40   and name HG1%)
 ASSI {  430}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HA  ))
      3.400     1.400     1.400 peak   430 spectrum    1 weight  0.10000E+01 volume  0.12302E-02 ppm1      8.999 ppm2      4.672 CV     1
 OR {  430}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI {  433}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      3.000     1.100     1.100 peak   433 spectrum    1 weight  0.10000E+01 volume  0.53893E-02 ppm1      9.000 ppm2      1.737 CV     1
 OR {  433}
   (( segid "    " and resid 33   and name HN  ))
   (  segid "    " and resid 32   and name HB% )
 ASSI {  448}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      3.800     1.800     1.800 peak   448 spectrum    1 weight  0.10000E+01 volume  0.19126E-02 ppm1      9.451 ppm2      8.590 CV     1
 OR {  448}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
 OR {  448}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
 ASSI {  453}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      3.100     3.100     2.900 peak   453 spectrum    1 weight  0.10000E+01 volume  0.10964E-02 ppm1      9.455 ppm2      0.637 CV     1
 OR {  453}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
 ASSI {  454}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 19   and name HD2%)
      3.500     1.500     1.500 peak   454 spectrum    1 weight  0.10000E+01 volume  0.17586E-02 ppm1      9.451 ppm2      0.437 CV     1
 OR {  454}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
 ASSI {  459}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HB  ))
      2.900     1.100     1.100 peak   459 spectrum    1 weight  0.10000E+01 volume  0.27493E-02 ppm1      8.821 ppm2      1.926 CV     1
 OR {  459}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 139  and name HB1 ))
 ASSI {  469}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      4.900     3.000     1.100 peak   469 spectrum    1 weight  0.10000E+01 volume  0.39401E-03 ppm1      8.554 ppm2      3.676 CV     1
 OR {  469}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 94   and name HA1 ))
 ASSI {  471}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 30   and name HG2%)
      2.600     2.600     3.400 peak   471 spectrum    1 weight  0.10000E+01 volume  0.67306E-02 ppm1      8.547 ppm2      1.121 CV     1
 OR {  471}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI {  476}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      3.000     1.100     1.100 peak   476 spectrum    1 weight  0.10000E+01 volume  0.36882E-02 ppm1      8.175 ppm2      8.598 CV     1
 OR {  476}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI {  477}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      3.600     1.600     1.600 peak   477 spectrum    1 weight  0.10000E+01 volume  0.12224E-02 ppm1      8.175 ppm2      7.597 CV     1
 OR {  477}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI {  479}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      2.800     1.000     1.000 peak   479 spectrum    1 weight  0.10000E+01 volume  0.34578E-02 ppm1      9.438 ppm2      7.571 CV     1
 OR {  479}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI {  484}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HB1 ))
      3.100     1.200     1.200 peak   484 spectrum    1 weight  0.10000E+01 volume  0.57712E-02 ppm1      9.438 ppm2      2.303 CV     1
 OR {  484}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
 OR {  484}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
 ASSI {  486}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 49   and name HZ  ))
      4.900     3.000     1.100 peak   486 spectrum    1 weight  0.10000E+01 volume  0.56147E-03 ppm1      9.432 ppm2      7.188 CV     1
 OR {  486}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
 ASSI {  487}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 28   and name HG1%)
      3.700     1.700     1.700 peak   487 spectrum    1 weight  0.10000E+01 volume  0.10056E-02 ppm1      9.200 ppm2      0.663 CV     1
 OR {  487}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
 ASSI {  495}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      4.400     2.400     1.600 peak   495 spectrum    1 weight  0.10000E+01 volume  0.90915E-03 ppm1      8.775 ppm2      2.794 CV     1
 OR {  495}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI {  496}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 94   and name HA2 ))
      4.100     2.100     1.900 peak   496 spectrum    1 weight  0.10000E+01 volume  0.61151E-03 ppm1      8.531 ppm2      3.184 CV     1
 OR {  496}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 60   and name HB1 ))
 OR {  496}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 16   and name HD2 ))
 ASSI {  497}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 111  and name HB2 ))
      4.100     2.100     1.900 peak   497 spectrum    1 weight  0.10000E+01 volume  0.13219E-02 ppm1      8.529 ppm2      2.519 CV     1
 OR {  497}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
 OR {  497}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 100  and name HB  ))
 ASSI {  498}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 112  and name HE% )
      3.300     1.400     1.400 peak   498 spectrum    1 weight  0.10000E+01 volume  0.11430E-02 ppm1      8.501 ppm2      6.349 CV     1
 OR {  498}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 112  and name HE% )
 ASSI {  503}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
      2.300     2.300     3.700 peak   503 spectrum    1 weight  0.10000E+01 volume  0.14382E-01 ppm1      8.184 ppm2      1.550 CV     1
 OR {  503}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
 ASSI {  506}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 19   and name HD2%)
      4.100     2.100     1.900 peak   506 spectrum    1 weight  0.10000E+01 volume  0.71896E-03 ppm1      8.182 ppm2      0.409 CV     1
 OR {  506}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI {  509}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      2.900     1.000     1.000 peak   509 spectrum    1 weight  0.10000E+01 volume  0.24401E-02 ppm1      7.596 ppm2      4.365 CV     1
 OR {  509}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  510}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 17   and name HA1 ))
      3.200     1.300     1.300 peak   510 spectrum    1 weight  0.10000E+01 volume  0.18299E-02 ppm1      7.597 ppm2      3.750 CV     1
 OR {  510}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
 OR {  510}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 17   and name HA2 ))
 ASSI {  519}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      3.900     1.900     1.900 peak   519 spectrum    1 weight  0.10000E+01 volume  0.11704E-02 ppm1      9.203 ppm2      8.516 CV     1
 OR {  519}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
 OR {  519}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
 ASSI {  522}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      4.200     2.200     1.800 peak   522 spectrum    1 weight  0.10000E+01 volume  0.10335E-02 ppm1      9.198 ppm2      4.329 CV     1
 OR {  522}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HA1 ))
 ASSI {  525}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HG12))
      2.700     0.900     0.900 peak   525 spectrum    1 weight  0.10000E+01 volume  0.64953E-02 ppm1      9.198 ppm2      1.100 CV     1
 OR {  525}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI {  527}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      3.900     1.900     1.900 peak   527 spectrum    1 weight  0.10000E+01 volume  0.94940E-03 ppm1      9.204 ppm2      0.120 CV     1
 OR {  527}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
 ASSI {  529}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 79   and name HB  ))
      3.500     3.500     2.500 peak   529 spectrum    1 weight  0.10000E+01 volume  0.55458E-03 ppm1      9.171 ppm2      4.095 CV     1
 OR {  529}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 127  and name HA  ))
 OR {  529}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI {  534}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      2.300     0.600     0.600 peak   534 spectrum    1 weight  0.10000E+01 volume  0.77688E-02 ppm1      9.163 ppm2      5.619 CV     1
 OR {  534}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 85   and name HE% )
 ASSI {  536}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HB1 ))
      3.300     1.300     1.300 peak   536 spectrum    1 weight  0.10000E+01 volume  0.18910E-02 ppm1      9.163 ppm2      2.720 CV     1
 OR {  536}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
 OR {  536}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
 ASSI {  541}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 65   and name HD2%)
      3.800     1.800     1.800 peak   541 spectrum    1 weight  0.10000E+01 volume  0.17436E-02 ppm1      8.520 ppm2      0.486 CV     1
 OR {  541}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
 ASSI {  544}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
      2.900     1.000     1.000 peak   544 spectrum    1 weight  0.10000E+01 volume  0.27313E-02 ppm1      8.513 ppm2      1.559 CV     1
 OR {  544}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI {  545}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      2.500     0.800     0.800 peak   545 spectrum    1 weight  0.10000E+01 volume  0.50446E-02 ppm1      8.513 ppm2      0.676 CV     1
 OR {  545}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
 OR {  545}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI {  547}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
      4.900     3.000     1.100 peak   547 spectrum    1 weight  0.10000E+01 volume  0.72767E-03 ppm1      8.494 ppm2      7.228 CV     1
 OR {  547}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 66   and name HD% )
 ASSI {  548}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 112  and name HD% )
      3.100     1.200     1.200 peak   548 spectrum    1 weight  0.10000E+01 volume  0.21025E-02 ppm1      8.506 ppm2      6.757 CV     1
 OR {  548}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 112  and name HD% )
 ASSI {  550}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
      4.200     2.200     1.800 peak   550 spectrum    1 weight  0.10000E+01 volume  0.10468E-02 ppm1      8.506 ppm2      2.930 CV     1
 OR {  550}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 61   and name HB2 ))
 OR {  550}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
 ASSI {  556}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      2.700     2.700     3.300 peak   556 spectrum    1 weight  0.10000E+01 volume  0.11118E-01 ppm1      8.497 ppm2      4.449 CV     1
 OR {  556}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  557}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.400     0.700     0.700 peak   557 spectrum    1 weight  0.10000E+01 volume  0.72738E-02 ppm1      8.499 ppm2      4.291 CV     1
 OR {  557}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
 ASSI {  558}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 113  and name HB  ))
      3.200     3.200     2.800 peak   558 spectrum    1 weight  0.10000E+01 volume  0.37577E-02 ppm1      8.501 ppm2      3.840 CV     1
 OR {  558}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 110  and name HA2 ))
 OR {  558}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 113  and name HB  ))
 ASSI {  560}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      3.100     1.200     1.200 peak   560 spectrum    1 weight  0.10000E+01 volume  0.77961E-02 ppm1      8.506 ppm2      2.703 CV     1
 OR {  560}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
 ASSI {  563}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
      4.000     2.000     2.000 peak   563 spectrum    1 weight  0.10000E+01 volume  0.11754E-02 ppm1      8.419 ppm2      8.778 CV     1
 OR {  563}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI {  567}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      4.500     2.600     1.500 peak   567 spectrum    1 weight  0.10000E+01 volume  0.99646E-03 ppm1      8.412 ppm2      7.883 CV     1
 OR {  567}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  568}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      2.600     0.900     0.900 peak   568 spectrum    1 weight  0.10000E+01 volume  0.45567E-02 ppm1      8.413 ppm2      5.276 CV     1
 OR {  568}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI {  570}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      4.700     2.700     1.300 peak   570 spectrum    1 weight  0.10000E+01 volume  0.72759E-03 ppm1      8.413 ppm2      3.999 CV     1
 OR {  570}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 52   and name HA1 ))
 OR {  570}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 138  and name HB  ))
 ASSI {  572}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HB2 ))
      3.400     1.500     1.500 peak   572 spectrum    1 weight  0.10000E+01 volume  0.21871E-02 ppm1      8.413 ppm2      1.477 CV     1
 OR {  572}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 44   and name HB% )
 ASSI {  575}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 137  and name HN  ))
      4.000     2.000     2.000 peak   575 spectrum    1 weight  0.10000E+01 volume  0.14632E-02 ppm1      8.405 ppm2      9.441 CV     1
 OR {  575}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  577}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.600     0.900     0.900 peak   577 spectrum    1 weight  0.10000E+01 volume  0.33455E-02 ppm1      8.406 ppm2      7.579 CV     1
 OR {  577}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI {  578}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
      2.800     0.900     0.900 peak   578 spectrum    1 weight  0.10000E+01 volume  0.30771E-02 ppm1      8.405 ppm2      7.205 CV     1
 OR {  578}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HZ  ))
 ASSI {  579}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      2.200     0.600     0.600 peak   579 spectrum    1 weight  0.10000E+01 volume  0.80933E-02 ppm1      8.405 ppm2      5.100 CV     1
 OR {  579}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI {  581}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HB2 ))
      3.200     1.300     1.300 peak   581 spectrum    1 weight  0.10000E+01 volume  0.39368E-02 ppm1      8.409 ppm2      2.549 CV     1
 OR {  581}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
 ASSI {  582}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      3.600     1.600     1.600 peak   582 spectrum    1 weight  0.10000E+01 volume  0.19207E-02 ppm1      8.398 ppm2      6.934 CV     1
 OR {  582}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 49   and name HE% )
 OR {  582}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 55   and name HZ  ))
 ASSI {  583}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      3.200     1.200     1.200 peak   583 spectrum    1 weight  0.10000E+01 volume  0.22585E-02 ppm1      8.398 ppm2      6.592 CV     1
 OR {  583}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 55   and name HD% )
 ASSI {  588}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      4.400     2.400     1.600 peak   588 spectrum    1 weight  0.10000E+01 volume  0.50851E-03 ppm1      8.147 ppm2      2.696 CV     1
 OR {  588}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
 OR {  588}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI {  594}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      2.500     0.800     0.800 peak   594 spectrum    1 weight  0.10000E+01 volume  0.40999E-02 ppm1      7.962 ppm2      2.695 CV     1
 OR {  594}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
 ASSI {  596}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
      2.800     2.800     3.200 peak   596 spectrum    1 weight  0.10000E+01 volume  0.75236E-03 ppm1      7.965 ppm2      2.101 CV     1
 OR {  596}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI {  605}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 140  and name HB1 ))
      3.900     1.900     1.900 peak   605 spectrum    1 weight  0.10000E+01 volume  0.11733E-02 ppm1      9.472 ppm2      1.711 CV     1
 OR {  605}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI {  609}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      3.400     1.500     1.500 peak   609 spectrum    1 weight  0.10000E+01 volume  0.30941E-02 ppm1      9.474 ppm2      2.713 CV     1
 OR {  609}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HB1 ))
 ASSI {  610}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 139  and name HG1 ))
      4.000     2.000     2.000 peak   610 spectrum    1 weight  0.10000E+01 volume  0.98110E-03 ppm1      9.470 ppm2      1.229 CV     1
 OR {  610}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 141  and name HG2%)
 ASSI {  616}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 122  and name HN  ))
      4.200     2.200     1.800 peak   616 spectrum    1 weight  0.10000E+01 volume  0.67042E-03 ppm1      9.087 ppm2      7.676 CV     1
 OR {  616}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
 ASSI {  617}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 43   and name HZ% )
      4.700     2.800     1.300 peak   617 spectrum    1 weight  0.10000E+01 volume  0.73498E-03 ppm1      9.087 ppm2      6.867 CV     1
 OR {  617}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HE3 ))
 ASSI {  623}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      2.500     0.800     0.800 peak   623 spectrum    1 weight  0.10000E+01 volume  0.40854E-02 ppm1      9.087 ppm2      2.777 CV     1
 OR {  623}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI {  626}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 122  and name HB% )
      3.600     1.700     1.700 peak   626 spectrum    1 weight  0.10000E+01 volume  0.70361E-03 ppm1      9.087 ppm2      1.258 CV     1
 OR {  626}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
 ASSI {  633}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HB  ))
      2.800     1.000     1.000 peak   633 spectrum    1 weight  0.10000E+01 volume  0.40989E-02 ppm1      8.574 ppm2      1.531 CV     1
 OR {  633}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 98   and name HB  ))
 ASSI {  635}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
      3.200     1.300     1.300 peak   635 spectrum    1 weight  0.10000E+01 volume  0.32309E-02 ppm1      8.582 ppm2      0.520 CV     1
 OR {  635}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI {  636}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
      4.600     2.600     1.400 peak   636 spectrum    1 weight  0.10000E+01 volume  0.50665E-03 ppm1      8.572 ppm2      2.501 CV     1
 OR {  636}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
 OR {  636}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 100  and name HB  ))
 ASSI {  637}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HA  ))
      2.200     0.600     0.600 peak   637 spectrum    1 weight  0.10000E+01 volume  0.17885E-01 ppm1      8.281 ppm2      4.259 CV     1
 OR {  637}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 1    and name HA  ))
 ASSI {  639}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HB1 ))
      2.300     0.600     0.600 peak   639 spectrum    1 weight  0.10000E+01 volume  0.13179E-01 ppm1      8.280 ppm2      1.967 CV     1
 OR {  639}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 1    and name HB2 ))
 ASSI {  642}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 33   and name HB2 ))
      2.400     2.400     3.600 peak   642 spectrum    1 weight  0.10000E+01 volume  0.17027E-01 ppm1      8.239 ppm2      1.597 CV     1
 OR {  642}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 OR {  642}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 33   and name HG  ))
 ASSI {  651}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 24   and name HG2 ))
      5.300     3.500     0.700 peak   651 spectrum    1 weight  0.10000E+01 volume  0.49666E-03 ppm1      7.661 ppm2      2.105 CV     1
 OR {  651}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
 ASSI {  659}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      4.700     2.700     1.300 peak   659 spectrum    1 weight  0.10000E+01 volume  0.48155E-03 ppm1      9.476 ppm2      4.297 CV     1
 OR {  659}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 110  and name HA1 ))
 ASSI {  660}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 113  and name HN  ))
      4.500     2.500     1.500 peak   660 spectrum    1 weight  0.10000E+01 volume  0.49129E-03 ppm1      9.470 ppm2      8.726 CV     1
 OR {  660}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
 ASSI {  679}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 10   and name HB1 ))
      4.500     2.500     1.500 peak   679 spectrum    1 weight  0.10000E+01 volume  0.37446E-03 ppm1      9.406 ppm2      1.895 CV     1
 OR {  679}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 139  and name HB1 ))
 ASSI {  680}
   (( segid "    " and resid 137  and name HN  ))
   (  segid "    " and resid 137  and name HG2%)
      3.500     1.500     1.500 peak   680 spectrum    1 weight  0.10000E+01 volume  0.25438E-02 ppm1      9.410 ppm2      1.083 CV     1
 OR {  680}
   (( segid "    " and resid 137  and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI {  684}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      4.000     2.000     2.000 peak   684 spectrum    1 weight  0.10000E+01 volume  0.10516E-02 ppm1      8.991 ppm2      8.499 CV     1
 OR {  684}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
 OR {  684}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
 OR {  684}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
 ASSI {  688}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      4.200     2.200     1.800 peak   688 spectrum    1 weight  0.10000E+01 volume  0.15585E-02 ppm1      8.993 ppm2      4.310 CV     1
 OR {  688}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 97   and name HA1 ))
 OR {  688}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
 ASSI {  689}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
      3.900     1.900     1.900 peak   689 spectrum    1 weight  0.10000E+01 volume  0.98255E-03 ppm1      8.991 ppm2      3.579 CV     1
 OR {  689}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HD1 ))
 OR {  689}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HB2 ))
 ASSI {  691}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HB  ))
      3.100     1.200     1.200 peak   691 spectrum    1 weight  0.10000E+01 volume  0.25364E-02 ppm1      8.991 ppm2      2.021 CV     1
 OR {  691}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HB1 ))
 ASSI {  692}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HB  ))
      2.600     0.800     0.800 peak   692 spectrum    1 weight  0.10000E+01 volume  0.64358E-02 ppm1      8.994 ppm2      1.695 CV     1
 OR {  692}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HB2 ))
 OR {  692}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HG12))
 ASSI {  696}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      4.000     2.000     2.000 peak   696 spectrum    1 weight  0.10000E+01 volume  0.13222E-02 ppm1      8.987 ppm2      7.974 CV     1
 OR {  696}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
 ASSI {  700}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      3.500     1.500     1.500 peak   700 spectrum    1 weight  0.10000E+01 volume  0.94172E-03 ppm1      8.987 ppm2      2.709 CV     1
 OR {  700}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI {  702}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      5.400     3.600     0.600 peak   702 spectrum    1 weight  0.10000E+01 volume  0.42949E-03 ppm1      8.896 ppm2      3.115 CV     1
 OR {  702}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 129  and name HB1 ))
 ASSI {  705}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 117  and name HB  ))
      3.800     1.800     1.800 peak   705 spectrum    1 weight  0.10000E+01 volume  0.68907E-03 ppm1      8.885 ppm2      3.927 CV     1
 OR {  705}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
 ASSI {  707}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 83   and name HB  ))
      4.800     2.900     1.200 peak   707 spectrum    1 weight  0.10000E+01 volume  0.42875E-03 ppm1      8.893 ppm2      2.176 CV     1
 OR {  707}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
 OR {  707}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 82   and name HA2 ))
 ASSI {  709}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 41   and name HB% )
      3.900     1.900     1.900 peak   709 spectrum    1 weight  0.10000E+01 volume  0.10511E-02 ppm1      8.889 ppm2      1.479 CV     1
 OR {  709}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 117  and name HG2%)
 OR {  709}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 44   and name HB% )
 ASSI {  710}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HB2 ))
      3.600     1.600     1.600 peak   710 spectrum    1 weight  0.10000E+01 volume  0.24013E-02 ppm1      8.885 ppm2      1.231 CV     1
 OR {  710}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
 ASSI {  714}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      5.000     3.200     1.000 peak   714 spectrum    1 weight  0.10000E+01 volume  0.40338E-03 ppm1      8.891 ppm2      5.665 CV     1
 OR {  714}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
 OR {  714}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
 ASSI {  718}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 74   and name HD21))
      4.000     2.000     2.000 peak   718 spectrum    1 weight  0.10000E+01 volume  0.52135E-03 ppm1      8.771 ppm2      7.641 CV     1
 OR {  718}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 92   and name HZ2 ))
 ASSI {  725}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      4.500     2.500     1.500 peak   725 spectrum    1 weight  0.10000E+01 volume  0.58327E-03 ppm1      8.763 ppm2      1.521 CV     1
 OR {  725}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
 ASSI {  728}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      4.200     2.200     1.800 peak   728 spectrum    1 weight  0.10000E+01 volume  0.70022E-03 ppm1      8.763 ppm2      8.587 CV     1
 OR {  728}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
 ASSI {  730}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HD2 ))
      4.800     2.800     1.200 peak   730 spectrum    1 weight  0.10000E+01 volume  0.51152E-03 ppm1      8.758 ppm2      3.147 CV     1
 OR {  730}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI {  732}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.700     2.700     3.300 peak   732 spectrum    1 weight  0.10000E+01 volume  0.15373E-02 ppm1      8.639 ppm2      1.863 CV     1
 OR {  732}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 16   and name HG1 ))
 ASSI {  739}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
      3.000     1.100     1.100 peak   739 spectrum    1 weight  0.10000E+01 volume  0.57534E-02 ppm1      8.625 ppm2      2.550 CV     1
 OR {  739}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 100  and name HB  ))
 ASSI {  746}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      2.800     1.000     1.000 peak   746 spectrum    1 weight  0.10000E+01 volume  0.31368E-02 ppm1      8.569 ppm2      3.723 CV     1
 OR {  746}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 17   and name HA2 ))
 OR {  746}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 17   and name HA1 ))
 ASSI {  749}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 43   and name HB1 ))
      3.800     3.800     2.200 peak   749 spectrum    1 weight  0.10000E+01 volume  0.98213E-03 ppm1      7.683 ppm2      0.774 CV     1
 OR {  749}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 114  and name HD2%)
 ASSI {  750}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 109  and name HG1 ))
      3.600     1.700     1.700 peak   750 spectrum    1 weight  0.10000E+01 volume  0.85829E-03 ppm1      7.216 ppm2      1.889 CV     1
 OR {  750}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 16   and name HG1 ))
 ASSI {  756}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      2.800     2.800     3.200 peak   756 spectrum    1 weight  0.10000E+01 volume  0.76099E-03 ppm1      7.217 ppm2      4.521 CV     1
 OR {  756}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 104  and name HA  ))
 ASSI {  769}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 92   and name HH2 ))
      4.000     2.000     2.000 peak   769 spectrum    1 weight  0.10000E+01 volume  0.56110E-03 ppm1      8.767 ppm2      6.790 CV     1
 OR {  769}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 74   and name HD22))
 ASSI {  772}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 106  and name HD21))
      4.200     2.200     1.800 peak   772 spectrum    1 weight  0.10000E+01 volume  0.47821E-03 ppm1      8.575 ppm2      7.620 CV     1
 OR {  772}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
 OR {  772}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
 ASSI {  776}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      4.600     2.600     1.400 peak   776 spectrum    1 weight  0.10000E+01 volume  0.46087E-03 ppm1      8.572 ppm2      2.562 CV     1
 OR {  776}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 OR {  776}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
 OR {  776}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 OR {  776}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
 ASSI {  778}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
      2.900     1.100     1.100 peak   778 spectrum    1 weight  0.10000E+01 volume  0.44283E-02 ppm1      8.578 ppm2      0.695 CV     1
 OR {  778}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
 OR {  778}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
 ASSI {  779}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
      2.200     0.600     0.600 peak   779 spectrum    1 weight  0.10000E+01 volume  0.84235E-02 ppm1      8.345 ppm2      7.976 CV     1
 OR {  779}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI {  780}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      2.800     1.000     1.000 peak   780 spectrum    1 weight  0.10000E+01 volume  0.53460E-02 ppm1      8.349 ppm2      4.476 CV     1
 OR {  780}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI {  782}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HB1 ))
      2.400     0.700     0.700 peak   782 spectrum    1 weight  0.10000E+01 volume  0.99943E-02 ppm1      8.349 ppm2      1.754 CV     1
 OR {  782}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HB2 ))
 OR {  782}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HB  ))
 OR {  782}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI {  820}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      3.200     3.200     2.800 peak   820 spectrum    1 weight  0.10000E+01 volume  0.38006E-03 ppm1      9.054 ppm2      2.777 CV     1
 OR {  820}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 OR {  820}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
 OR {  820}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
 OR {  820}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
 ASSI {  822}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
      4.100     2.100     1.900 peak   822 spectrum    1 weight  0.10000E+01 volume  0.99691E-03 ppm1      9.026 ppm2      7.674 CV     1
 OR {  822}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI {  826}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 119  and name HA2 ))
      2.200     0.600     0.600 peak   826 spectrum    1 weight  0.10000E+01 volume  0.43284E-02 ppm1      9.019 ppm2      4.019 CV     1
 OR {  826}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
 ASSI {  838}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.300     1.300     1.300 peak   838 spectrum    1 weight  0.10000E+01 volume  0.29843E-02 ppm1      8.570 ppm2      1.468 CV     1
 OR {  838}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 98   and name HB  ))
 OR {  838}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
 ASSI {  840}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HG12))
      4.100     2.100     1.900 peak   840 spectrum    1 weight  0.10000E+01 volume  0.14260E-02 ppm1      8.568 ppm2      0.108 CV     1
 OR {  840}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
 ASSI {  845}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 8    and name HN  ))
      2.900     2.900     3.100 peak   845 spectrum    1 weight  0.10000E+01 volume  0.10910E-02 ppm1      8.361 ppm2      8.743 CV     1
 OR {  845}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
 OR {  845}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
 ASSI {  846}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
      2.000     0.500     0.500 peak   846 spectrum    1 weight  0.10000E+01 volume  0.18704E-01 ppm1      8.365 ppm2      4.056 CV     1
 OR {  846}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI {  849}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 4    and name HN  ))
      3.900     1.900     1.900 peak   849 spectrum    1 weight  0.10000E+01 volume  0.82980E-03 ppm1      8.294 ppm2      8.938 CV     1
 OR {  849}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
 ASSI {  850}
   (( segid "    " and resid 3    and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      3.900     1.900     1.900 peak   850 spectrum    1 weight  0.10000E+01 volume  0.13857E-02 ppm1      8.282 ppm2      6.669 CV     1
 OR {  850}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 55   and name HD% )
 OR {  850}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 66   and name HE% )
 ASSI {  852}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 121  and name HZ2 ))
      4.600     2.700     1.400 peak   852 spectrum    1 weight  0.10000E+01 volume  0.47519E-03 ppm1      8.286 ppm2      7.196 CV     1
 OR {  852}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
 ASSI {  870}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
      4.100     2.100     1.900 peak   870 spectrum    1 weight  0.10000E+01 volume  0.99906E-03 ppm1      7.565 ppm2      7.218 CV     1
 OR {  870}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 66   and name HD% )
 ASSI {  871}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      4.000     2.000     2.000 peak   871 spectrum    1 weight  0.10000E+01 volume  0.81383E-03 ppm1      7.561 ppm2      6.612 CV     1
 OR {  871}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 66   and name HE% )
 ASSI {  878}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
      3.100     1.200     1.200 peak   878 spectrum    1 weight  0.10000E+01 volume  0.40983E-02 ppm1      7.561 ppm2      2.244 CV     1
 OR {  878}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
 OR {  878}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
 OR {  878}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
 ASSI {  882}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 84   and name HE% )
      4.900     3.000     1.100 peak   882 spectrum    1 weight  0.10000E+01 volume  0.39502E-03 ppm1      9.249 ppm2      6.270 CV     1
 OR {  882}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HZ3 ))
 OR {  882}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 87   and name HD22))
 ASSI {  887}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 117  and name HG2%)
      3.600     1.600     1.600 peak   887 spectrum    1 weight  0.10000E+01 volume  0.22541E-02 ppm1      9.056 ppm2      1.421 CV     1
 OR {  887}
   (( segid "    " and resid 132  and name HN  ))
   (  segid "    " and resid 117  and name HG2%)
 ASSI {  891}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      3.100     1.200     1.200 peak   891 spectrum    1 weight  0.10000E+01 volume  0.18765E-02 ppm1      8.720 ppm2      5.150 CV     1
 OR {  891}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 141  and name HA  ))
 ASSI {  893}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 13   and name HB% )
      2.700     2.700     3.300 peak   893 spectrum    1 weight  0.10000E+01 volume  0.79356E-02 ppm1      8.723 ppm2      1.368 CV     1
 OR {  893}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HB2 ))
 ASSI {  895}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      3.500     1.500     1.500 peak   895 spectrum    1 weight  0.10000E+01 volume  0.17436E-02 ppm1      8.721 ppm2      8.354 CV     1
 OR {  895}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
 ASSI {  898}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      3.500     3.500     2.500 peak   898 spectrum    1 weight  0.10000E+01 volume  0.29149E-02 ppm1      8.721 ppm2      1.182 CV     1
 OR {  898}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 141  and name HG2%)
 ASSI {  899}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 140  and name HG  ))
      3.900     1.900     1.900 peak   899 spectrum    1 weight  0.10000E+01 volume  0.11424E-02 ppm1      8.719 ppm2      0.411 CV     1
 OR {  899}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI {  901}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 3    and name HB2 ))
      2.500     0.800     0.800 peak   901 spectrum    1 weight  0.10000E+01 volume  0.81837E-02 ppm1      8.299 ppm2      2.336 CV     1
 OR {  901}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 2    and name HG1 ))
 OR {  901}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 2    and name HG2 ))
 ASSI {  903}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 3    and name HB1 ))
      3.000     1.100     1.100 peak   903 spectrum    1 weight  0.10000E+01 volume  0.38394E-02 ppm1      8.288 ppm2      2.896 CV     1
 OR {  903}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
 ASSI {  904}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 12   and name HG1%)
      3.800     1.800     1.800 peak   904 spectrum    1 weight  0.10000E+01 volume  0.11382E-02 ppm1      8.723 ppm2      0.851 CV     1
 OR {  904}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI {  905}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 121  and name HN  ))
      3.900     1.900     1.900 peak   905 spectrum    1 weight  0.10000E+01 volume  0.77003E-03 ppm1      8.213 ppm2      9.110 CV     1
 OR {  905}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
 ASSI {  910}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      3.600     1.600     1.600 peak   910 spectrum    1 weight  0.10000E+01 volume  0.15646E-02 ppm1      8.201 ppm2      2.758 CV     1
 OR {  910}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
 OR {  910}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 86   and name HE1 ))
 ASSI {  929}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 49   and name HE% )
      3.200     1.300     1.300 peak   929 spectrum    1 weight  0.10000E+01 volume  0.14233E-02 ppm1      7.435 ppm2      6.927 CV     1
 OR {  929}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 84   and name HD% )
 OR {  929}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 121  and name HE3 ))
 ASSI {  931}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.300     1.300     1.300 peak   931 spectrum    1 weight  0.10000E+01 volume  0.11274E-02 ppm1      7.429 ppm2      4.654 CV     1
 OR {  931}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI {  934}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HA2 ))
      2.700     0.900     0.900 peak   934 spectrum    1 weight  0.10000E+01 volume  0.74650E-02 ppm1      7.431 ppm2      2.239 CV     1
 OR {  934}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HB  ))
 ASSI {  948}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
      2.800     1.000     1.000 peak   948 spectrum    1 weight  0.10000E+01 volume  0.21170E-02 ppm1      8.919 ppm2      1.515 CV     1
 OR {  948}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI {  949}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 114  and name HD2%)
      3.400     3.400     2.600 peak   949 spectrum    1 weight  0.10000E+01 volume  0.33534E-02 ppm1      8.918 ppm2      0.815 CV     1
 OR {  949}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 64   and name HG1 ))
 ASSI {  950}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      3.300     1.300     1.300 peak   950 spectrum    1 weight  0.10000E+01 volume  0.25461E-02 ppm1      8.921 ppm2      0.646 CV     1
 OR {  950}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
 OR {  950}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
 OR {  950}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
 ASSI {  951}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
      3.500     1.500     1.500 peak   951 spectrum    1 weight  0.10000E+01 volume  0.21632E-02 ppm1      8.919 ppm2      0.464 CV     1
 OR {  951}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 65   and name HD2%)
 ASSI {  957}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      3.200     1.300     1.300 peak   957 spectrum    1 weight  0.10000E+01 volume  0.19409E-02 ppm1      8.609 ppm2      4.309 CV     1
 OR {  957}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  961}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
      4.300     2.300     1.700 peak   961 spectrum    1 weight  0.10000E+01 volume  0.13447E-02 ppm1      8.615 ppm2      0.851 CV     1
 OR {  961}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HG2 ))
 OR {  961}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 89   and name HG1%)
 ASSI {  963}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      3.800     1.800     1.800 peak   963 spectrum    1 weight  0.10000E+01 volume  0.12378E-02 ppm1      8.540 ppm2      9.475 CV     1
 OR {  963}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
 ASSI {  966}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 112  and name HD% )
      3.600     1.600     1.600 peak   966 spectrum    1 weight  0.10000E+01 volume  0.10929E-02 ppm1      8.541 ppm2      6.790 CV     1
 OR {  966}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HD22))
 ASSI {  972}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 55   and name HD% )
      4.200     2.200     1.800 peak   972 spectrum    1 weight  0.10000E+01 volume  0.44795E-03 ppm1      8.379 ppm2      6.600 CV     1
 OR {  972}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 66   and name HE% )
 OR {  972}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
 ASSI {  973}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      4.300     2.300     1.700 peak   973 spectrum    1 weight  0.10000E+01 volume  0.47078E-03 ppm1      8.383 ppm2      8.772 CV     1
 OR {  973}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI {  981}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
      2.900     1.000     1.000 peak   981 spectrum    1 weight  0.10000E+01 volume  0.25243E-02 ppm1      8.372 ppm2      2.232 CV     1
 OR {  981}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 82   and name HA2 ))
 ASSI {  989}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      3.900     1.900     1.900 peak   989 spectrum    1 weight  0.10000E+01 volume  0.96835E-03 ppm1      9.169 ppm2      8.828 CV     1
 OR {  989}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI {  993}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      4.000     2.000     2.000 peak   993 spectrum    1 weight  0.10000E+01 volume  0.80210E-03 ppm1      9.167 ppm2      2.717 CV     1
 OR {  993}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 85   and name HB1 ))
 ASSI {  999}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
      4.900     3.000     1.100 peak   999 spectrum    1 weight  0.10000E+01 volume  0.51247E-03 ppm1      8.912 ppm2      3.034 CV     1
 OR {  999}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
 ASSI { 1003}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      2.200     2.200     3.800 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.73391E-02 ppm1      8.087 ppm2      4.432 CV     1
 OR { 1003}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 1004}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 126  and name HA  ))
      4.500     2.500     1.500 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.76664E-03 ppm1      8.085 ppm2      4.077 CV     1
 OR { 1004}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
 OR { 1004}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 127  and name HA  ))
 ASSI { 1009}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 42   and name HB2 ))
      3.700     1.700     1.700 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.31109E-02 ppm1      8.084 ppm2      1.270 CV     1
 OR { 1009}
   (( segid "    " and resid 124  and name HN  ))
   (  segid "    " and resid 122  and name HB% )
 ASSI { 1010}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 54   and name HZ  ))
      3.800     1.800     1.800 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.90411E-03 ppm1      8.081 ppm2      6.795 CV     1
 OR { 1010}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HD22))
 OR { 1010}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 92   and name HH2 ))
 ASSI { 1011}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 124  and name HB1 ))
      2.300     2.300     3.700 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.11136E-01 ppm1      8.077 ppm2      2.624 CV     1
 OR { 1011}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 1012}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      3.300     3.300     2.700 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.19398E-02 ppm1      8.079 ppm2      2.121 CV     1
 OR { 1012}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 82   and name HA2 ))
 OR { 1012}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 24   and name HG2 ))
 OR { 1012}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 27   and name HG1 ))
 ASSI { 1015}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 98   and name HG2%)
      4.200     2.200     1.800 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.11843E-02 ppm1      8.048 ppm2      0.510 CV     1
 OR { 1015}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 116  and name HD2%)
 OR { 1015}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 98   and name HD1%)
 OR { 1015}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 1017}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 121  and name HZ2 ))
      3.600     1.600     1.600 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.74142E-03 ppm1      8.056 ppm2      7.293 CV     1
 OR { 1017}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 54   and name HE% )
 OR { 1017}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 1026}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 122  and name HN  ))
      4.900     3.100     1.100 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.64602E-03 ppm1      7.962 ppm2      7.662 CV     1
 OR { 1026}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 122  and name HN  ))
 ASSI { 1028}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 121  and name HE3 ))
      5.100     3.300     0.900 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.42355E-03 ppm1      7.959 ppm2      6.810 CV     1
 OR { 1028}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 121  and name HE3 ))
 ASSI { 1029}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HA  ))
      2.100     0.500     0.500 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.10891E-01 ppm1      7.961 ppm2      4.061 CV     1
 OR { 1029}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 1030}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HB2 ))
      3.200     1.300     1.300 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.53055E-02 ppm1      7.961 ppm2      2.242 CV     1
 OR { 1030}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HG2 ))
 OR { 1030}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HG1 ))
 ASSI { 1032}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 16   and name HN  ))
      3.800     1.800     1.800 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.17485E-02 ppm1      7.293 ppm2      8.588 CV     1
 OR { 1032}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 111  and name HN  ))
 ASSI { 1033}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 17   and name HN  ))
      4.900     3.000     1.100 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.58892E-03 ppm1      7.295 ppm2      8.284 CV     1
 OR { 1033}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 1035}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 15   and name HA  ))
      4.700     2.800     1.300 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.46207E-03 ppm1      7.293 ppm2      5.096 CV     1
 OR { 1035}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 141  and name HA  ))
 OR { 1035}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 1038}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 16   and name HA  ))
      3.900     1.900     1.900 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.22056E-02 ppm1      7.293 ppm2      3.703 CV     1
 OR { 1038}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 1039}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 109  and name HG2 ))
      3.400     1.500     1.500 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.28759E-02 ppm1      7.293 ppm2      2.077 CV     1
 OR { 1039}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 16   and name HB1 ))
 ASSI { 1040}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 16   and name HG2 ))
      2.400     0.700     0.700 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.76297E-02 ppm1      7.292 ppm2      1.755 CV     1
 OR { 1040}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 16   and name HG1 ))
 OR { 1040}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 109  and name HG1 ))
 OR { 1040}
   (( segid "    " and resid 16   and name HE  ))
   (( segid "    " and resid 16   and name HB2 ))
 ASSI { 1048}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 98   and name HG2%)
      3.500     1.500     1.500 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.41090E-02 ppm1      9.429 ppm2      0.530 CV     1
 OR { 1048}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
 ASSI { 1050}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      3.600     1.600     1.600 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.19662E-02 ppm1      9.431 ppm2      8.579 CV     1
 OR { 1050}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 1067}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HB2 ))
      4.100     2.100     1.900 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.17796E-02 ppm1      8.498 ppm2      2.951 CV     1
 OR { 1067}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
 ASSI { 1070}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      2.100     0.600     0.600 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.75768E-02 ppm1      7.993 ppm2      4.472 CV     1
 OR { 1070}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
 ASSI { 1071}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HB1 ))
      2.800     1.000     1.000 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.62183E-02 ppm1      7.993 ppm2      2.699 CV     1
 OR { 1071}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
 OR { 1071}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HB1 ))
 ASSI { 1083}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 98   and name HB  ))
      4.800     2.900     1.200 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.58632E-03 ppm1      9.414 ppm2      1.519 CV     1
 OR { 1083}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
 OR { 1083}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
 OR { 1083}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI { 1085}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      3.600     1.600     1.600 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.98692E-03 ppm1      9.401 ppm2      4.988 CV     1
 OR { 1085}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI { 1098}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.700     0.900     0.900 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.44250E-02 ppm1      8.281 ppm2      4.326 CV     1
 OR { 1098}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI { 1099}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 34   and name HN  ))
      3.000     3.000     3.000 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.73201E-03 ppm1      8.276 ppm2      8.821 CV     1
 OR { 1099}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI { 1100}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      2.500     0.800     0.800 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.58793E-02 ppm1      8.272 ppm2      8.619 CV     1
 OR { 1100}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
 OR { 1100}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
 ASSI { 1105}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.300     0.600     0.600 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.18256E-01 ppm1      8.281 ppm2      2.795 CV     1
 OR { 1105}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
 OR { 1105}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 1106}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      4.000     2.000     2.000 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.20455E-02 ppm1      8.271 ppm2      5.044 CV     1
 OR { 1106}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 1108}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
      4.200     2.200     1.800 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.70195E-03 ppm1      8.277 ppm2      1.501 CV     1
 OR { 1108}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 OR { 1108}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
 OR { 1108}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 1110}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 65   and name HD2%)
      4.100     2.100     1.900 peak  1110 spectrum    1 weight  0.10000E+01 volume  0.55573E-03 ppm1      8.265 ppm2      0.429 CV     1
 OR { 1110}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 19   and name HD2%)
 ASSI { 1111}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      2.900     1.100     1.100 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.37134E-02 ppm1      8.257 ppm2      4.454 CV     1
 OR { 1111}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
 OR { 1111}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB  ))
 OR { 1111}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB  ))
 ASSI { 1112}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      2.400     0.700     0.700 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.69514E-02 ppm1      8.254 ppm2      4.071 CV     1
 OR { 1112}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
 ASSI { 1113}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 90   and name HA2 ))
      3.000     1.100     1.100 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.30213E-02 ppm1      8.269 ppm2      3.788 CV     1
 OR { 1113}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 17   and name HA1 ))
 OR { 1113}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 17   and name HA2 ))
 OR { 1113}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
 ASSI { 1115}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 20   and name HG2%)
      3.200     1.300     1.300 peak  1115 spectrum    1 weight  0.10000E+01 volume  0.38767E-02 ppm1      8.258 ppm2      1.111 CV     1
 OR { 1115}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 1117}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
      2.500     0.800     0.800 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.96182E-02 ppm1      8.254 ppm2      2.561 CV     1
 OR { 1117}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HB1 ))
 OR { 1117}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
 ASSI { 1125}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 3    and name HB1 ))
      4.500     2.500     1.500 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.62732E-03 ppm1      7.374 ppm2      2.994 CV     1
 OR { 1125}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
 OR { 1125}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 1126}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.600     3.600     2.400 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.15690E-02 ppm1      7.374 ppm2      2.771 CV     1
 OR { 1126}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI { 1130}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 37   and name HB% )
      3.300     1.400     1.400 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.37269E-02 ppm1      7.372 ppm2      1.321 CV     1
 OR { 1130}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HG1 ))
 ASSI { 1131}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 89   and name HG1%)
      3.500     1.500     1.500 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.32459E-02 ppm1      7.372 ppm2      0.845 CV     1
 OR { 1131}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
 OR { 1131}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HG2 ))
 ASSI { 1141}
   (  segid "    " and resid 43   and name HZ% )
   (( segid "    " and resid 43   and name HE2 ))
      2.100     0.600     0.600 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.10647E-01 ppm1      6.822 ppm2      2.927 CV     1
 OR { 1141}
   (  segid "    " and resid 43   and name HZ% )
   (( segid "    " and resid 43   and name HE1 ))
 OR { 1141}
   (  segid "    " and resid 43   and name HZ% )
   (( segid "    " and resid 129  and name HB2 ))
 ASSI { 1143}
   (  segid "    " and resid 43   and name HZ% )
   (( segid "    " and resid 42   and name HG  ))
      4.000     2.000     2.000 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.14956E-02 ppm1      6.826 ppm2      1.864 CV     1
 OR { 1143}
   (  segid "    " and resid 43   and name HZ% )
   (( segid "    " and resid 42   and name HB1 ))
 OR { 1143}
   (  segid "    " and resid 43   and name HZ% )
   (( segid "    " and resid 127  and name HB1 ))
 OR { 1143}
   (  segid "    " and resid 43   and name HZ% )
   (( segid "    " and resid 127  and name HB2 ))
 ASSI { 1147}
   (( segid "    " and resid 136  and name HN  ))
   (  segid "    " and resid 135  and name HG2%)
      2.900     1.000     1.000 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.47870E-02 ppm1      9.399 ppm2      1.083 CV     1
 OR { 1147}
   (( segid "    " and resid 136  and name HN  ))
   (  segid "    " and resid 7    and name HG2%)
 ASSI { 1155}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.500     1.600     1.600 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.27728E-02 ppm1      7.807 ppm2      1.854 CV     1
 OR { 1155}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 16   and name HG1 ))
 OR { 1155}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 14   and name HB1 ))
 ASSI { 1159}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 19   and name HD2%)
      3.800     1.800     1.800 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.12598E-02 ppm1      7.811 ppm2      0.420 CV     1
 OR { 1159}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI { 1164}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      3.100     1.200     1.200 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.35601E-02 ppm1      7.290 ppm2      2.687 CV     1
 OR { 1164}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
 OR { 1164}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
 ASSI { 1165}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
      2.700     0.900     0.900 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.38578E-02 ppm1      7.282 ppm2      2.264 CV     1
 OR { 1165}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI { 1172}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      3.400     1.400     1.400 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.18287E-02 ppm1      6.904 ppm2      4.300 CV     1
 OR { 1172}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 46   and name HB  ))
 ASSI { 1177}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      3.600     1.600     1.600 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.24360E-02 ppm1      6.905 ppm2      8.391 CV     1
 OR { 1177}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI { 1183}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.100     3.100     2.900 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.59243E-03 ppm1      6.904 ppm2      1.388 CV     1
 OR { 1183}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 53   and name HD1 ))
 ASSI { 1201}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
      2.900     1.100     1.100 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.50421E-02 ppm1      8.431 ppm2      2.893 CV     1
 OR { 1201}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
 OR { 1201}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 1216}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 90   and name HA1 ))
      3.600     1.600     1.600 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.12037E-02 ppm1      8.179 ppm2      4.743 CV     1
 OR { 1216}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
 ASSI { 1222}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 136  and name HA1 ))
      4.600     2.600     1.400 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.49732E-03 ppm1      7.891 ppm2      4.534 CV     1
 OR { 1222}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
 ASSI { 1227}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 10   and name HG  ))
      4.100     2.100     1.900 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.72094E-03 ppm1      7.886 ppm2      1.182 CV     1
 OR { 1227}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
 OR { 1227}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
 ASSI { 1246}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 5    and name HB  ))
      4.300     2.300     1.700 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.74476E-03 ppm1      9.071 ppm2      2.257 CV     1
 OR { 1246}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
 ASSI { 1257}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 114  and name HB1 ))
      4.500     2.500     1.500 peak  1257 spectrum    1 weight  0.10000E+01 volume  0.68870E-03 ppm1      8.715 ppm2      1.495 CV     1
 OR { 1257}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
 OR { 1257}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 114  and name HB2 ))
 ASSI { 1259}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 56   and name HB1 ))
      3.700     1.800     1.800 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.13464E-02 ppm1      8.715 ppm2      1.778 CV     1
 OR { 1259}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 1266}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 92   and name HZ2 ))
      4.100     2.100     1.900 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.99373E-03 ppm1      8.456 ppm2      7.652 CV     1
 OR { 1266}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 74   and name HD21))
 OR { 1266}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI { 1268}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 30   and name HB  ))
      3.800     1.800     1.800 peak  1268 spectrum    1 weight  0.10000E+01 volume  0.12041E-02 ppm1      8.458 ppm2      2.143 CV     1
 OR { 1268}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 1273}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.600     2.600     3.400 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.12476E-02 ppm1      8.223 ppm2      2.766 CV     1
 OR { 1273}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 OR { 1273}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 1276}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      3.400     1.500     1.500 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.26105E-02 ppm1      8.091 ppm2      4.338 CV     1
 OR { 1276}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
 OR { 1276}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
 ASSI { 1294}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      4.100     2.100     1.900 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.11022E-02 ppm1      7.663 ppm2      8.833 CV     1
 OR { 1294}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
 ASSI { 1299}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      4.600     2.700     1.400 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.55029E-03 ppm1      7.652 ppm2      4.684 CV     1
 OR { 1299}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 118  and name HA1 ))
 ASSI { 1301}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HA2 ))
      2.900     1.000     1.000 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.36962E-02 ppm1      7.654 ppm2      4.018 CV     1
 OR { 1301}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
 ASSI { 1305}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      4.000     2.000     2.000 peak  1305 spectrum    1 weight  0.10000E+01 volume  0.15763E-02 ppm1      7.654 ppm2      2.300 CV     1
 OR { 1305}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 5    and name HB  ))
 OR { 1305}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
 ASSI { 1306}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 41   and name HB% )
      3.500     1.500     1.500 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.13466E-02 ppm1      7.654 ppm2      1.448 CV     1
 OR { 1306}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 117  and name HG2%)
 ASSI { 1326}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HB  ))
      4.600     2.600     1.400 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.55834E-03 ppm1      9.069 ppm2      3.919 CV     1
 OR { 1326}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 135  and name HB  ))
 ASSI { 1328}
   (( segid "    " and resid 118  and name HN  ))
   (  segid "    " and resid 7    and name HG2%)
      3.300     1.300     1.300 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.23508E-02 ppm1      9.068 ppm2      1.078 CV     1
 OR { 1328}
   (( segid "    " and resid 118  and name HN  ))
   (  segid "    " and resid 135  and name HG2%)
 ASSI { 1334}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 29   and name HN  ))
      3.800     1.800     1.800 peak  1334 spectrum    1 weight  0.10000E+01 volume  0.97008E-03 ppm1      8.797 ppm2      8.376 CV     1
 OR { 1334}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
 OR { 1334}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 134  and name HN  ))
 ASSI { 1344}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 54   and name HD% )
      3.600     1.600     1.600 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.13874E-02 ppm1      8.746 ppm2      7.271 CV     1
 OR { 1344}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 66   and name HD% )
 ASSI { 1345}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      2.600     0.800     0.800 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.28181E-02 ppm1      8.746 ppm2      5.288 CV     1
 OR { 1345}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
 ASSI { 1346}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      2.700     0.900     0.900 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.22629E-02 ppm1      8.740 ppm2      4.884 CV     1
 OR { 1346}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
 ASSI { 1351}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      4.500     2.500     1.500 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.40235E-03 ppm1      8.748 ppm2      8.053 CV     1
 OR { 1351}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 1353}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      3.200     1.300     1.300 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.19377E-02 ppm1      8.745 ppm2      2.683 CV     1
 OR { 1353}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 OR { 1353}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI { 1358}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.200     0.600     0.600 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.11926E-01 ppm1      8.440 ppm2      4.293 CV     1
 OR { 1358}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HA1 ))
 ASSI { 1361}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 57   and name HG11))
      3.300     1.400     1.400 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.18095E-02 ppm1      8.440 ppm2      1.649 CV     1
 OR { 1361}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HG1 ))
 ASSI { 1366}
   (( segid "    " and resid 81   and name HD21))
   (  segid "    " and resid 54   and name HD% )
      3.200     1.200     1.200 peak  1366 spectrum    1 weight  0.10000E+01 volume  0.13785E-02 ppm1      7.739 ppm2      7.246 CV     1
 OR { 1366}
   (( segid "    " and resid 81   and name HD21))
   (  segid "    " and resid 66   and name HD% )
 ASSI { 1395}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 27   and name HG2 ))
      5.300     3.500     0.700 peak  1395 spectrum    1 weight  0.10000E+01 volume  0.47280E-03 ppm1      9.259 ppm2      2.051 CV     1
 OR { 1395}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 24   and name HG2 ))
 ASSI { 1403}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HA2 ))
      2.600     0.800     0.800 peak  1403 spectrum    1 weight  0.10000E+01 volume  0.40533E-02 ppm1      8.456 ppm2      3.485 CV     1
 OR { 1403}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
 ASSI { 1404}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.700     1.800     1.800 peak  1404 spectrum    1 weight  0.10000E+01 volume  0.19241E-02 ppm1      8.456 ppm2      2.577 CV     1
 OR { 1404}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 1407}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      4.200     2.200     1.800 peak  1407 spectrum    1 weight  0.10000E+01 volume  0.76734E-03 ppm1      8.065 ppm2      8.778 CV     1
 OR { 1407}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
 ASSI { 1408}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      3.700     1.700     1.700 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.18140E-02 ppm1      8.067 ppm2      8.395 CV     1
 OR { 1408}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 1410}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 55   and name HE% )
      3.400     1.500     1.500 peak  1410 spectrum    1 weight  0.10000E+01 volume  0.22309E-02 ppm1      8.063 ppm2      7.280 CV     1
 OR { 1410}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 54   and name HD% )
 OR { 1410}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 66   and name HD% )
 ASSI { 1411}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HD22))
      4.100     2.100     1.900 peak  1411 spectrum    1 weight  0.10000E+01 volume  0.12837E-02 ppm1      8.065 ppm2      6.919 CV     1
 OR { 1411}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI { 1420}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      2.800     1.000     1.000 peak  1420 spectrum    1 weight  0.10000E+01 volume  0.43020E-02 ppm1      8.065 ppm2      2.946 CV     1
 OR { 1420}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 1421}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
      2.600     0.900     0.900 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.36881E-02 ppm1      8.066 ppm2      2.742 CV     1
 OR { 1421}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
 ASSI { 1423}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      3.500     1.500     1.500 peak  1423 spectrum    1 weight  0.10000E+01 volume  0.16186E-02 ppm1      8.066 ppm2      2.218 CV     1
 OR { 1423}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 OR { 1423}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 72   and name HB1 ))
 ASSI { 1424}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 57   and name HB  ))
      3.800     1.800     1.800 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.16653E-02 ppm1      8.065 ppm2      2.093 CV     1
 OR { 1424}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
 ASSI { 1426}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.800     1.800     1.800 peak  1426 spectrum    1 weight  0.10000E+01 volume  0.14430E-02 ppm1      8.065 ppm2      1.521 CV     1
 OR { 1426}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 44   and name HB% )
 OR { 1426}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI { 1428}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
      3.600     1.600     1.600 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.18488E-02 ppm1      8.066 ppm2      0.491 CV     1
 OR { 1428}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 1428}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 116  and name HD2%)
 OR { 1428}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 1429}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      3.200     1.300     1.300 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.24728E-02 ppm1      7.830 ppm2      8.081 CV     1
 OR { 1429}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
 ASSI { 1431}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 57   and name HB  ))
      3.900     3.900     2.100 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.12302E-02 ppm1      7.831 ppm2      2.070 CV     1
 OR { 1431}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
 ASSI { 1435}
   (( segid "    " and resid 81   and name HD21))
   (  segid "    " and resid 66   and name HE% )
      2.900     2.900     3.100 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.55491E-03 ppm1      7.739 ppm2      6.596 CV     1
 OR { 1435}
   (( segid "    " and resid 81   and name HD21))
   (  segid "    " and resid 55   and name HD% )
 ASSI { 1437}
   (( segid "    " and resid 81   and name HD21))
   (( segid "    " and resid 81   and name HB1 ))
      2.300     0.700     0.700 peak  1437 spectrum    1 weight  0.10000E+01 volume  0.43102E-02 ppm1      7.747 ppm2      3.057 CV     1
 OR { 1437}
   (( segid "    " and resid 81   and name HD21))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 1460}
   (( segid "    " and resid 81   and name HD22))
   (( segid "    " and resid 81   and name HN  ))
      3.400     3.400     2.600 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.68284E-03 ppm1      6.898 ppm2      9.309 CV     1
 OR { 1460}
   (( segid "    " and resid 74   and name HD22))
   (( segid "    " and resid 97   and name HN  ))
 ASSI { 1461}
   (( segid "    " and resid 106  and name HD22))
   (( segid "    " and resid 17   and name HN  ))
      3.900     1.900     1.900 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.12278E-02 ppm1      6.897 ppm2      8.267 CV     1
 OR { 1461}
   (( segid "    " and resid 106  and name HD22))
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 1462}
   (( segid "    " and resid 81   and name HD22))
   (( segid "    " and resid 66   and name HB2 ))
      3.200     1.300     1.300 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.46446E-02 ppm1      6.898 ppm2      3.046 CV     1
 OR { 1462}
   (( segid "    " and resid 81   and name HD22))
   (( segid "    " and resid 81   and name HB1 ))
 OR { 1462}
   (( segid "    " and resid 106  and name HD22))
   (( segid "    " and resid 106  and name HB1 ))
 ASSI { 1464}
   (( segid "    " and resid 106  and name HD22))
   (( segid "    " and resid 106  and name HD21))
      1.200     0.200     1.000 peak  1464 spectrum    1 weight  0.10000E+01 volume  0.17003E+00 ppm1      6.889 ppm2      7.606 CV     1
 OR { 1464}
   (( segid "    " and resid 74   and name HD22))
   (( segid "    " and resid 74   and name HD21))
 ASSI { 1466}
   (( segid "    " and resid 74   and name HD22))
   (( segid "    " and resid 74   and name HB2 ))
      3.200     1.300     1.300 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.50141E-02 ppm1      6.891 ppm2      2.923 CV     1
 OR { 1466}
   (( segid "    " and resid 106  and name HD22))
   (( segid "    " and resid 106  and name HB1 ))
 ASSI { 1477}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      2.600     0.800     0.800 peak  1477 spectrum    1 weight  0.10000E+01 volume  0.38329E-02 ppm1      7.824 ppm2      8.359 CV     1
 OR { 1477}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI { 1479}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 55   and name HD% )
      4.600     2.600     1.400 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.47515E-03 ppm1      7.825 ppm2      6.677 CV     1
 OR { 1479}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 92   and name HZ3 ))
 ASSI { 1480}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.900     1.100     1.100 peak  1480 spectrum    1 weight  0.10000E+01 volume  0.27156E-02 ppm1      7.827 ppm2      4.303 CV     1
 OR { 1480}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
 OR { 1480}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 1483}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      2.900     1.100     1.100 peak  1483 spectrum    1 weight  0.10000E+01 volume  0.30230E-02 ppm1      7.824 ppm2      2.888 CV     1
 OR { 1483}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 1484}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
      3.400     1.400     1.400 peak  1484 spectrum    1 weight  0.10000E+01 volume  0.30855E-02 ppm1      7.824 ppm2      2.682 CV     1
 OR { 1484}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 ASSI { 1486}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.700     1.700     1.700 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.11159E-02 ppm1      7.826 ppm2      1.385 CV     1
 OR { 1486}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 76   and name HB% )
 ASSI { 1489}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      3.400     1.500     1.500 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.12130E-02 ppm1      7.827 ppm2      4.689 CV     1
 OR { 1489}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 1501}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 74   and name HN  ))
      3.100     3.100     2.900 peak  1501 spectrum    1 weight  0.10000E+01 volume  0.18116E-02 ppm1      7.618 ppm2      8.045 CV     1
 OR { 1501}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 73   and name HN  ))
 ASSI { 1522}
   (( segid "    " and resid 74   and name HD22))
   (( segid "    " and resid 72   and name HB2 ))
      2.700     0.900     0.900 peak  1522 spectrum    1 weight  0.10000E+01 volume  0.70100E-02 ppm1      6.883 ppm2      2.229 CV     1
 OR { 1522}
   (( segid "    " and resid 81   and name HD22))
   (( segid "    " and resid 101  and name HB2 ))
 OR { 1522}
   (( segid "    " and resid 81   and name HD22))
   (( segid "    " and resid 53   and name HB1 ))
 OR { 1522}
   (( segid "    " and resid 74   and name HD22))
   (( segid "    " and resid 72   and name HB1 ))
 ASSI { 1547}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 5    and name HG1%)
      3.200     3.200     2.800 peak  1547 spectrum    1 weight  0.10000E+01 volume  0.30643E-02 ppm1      8.841 ppm2      1.417 CV     1
 OR { 1547}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 117  and name HG2%)
 ASSI { 1551}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
      4.000     2.000     2.000 peak  1551 spectrum    1 weight  0.10000E+01 volume  0.74105E-03 ppm1      8.623 ppm2      0.414 CV     1
 OR { 1551}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 19   and name HD2%)
 ASSI { 1600}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      2.700     2.700     3.300 peak  1600 spectrum    1 weight  0.10000E+01 volume  0.10346E-02 ppm1      6.810 ppm2      8.273 CV     1
 OR { 1600}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
 OR { 1600}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI { 1614}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      4.100     2.100     1.900 peak  1614 spectrum    1 weight  0.10000E+01 volume  0.62942E-03 ppm1      8.825 ppm2      8.275 CV     1
 OR { 1614}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 3    and name HN  ))
 OR { 1614}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 2    and name HN  ))
 ASSI { 1615}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.200     3.200     2.800 peak  1615 spectrum    1 weight  0.10000E+01 volume  0.91216E-03 ppm1      7.706 ppm2      1.954 CV     1
 OR { 1615}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 109  and name HB2 ))
 ASSI { 1646}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
      4.400     2.400     1.600 peak  1646 spectrum    1 weight  0.10000E+01 volume  0.70922E-03 ppm1      8.292 ppm2      1.275 CV     1
 OR { 1646}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 37   and name HB% )
 ASSI { 1671}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 100  and name HB  ))
      4.300     2.300     1.700 peak  1671 spectrum    1 weight  0.10000E+01 volume  0.79397E-03 ppm1      7.581 ppm2      2.499 CV     1
 OR { 1671}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HB1 ))
 OR { 1671}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
 OR { 1671}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI { 1676}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 141  and name HA  ))
      4.300     2.300     1.700 peak  1676 spectrum    1 weight  0.10000E+01 volume  0.85598E-03 ppm1      8.705 ppm2      5.139 CV     1
 OR { 1676}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI { 1680}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 141  and name HG2%)
      4.300     2.300     1.700 peak  1680 spectrum    1 weight  0.10000E+01 volume  0.10288E-02 ppm1      8.699 ppm2      1.199 CV     1
 OR { 1680}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 1681}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 32   and name HB% )
      3.700     3.700     2.300 peak  1681 spectrum    1 weight  0.10000E+01 volume  0.42198E-03 ppm1      7.984 ppm2      1.760 CV     1
 OR { 1681}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 28   and name HB  ))
 OR { 1681}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 42   and name HG  ))
 ASSI { 1683}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      3.300     1.300     1.300 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.23887E-02 ppm1      7.972 ppm2      8.537 CV     1
 OR { 1683}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
 ASSI { 1684}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 92   and name HZ2 ))
      4.600     2.700     1.400 peak  1684 spectrum    1 weight  0.10000E+01 volume  0.64779E-03 ppm1      7.974 ppm2      7.648 CV     1
 OR { 1684}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 74   and name HD21))
 ASSI { 1685}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      4.000     2.000     2.000 peak  1685 spectrum    1 weight  0.10000E+01 volume  0.11579E-02 ppm1      7.967 ppm2      6.841 CV     1
 OR { 1685}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 92   and name HH2 ))
 ASSI { 1692}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 30   and name HG2%)
      3.700     1.700     1.700 peak  1692 spectrum    1 weight  0.10000E+01 volume  0.23015E-02 ppm1      7.967 ppm2      1.129 CV     1
 OR { 1692}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI { 1693}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      4.500     2.500     1.500 peak  1693 spectrum    1 weight  0.10000E+01 volume  0.55165E-03 ppm1      7.587 ppm2      8.595 CV     1
 OR { 1693}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
 OR { 1693}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
 ASSI { 1698}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      2.600     0.800     0.800 peak  1698 spectrum    1 weight  0.10000E+01 volume  0.80929E-02 ppm1      7.587 ppm2      1.131 CV     1
 OR { 1698}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 20   and name HG2%)
 ASSI { 1712}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      2.800     2.800     3.200 peak  1712 spectrum    1 weight  0.10000E+01 volume  0.99340E-03 ppm1      7.370 ppm2      2.729 CV     1
 OR { 1712}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 125  and name HB1 ))
 OR { 1712}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
 OR { 1712}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI { 1742}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HA2 ))
      2.400     0.700     0.700 peak  1742 spectrum    1 weight  0.10000E+01 volume  0.55652E-02 ppm1      7.541 ppm2      3.838 CV     1
 OR { 1742}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
 ASSI { 1743}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 82   and name HA1 ))
      4.800     2.900     1.200 peak  1743 spectrum    1 weight  0.10000E+01 volume  0.72243E-03 ppm1      7.539 ppm2      3.120 CV     1
 OR { 1743}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI { 1744}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
      3.400     3.400     2.600 peak  1744 spectrum    1 weight  0.10000E+01 volume  0.82997E-03 ppm1      7.537 ppm2      2.709 CV     1
 OR { 1744}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
 OR { 1744}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
 OR { 1744}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
 ASSI { 1745}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HB1 ))
      3.000     1.100     1.100 peak  1745 spectrum    1 weight  0.10000E+01 volume  0.47718E-02 ppm1      7.546 ppm2      2.262 CV     1
 OR { 1745}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
 OR { 1745}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
 OR { 1745}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 ASSI { 1746}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HB2 ))
      3.200     1.300     1.300 peak  1746 spectrum    1 weight  0.10000E+01 volume  0.36572E-02 ppm1      7.544 ppm2      2.019 CV     1
 OR { 1746}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 1759}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 106  and name HD21))
      3.600     1.600     1.600 peak  1759 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      8.283 ppm2      7.595 CV     1
 OR { 1759}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI { 1769}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA1 ))
      2.700     0.900     0.900 peak  1769 spectrum    1 weight  0.10000E+01 volume  0.33022E-02 ppm1      6.863 ppm2      4.206 CV     1
 OR { 1769}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
 ASSI { 1772}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HG2 ))
      4.500     2.500     1.500 peak  1772 spectrum    1 weight  0.10000E+01 volume  0.94395E-03 ppm1      6.861 ppm2      1.983 CV     1
 OR { 1772}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 24   and name HB1 ))
 OR { 1772}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HB1 ))
 ASSI { 1773}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 98   and name HB  ))
      2.400     0.700     0.700 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.74286E-02 ppm1      6.865 ppm2      1.517 CV     1
 OR { 1773}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HB  ))
 ASSI { 1787}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      4.700     2.800     1.300 peak  1787 spectrum    1 weight  0.10000E+01 volume  0.35441E-03 ppm1      5.646 ppm2      4.678 CV     1
 OR { 1787}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 1791}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 54   and name HE% )
      4.000     2.000     2.000 peak  1791 spectrum    1 weight  0.10000E+01 volume  0.69580E-03 ppm1      5.636 ppm2      7.144 CV     1
 OR { 1791}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 49   and name HZ  ))
 ASSI { 1808}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      3.100     1.200     1.200 peak  1808 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      9.468 ppm2      2.558 CV     1
 OR { 1808}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HB2 ))
 ASSI { 1813}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      3.500     1.500     1.500 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.10100E-02 ppm1      9.397 ppm2      9.062 CV     1
 OR { 1813}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 118  and name HN  ))
 ASSI { 1814}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      2.400     0.700     0.700 peak  1814 spectrum    1 weight  0.10000E+01 volume  0.47614E-02 ppm1      9.412 ppm2      5.270 CV     1
 OR { 1814}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
 ASSI { 1819}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HN  ))
      4.000     2.000     2.000 peak  1819 spectrum    1 weight  0.10000E+01 volume  0.86572E-03 ppm1      9.052 ppm2      8.745 CV     1
 OR { 1819}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI { 1820}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
      2.600     0.900     0.900 peak  1820 spectrum    1 weight  0.10000E+01 volume  0.28857E-02 ppm1      9.057 ppm2      3.939 CV     1
 OR { 1820}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB  ))
 ASSI { 1824}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 34   and name HN  ))
      3.900     1.900     1.900 peak  1824 spectrum    1 weight  0.10000E+01 volume  0.12986E-02 ppm1      8.998 ppm2      8.818 CV     1
 OR { 1824}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
 ASSI { 1826}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 141  and name HB  ))
      3.000     1.100     1.100 peak  1826 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      8.853 ppm2      3.942 CV     1
 OR { 1826}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 138  and name HB  ))
 ASSI { 1827}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      2.900     1.100     1.100 peak  1827 spectrum    1 weight  0.10000E+01 volume  0.43284E-02 ppm1      8.857 ppm2      1.181 CV     1
 OR { 1827}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 141  and name HG2%)
 ASSI { 1828}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 114  and name HD2%)
      3.000     1.100     1.100 peak  1828 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      8.855 ppm2      0.799 CV     1
 OR { 1828}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI { 1829}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      3.200     1.200     1.200 peak  1829 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      8.855 ppm2      0.588 CV     1
 OR { 1829}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 1831}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      3.400     1.500     1.500 peak  1831 spectrum    1 weight  0.10000E+01 volume  0.15871E-02 ppm1      8.884 ppm2      9.095 CV     1
 OR { 1831}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI { 1835}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HA1 ))
      2.900     1.000     1.000 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      8.839 ppm2      4.223 CV     1
 OR { 1835}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HA2 ))
 ASSI { 1838}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      3.900     1.900     1.900 peak  1838 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      8.746 ppm2      8.968 CV     1
 OR { 1838}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
 ASSI { 1842}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 100  and name HG2%)
      2.800     1.000     1.000 peak  1842 spectrum    1 weight  0.10000E+01 volume  0.28857E-02 ppm1      8.588 ppm2      0.920 CV     1
 OR { 1842}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 100  and name HG2%)
 OR { 1842}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 100  and name HG1%)
 ASSI { 1844}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 65   and name HD2%)
      4.100     2.100     1.900 peak  1844 spectrum    1 weight  0.10000E+01 volume  0.10100E-02 ppm1      8.586 ppm2      0.436 CV     1
 OR { 1844}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 67   and name HG1%)
 ASSI { 1847}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HB1 ))
      4.500     2.600     1.500 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.86572E-03 ppm1      8.576 ppm2      2.000 CV     1
 OR { 1847}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 27   and name HG2 ))
 ASSI { 1848}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.400     1.400     1.400 peak  1848 spectrum    1 weight  0.10000E+01 volume  0.18036E-02 ppm1      8.567 ppm2      4.475 CV     1
 OR { 1848}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
 ASSI { 1857}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      3.000     1.100     1.100 peak  1857 spectrum    1 weight  0.10000E+01 volume  0.36071E-02 ppm1      8.458 ppm2      1.078 CV     1
 OR { 1857}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 30   and name HG2%)
 OR { 1857}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 96   and name HG12))
 ASSI { 1858}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 100  and name HG1%)
      3.800     1.800     1.800 peak  1858 spectrum    1 weight  0.10000E+01 volume  0.14428E-02 ppm1      8.460 ppm2      0.930 CV     1
 OR { 1858}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 57   and name HD1%)
 ASSI { 1864}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 134  and name HA  ))
      3.500     1.500     1.500 peak  1864 spectrum    1 weight  0.10000E+01 volume  0.10100E-02 ppm1      8.383 ppm2      4.963 CV     1
 OR { 1864}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI { 1871}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HA2 ))
      2.600     0.900     0.900 peak  1871 spectrum    1 weight  0.10000E+01 volume  0.50500E-02 ppm1      8.225 ppm2      3.849 CV     1
 OR { 1871}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
 OR { 1871}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI { 1875}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HG2 ))
      3.200     1.300     1.300 peak  1875 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      8.205 ppm2      0.827 CV     1
 OR { 1875}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 89   and name HG1%)
 ASSI {   27}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 121  and name HB2 ))
      3.700     1.700     1.700 peak    27 spectrum    1 weight  0.10000E+01 volume  0.13881E-02 ppm1      3.009 ppm2      2.519 CV     1
 OR {   27}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 39   and name HB1 ))
 ASSI {   31}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 128  and name HA2 ))
      4.000     2.000     2.000 peak    31 spectrum    1 weight  0.10000E+01 volume  0.80714E-03 ppm1      2.988 ppm2      2.344 CV     1
 OR {   31}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 39   and name HB2 ))
 OR {   31}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 85   and name HB2 ))
 ASSI {   36}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 43   and name HG2 ))
      2.400     0.700     0.700 peak    36 spectrum    1 weight  0.10000E+01 volume  0.42330E-02 ppm1      2.969 ppm2      0.821 CV     1
 OR {   36}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 38   and name HG2 ))
 ASSI {  109}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 66   and name HB1 ))
      4.000     2.000     2.000 peak   109 spectrum    1 weight  0.10000E+01 volume  0.18209E-02 ppm1      2.635 ppm2      3.515 CV     1
 OR {  109}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 100  and name HA  ))
 ASSI {  146}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 40   and name HA  ))
      4.200     2.200     1.800 peak   146 spectrum    1 weight  0.10000E+01 volume  0.48139E-03 ppm1      2.988 ppm2      3.910 CV     1
 OR {  146}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 132  and name HB1 ))
 ASSI {  159}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 58   and name HA  ))
      3.900     1.900     1.900 peak   159 spectrum    1 weight  0.10000E+01 volume  0.85102E-03 ppm1      2.531 ppm2      4.283 CV     1
 OR {  159}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 110  and name HA1 ))
 ASSI {  164}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HN  ))
      3.200     1.300     1.300 peak   164 spectrum    1 weight  0.10000E+01 volume  0.28871E-02 ppm1      3.339 ppm2      8.090 CV     1
 OR {  164}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI {  166}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 72   and name HA  ))
      4.000     2.000     2.000 peak   166 spectrum    1 weight  0.10000E+01 volume  0.77292E-03 ppm1      3.344 ppm2      4.652 CV     1
 OR {  166}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  169}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HN  ))
      2.900     1.000     1.000 peak   169 spectrum    1 weight  0.10000E+01 volume  0.30145E-02 ppm1      2.851 ppm2      8.083 CV     1
 OR {  169}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
 OR {  169}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI {  176}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 101  and name HN  ))
      2.900     1.000     1.000 peak   176 spectrum    1 weight  0.10000E+01 volume  0.27352E-02 ppm1      2.645 ppm2      8.518 CV     1
 OR {  176}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI {  178}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 66   and name HB1 ))
      3.800     1.800     1.800 peak   178 spectrum    1 weight  0.10000E+01 volume  0.17416E-02 ppm1      2.647 ppm2      3.483 CV     1
 OR {  178}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 100  and name HA  ))
 OR {  178}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 66   and name HB1 ))
 ASSI {  179}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 124  and name HB2 ))
      1.900     0.500     0.500 peak   179 spectrum    1 weight  0.10000E+01 volume  0.96921E-02 ppm1      2.639 ppm2      2.250 CV     1
 OR {  179}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 101  and name HB2 ))
 ASSI {  186}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      2.900     1.100     1.100 peak   186 spectrum    1 weight  0.10000E+01 volume  0.20543E-02 ppm1      2.219 ppm2      8.500 CV     1
 OR {  186}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
 ASSI {  190}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HA  ))
      2.800     1.000     1.000 peak   190 spectrum    1 weight  0.10000E+01 volume  0.27111E-02 ppm1      2.219 ppm2      4.901 CV     1
 OR {  190}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 66   and name HA  ))
 ASSI {  192}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 66   and name HB1 ))
      4.200     2.200     1.800 peak   192 spectrum    1 weight  0.10000E+01 volume  0.10931E-02 ppm1      2.219 ppm2      3.481 CV     1
 OR {  192}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 100  and name HA  ))
 OR {  192}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 66   and name HB1 ))
 ASSI {  194}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 67   and name HG1%)
      4.600     2.700     1.400 peak   194 spectrum    1 weight  0.10000E+01 volume  0.40140E-03 ppm1      2.210 ppm2      0.481 CV     1
 OR {  194}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 65   and name HD2%)
 OR {  194}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 114  and name HD1%)
 OR {  194}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI {  197}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 111  and name HN  ))
      3.000     1.100     1.100 peak   197 spectrum    1 weight  0.10000E+01 volume  0.34622E-02 ppm1      2.700 ppm2      8.516 CV     1
 OR {  197}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI {  204}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 126  and name HN  ))
      4.000     2.000     2.000 peak   204 spectrum    1 weight  0.10000E+01 volume  0.78295E-03 ppm1      2.615 ppm2      8.283 CV     1
 OR {  204}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 123  and name HN  ))
 ASSI {  205}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 124  and name HN  ))
      2.900     1.000     1.000 peak   205 spectrum    1 weight  0.10000E+01 volume  0.37533E-02 ppm1      2.617 ppm2      8.042 CV     1
 OR {  205}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI {  219}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 110  and name HN  ))
      4.700     2.800     1.300 peak   219 spectrum    1 weight  0.10000E+01 volume  0.39640E-03 ppm1      2.731 ppm2      8.734 CV     1
 OR {  219}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 113  and name HN  ))
 ASSI {  220}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HN  ))
      2.900     1.000     1.000 peak   220 spectrum    1 weight  0.10000E+01 volume  0.35014E-02 ppm1      2.719 ppm2      8.111 CV     1
 OR {  220}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI {  222}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 65   and name HB1 ))
      4.400     2.500     1.600 peak   222 spectrum    1 weight  0.10000E+01 volume  0.91666E-03 ppm1      2.696 ppm2      1.527 CV     1
 OR {  222}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 56   and name HB2 ))
 OR {  222}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI {  223}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 64   and name HB1 ))
      4.500     2.500     1.500 peak   223 spectrum    1 weight  0.10000E+01 volume  0.10010E-02 ppm1      2.701 ppm2      1.048 CV     1
 OR {  223}
   (( segid "    " and resid 55   and name HB1 ))
   (  segid "    " and resid 57   and name HD1%)
 OR {  223}
   (( segid "    " and resid 55   and name HB1 ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI {  224}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 64   and name HG1 ))
      4.100     2.100     1.900 peak   224 spectrum    1 weight  0.10000E+01 volume  0.15393E-02 ppm1      2.696 ppm2      0.836 CV     1
 OR {  224}
   (( segid "    " and resid 55   and name HB1 ))
   (  segid "    " and resid 114  and name HD2%)
 ASSI {  229}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 141  and name HA  ))
      4.600     2.600     1.400 peak   229 spectrum    1 weight  0.10000E+01 volume  0.10167E-02 ppm1      2.679 ppm2      5.107 CV     1
 OR {  229}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI {  232}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 64   and name HD2 ))
      3.800     1.800     1.800 peak   232 spectrum    1 weight  0.10000E+01 volume  0.13483E-02 ppm1      2.689 ppm2      0.631 CV     1
 OR {  232}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 64   and name HB2 ))
 OR {  232}
   (( segid "    " and resid 55   and name HB1 ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI {  233}
   (( segid "    " and resid 55   and name HB1 ))
   (  segid "    " and resid 67   and name HG1%)
      4.500     2.600     1.500 peak   233 spectrum    1 weight  0.10000E+01 volume  0.83418E-03 ppm1      2.683 ppm2      0.450 CV     1
 OR {  233}
   (( segid "    " and resid 55   and name HB1 ))
   (  segid "    " and resid 65   and name HD2%)
 ASSI {  234}
   (( segid "    " and resid 55   and name HB1 ))
   (  segid "    " and resid 66   and name HD% )
      3.200     1.300     1.300 peak   234 spectrum    1 weight  0.10000E+01 volume  0.13326E-02 ppm1      2.668 ppm2      7.251 CV     1
 OR {  234}
   (( segid "    " and resid 55   and name HB1 ))
   (  segid "    " and resid 55   and name HE% )
 OR {  234}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 121  and name HZ2 ))
 ASSI {  235}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 121  and name HE1 ))
      4.800     2.900     1.200 peak   235 spectrum    1 weight  0.10000E+01 volume  0.30141E-03 ppm1      2.244 ppm2      9.595 CV     1
 OR {  235}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 66   and name HN  ))
 ASSI {  239}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 124  and name HN  ))
      4.200     2.200     1.800 peak   239 spectrum    1 weight  0.10000E+01 volume  0.51862E-03 ppm1      2.231 ppm2      8.013 CV     1
 OR {  239}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HN  ))
 OR {  239}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI {  240}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 66   and name HD% )
      4.300     2.300     1.700 peak   240 spectrum    1 weight  0.10000E+01 volume  0.10577E-02 ppm1      2.226 ppm2      7.255 CV     1
 OR {  240}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 121  and name HZ2 ))
 OR {  240}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 55   and name HE% )
 ASSI {  245}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 124  and name HB1 ))
      2.100     0.600     0.600 peak   245 spectrum    1 weight  0.10000E+01 volume  0.46888E-02 ppm1      2.226 ppm2      2.685 CV     1
 OR {  245}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI {  246}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 56   and name HB2 ))
      4.600     2.700     1.400 peak   246 spectrum    1 weight  0.10000E+01 volume  0.39115E-03 ppm1      2.227 ppm2      1.524 CV     1
 OR {  246}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI {  247}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 64   and name HB1 ))
      4.100     2.100     1.900 peak   247 spectrum    1 weight  0.10000E+01 volume  0.85395E-03 ppm1      2.229 ppm2      1.039 CV     1
 OR {  247}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 57   and name HD1%)
 ASSI {  248}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 64   and name HD2 ))
      3.100     1.200     1.200 peak   248 spectrum    1 weight  0.10000E+01 volume  0.16330E-02 ppm1      2.233 ppm2      0.633 CV     1
 OR {  248}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 64   and name HB2 ))
 OR {  248}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI {  249}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 67   and name HG1%)
      4.400     2.400     1.600 peak   249 spectrum    1 weight  0.10000E+01 volume  0.82473E-03 ppm1      2.229 ppm2      0.456 CV     1
 OR {  249}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 65   and name HD2%)
 ASSI {  260}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 57   and name HG11))
      4.000     2.000     2.000 peak   260 spectrum    1 weight  0.10000E+01 volume  0.96236E-03 ppm1      2.845 ppm2      1.632 CV     1
 OR {  260}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 57   and name HG11))
 OR {  260}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 139  and name HD1 ))
 OR {  260}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 62   and name HG1 ))
 ASSI {  271}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 96   and name HA  ))
      4.500     2.600     1.500 peak   271 spectrum    1 weight  0.10000E+01 volume  0.58294E-03 ppm1      0.692 ppm2      4.474 CV     1
 OR {  271}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 98   and name HA  ))
 ASSI {  279}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 69   and name HG11))
      2.300     0.700     0.700 peak   279 spectrum    1 weight  0.10000E+01 volume  0.63004E-02 ppm1      0.681 ppm2      0.281 CV     1
 OR {  279}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 96   and name HG2%)
 ASSI {  280}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 69   and name HG12))
      3.000     1.100     1.100 peak   280 spectrum    1 weight  0.10000E+01 volume  0.25142E-02 ppm1      0.676 ppm2      0.105 CV     1
 OR {  280}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 96   and name HD1%)
 ASSI {  298}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 101  and name HB1 ))
      3.800     1.800     1.800 peak   298 spectrum    1 weight  0.10000E+01 volume  0.12578E-02 ppm1      3.460 ppm2      2.619 CV     1
 OR {  298}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 55   and name HB1 ))
 OR {  298}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI {  299}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 101  and name HB2 ))
      3.700     1.700     1.700 peak   299 spectrum    1 weight  0.10000E+01 volume  0.13768E-02 ppm1      3.459 ppm2      2.214 CV     1
 OR {  299}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 55   and name HB2 ))
 OR {  299}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 53   and name HB1 ))
 ASSI {  300}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 65   and name HB1 ))
      4.400     2.500     1.600 peak   300 spectrum    1 weight  0.10000E+01 volume  0.62121E-03 ppm1      3.463 ppm2      1.521 CV     1
 OR {  300}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 44   and name HB% )
 ASSI {  302}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 67   and name HG2%)
      5.000     3.100     1.000 peak   302 spectrum    1 weight  0.10000E+01 volume  0.47226E-03 ppm1      3.457 ppm2      0.637 CV     1
 OR {  302}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI {  307}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 66   and name HD% )
      2.900     1.000     1.000 peak   307 spectrum    1 weight  0.10000E+01 volume  0.23823E-02 ppm1      3.049 ppm2      7.252 CV     1
 OR {  307}
   (( segid "    " and resid 81   and name HB1 ))
   (  segid "    " and resid 54   and name HD% )
 ASSI {  309}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 53   and name HB1 ))
      3.300     1.400     1.400 peak   309 spectrum    1 weight  0.10000E+01 volume  0.10815E-02 ppm1      3.049 ppm2      2.198 CV     1
 OR {  309}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 101  and name HB2 ))
 OR {  309}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 55   and name HB2 ))
 ASSI {  310}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 125  and name HN  ))
      3.200     1.300     1.300 peak   310 spectrum    1 weight  0.10000E+01 volume  0.29496E-02 ppm1      2.773 ppm2      7.975 CV     1
 OR {  310}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  314}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 16   and name HB2 ))
      4.000     2.000     2.000 peak   314 spectrum    1 weight  0.10000E+01 volume  0.55322E-03 ppm1      2.774 ppm2      1.764 CV     1
 OR {  314}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 109  and name HG1 ))
 OR {  314}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 16   and name HG1 ))
 OR {  314}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI {  315}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 126  and name HA  ))
      3.900     1.900     1.900 peak   315 spectrum    1 weight  0.10000E+01 volume  0.95683E-03 ppm1      2.754 ppm2      4.036 CV     1
 OR {  315}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 127  and name HA  ))
 OR {  315}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
 ASSI {  316}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 38   and name HB2 ))
      4.900     3.100     1.100 peak   316 spectrum    1 weight  0.10000E+01 volume  0.30184E-03 ppm1      2.760 ppm2      1.570 CV     1
 OR {  316}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 38   and name HB2 ))
 OR {  316}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 38   and name HB1 ))
 OR {  316}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 38   and name HB1 ))
 OR {  316}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 126  and name HD2 ))
 ASSI {  323}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 125  and name HN  ))
      3.000     1.100     1.100 peak   323 spectrum    1 weight  0.10000E+01 volume  0.28128E-02 ppm1      2.700 ppm2      7.974 CV     1
 OR {  323}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  332}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 54   and name HN  ))
      2.700     0.900     0.900 peak   332 spectrum    1 weight  0.10000E+01 volume  0.31443E-02 ppm1      3.053 ppm2      8.446 CV     1
 OR {  332}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 61   and name HN  ))
 OR {  332}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 62   and name HN  ))
 ASSI {  343}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 57   and name HG11))
      3.600     1.600     1.600 peak   343 spectrum    1 weight  0.10000E+01 volume  0.17068E-02 ppm1      3.036 ppm2      1.587 CV     1
 OR {  343}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 62   and name HB1 ))
 OR {  343}
   (( segid "    " and resid 81   and name HB1 ))
   (  segid "    " and resid 44   and name HB% )
 OR {  343}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI {  350}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 61   and name HN  ))
      3.200     1.300     1.300 peak   350 spectrum    1 weight  0.10000E+01 volume  0.32206E-02 ppm1      2.921 ppm2      8.444 CV     1
 OR {  350}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 62   and name HN  ))
 OR {  350}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI {  352}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 61   and name HA  ))
      2.600     0.800     0.800 peak   352 spectrum    1 weight  0.10000E+01 volume  0.76578E-02 ppm1      2.920 ppm2      4.281 CV     1
 OR {  352}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 2    and name HA  ))
 OR {  352}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI {  353}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 4    and name HB2 ))
      4.300     2.300     1.700 peak   353 spectrum    1 weight  0.10000E+01 volume  0.52742E-03 ppm1      2.921 ppm2      1.982 CV     1
 OR {  353}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 4    and name HB1 ))
 OR {  353}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 57   and name HB  ))
 OR {  353}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 57   and name HB  ))
 ASSI {  355}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 57   and name HG11))
      3.600     1.600     1.600 peak   355 spectrum    1 weight  0.10000E+01 volume  0.15851E-02 ppm1      2.903 ppm2      1.584 CV     1
 OR {  355}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 38   and name HB1 ))
 OR {  355}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 38   and name HB2 ))
 OR {  355}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 62   and name HB1 ))
 OR {  355}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 62   and name HG1 ))
 ASSI {  356}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 38   and name HG1 ))
      3.600     1.600     1.600 peak   356 spectrum    1 weight  0.10000E+01 volume  0.11584E-02 ppm1      2.908 ppm2      1.340 CV     1
 OR {  356}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 62   and name HG2 ))
 OR {  356}
   (( segid "    " and resid 3    and name HB1 ))
   (  segid "    " and resid 40   and name HG1%)
 OR {  356}
   (( segid "    " and resid 74   and name HB2 ))
   (  segid "    " and resid 76   and name HB% )
 OR {  356}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI {  357}
   (( segid "    " and resid 61   and name HB2 ))
   (  segid "    " and resid 57   and name HD1%)
      3.500     1.500     1.500 peak   357 spectrum    1 weight  0.10000E+01 volume  0.15680E-02 ppm1      2.901 ppm2      1.007 CV     1
 OR {  357}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI {  358}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 17   and name HN  ))
      2.400     0.700     0.700 peak   358 spectrum    1 weight  0.10000E+01 volume  0.43049E-02 ppm1      2.843 ppm2      8.260 CV     1
 OR {  358}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 106  and name HN  ))
 ASSI {  362}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 106  and name HD22))
      4.100     2.100     1.900 peak   362 spectrum    1 weight  0.10000E+01 volume  0.11775E-02 ppm1      2.848 ppm2      6.852 CV     1
 OR {  362}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  363}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HA  ))
      2.400     0.700     0.700 peak   363 spectrum    1 weight  0.10000E+01 volume  0.66938E-02 ppm1      2.852 ppm2      4.805 CV     1
 OR {  363}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 106  and name HA  ))
 OR {  363}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  364}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
      4.900     3.000     1.100 peak   364 spectrum    1 weight  0.10000E+01 volume  0.30699E-03 ppm1      2.829 ppm2      5.048 CV     1
 OR {  364}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 115  and name HA  ))
 ASSI {  366}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 107  and name HN  ))
      4.500     2.500     1.500 peak   366 spectrum    1 weight  0.10000E+01 volume  0.79917E-03 ppm1      2.798 ppm2      7.206 CV     1
 OR {  366}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 121  and name HZ2 ))
 ASSI {  368}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HA  ))
      2.400     0.700     0.700 peak   368 spectrum    1 weight  0.10000E+01 volume  0.59710E-02 ppm1      2.809 ppm2      4.802 CV     1
 OR {  368}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI {  369}
   (( segid "    " and resid 106  and name HB2 ))
   (  segid "    " and resid 107  and name HG2%)
      4.500     2.600     1.500 peak   369 spectrum    1 weight  0.10000E+01 volume  0.39907E-03 ppm1      2.787 ppm2      0.816 CV     1
 OR {  369}
   (( segid "    " and resid 125  and name HB1 ))
   (  segid "    " and resid 83   and name HG2%)
 OR {  369}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 89   and name HG2%)
 OR {  369}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 114  and name HD2%)
 OR {  369}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 89   and name HG2%)
 OR {  369}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 89   and name HG1%)
 OR {  369}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 89   and name HG1%)
 ASSI {  384}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 34   and name HA1 ))
      3.800     1.800     1.800 peak   384 spectrum    1 weight  0.10000E+01 volume  0.13210E-02 ppm1      2.350 ppm2      4.277 CV     1
 OR {  384}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 2    and name HA  ))
 ASSI {  387}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HN  ))
      3.300     1.400     1.400 peak   387 spectrum    1 weight  0.10000E+01 volume  0.15825E-02 ppm1      1.928 ppm2      7.550 CV     1
 OR {  387}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI {  388}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 20   and name HB  ))
      4.000     2.000     2.000 peak   388 spectrum    1 weight  0.10000E+01 volume  0.12155E-02 ppm1      1.918 ppm2      4.504 CV     1
 OR {  388}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 15   and name HB  ))
 OR {  388}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 23   and name HA  ))
 ASSI {  390}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 100  and name HB  ))
      4.000     2.000     2.000 peak   390 spectrum    1 weight  0.10000E+01 volume  0.33460E-03 ppm1      1.919 ppm2      2.503 CV     1
 OR {  390}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI {  394}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 96   and name HN  ))
      2.700     0.900     0.900 peak   394 spectrum    1 weight  0.10000E+01 volume  0.50917E-02 ppm1      1.543 ppm2      9.201 CV     1
 OR {  394}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 97   and name HN  ))
 ASSI {  395}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 28   and name HN  ))
      3.700     1.700     1.700 peak   395 spectrum    1 weight  0.10000E+01 volume  0.11345E-02 ppm1      1.545 ppm2      8.972 CV     1
 OR {  395}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 99   and name HN  ))
 ASSI {  396}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 27   and name HA  ))
      3.600     1.600     1.600 peak   396 spectrum    1 weight  0.10000E+01 volume  0.13620E-02 ppm1      1.543 ppm2      5.160 CV     1
 OR {  396}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 95   and name HA  ))
 ASSI {  397}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 69   and name HA  ))
      4.300     2.300     1.700 peak   397 spectrum    1 weight  0.10000E+01 volume  0.43329E-03 ppm1      1.543 ppm2      4.909 CV     1
 OR {  397}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 70   and name HA  ))
 OR {  397}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI {  399}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 96   and name HA  ))
      2.800     1.000     1.000 peak   399 spectrum    1 weight  0.10000E+01 volume  0.24133E-02 ppm1      1.548 ppm2      4.459 CV     1
 OR {  399}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 98   and name HA  ))
 ASSI {  400}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 138  and name HB  ))
      4.500     2.500     1.500 peak   400 spectrum    1 weight  0.10000E+01 volume  0.48415E-03 ppm1      1.544 ppm2      4.057 CV     1
 OR {  400}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 24   and name HD1 ))
 OR {  400}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  405}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 69   and name HG2%)
      3.000     1.100     1.100 peak   405 spectrum    1 weight  0.10000E+01 volume  0.21376E-02 ppm1      1.548 ppm2     -0.170 CV     1
 OR {  405}
   (( segid "    " and resid 98   and name HB  ))
   (  segid "    " and resid 69   and name HG2%)
 ASSI {  407}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 26   and name HA1 ))
      4.000     2.000     2.000 peak   407 spectrum    1 weight  0.10000E+01 volume  0.42058E-03 ppm1      1.529 ppm2      4.296 CV     1
 OR {  407}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 97   and name HA1 ))
 ASSI {  410}
   (( segid "    " and resid 98   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
      3.400     1.400     1.400 peak   410 spectrum    1 weight  0.10000E+01 volume  0.11620E-02 ppm1      1.520 ppm2      8.568 CV     1
 OR {  410}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI {  414}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      2.900     1.100     1.100 peak   414 spectrum    1 weight  0.10000E+01 volume  0.14260E-02 ppm1      1.065 ppm2      7.551 CV     1
 OR {  414}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI {  418}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 25   and name HG11))
      5.200     3.300     0.800 peak   418 spectrum    1 weight  0.10000E+01 volume  0.32911E-03 ppm1      1.065 ppm2      1.397 CV     1
 OR {  418}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 104  and name HB2 ))
 ASSI {  433}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HN  ))
      2.900     1.100     1.100 peak   433 spectrum    1 weight  0.10000E+01 volume  0.26157E-02 ppm1      2.935 ppm2      8.058 CV     1
 OR {  433}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI {  437}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HB1 ))
      1.500     0.300     0.700 peak   437 spectrum    1 weight  0.10000E+01 volume  0.48019E-01 ppm1      2.935 ppm2      3.112 CV     1
 OR {  437}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 61   and name HB1 ))
 ASSI {  440}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 36   and name HN  ))
      2.600     0.800     0.800 peak   440 spectrum    1 weight  0.10000E+01 volume  0.74584E-02 ppm1      2.766 ppm2      8.267 CV     1
 OR {  440}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 36   and name HN  ))
 OR {  440}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 126  and name HN  ))
 ASSI {  462}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 15   and name HA  ))
      4.300     2.300     1.700 peak   462 spectrum    1 weight  0.10000E+01 volume  0.45117E-03 ppm1      1.865 ppm2      5.109 CV     1
 OR {  462}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  468}
   (( segid "    " and resid 14   and name HB1 ))
   (  segid "    " and resid 25   and name HD1%)
      3.100     1.200     1.200 peak   468 spectrum    1 weight  0.10000E+01 volume  0.21872E-02 ppm1      1.863 ppm2      0.418 CV     1
 OR {  468}
   (( segid "    " and resid 14   and name HB1 ))
   (  segid "    " and resid 19   and name HD2%)
 ASSI {  472}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
      4.200     2.200     1.800 peak   472 spectrum    1 weight  0.10000E+01 volume  0.54013E-03 ppm1      1.323 ppm2      5.098 CV     1
 OR {  472}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  480}
   (( segid "    " and resid 14   and name HB2 ))
   (  segid "    " and resid 25   and name HD1%)
      3.000     1.100     1.100 peak   480 spectrum    1 weight  0.10000E+01 volume  0.24906E-02 ppm1      1.320 ppm2      0.414 CV     1
 OR {  480}
   (( segid "    " and resid 14   and name HB2 ))
   (  segid "    " and resid 19   and name HD2%)
 ASSI {  504}
   (( segid "    " and resid 87   and name HB1 ))
   (  segid "    " and resid 76   and name HB% )
      3.200     1.300     1.300 peak   504 spectrum    1 weight  0.10000E+01 volume  0.20714E-02 ppm1      2.691 ppm2      1.305 CV     1
 OR {  504}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI {  530}
   (( segid "    " and resid 12   and name HB  ))
   (  segid "    " and resid 13   and name HB% )
      4.000     2.000     2.000 peak   530 spectrum    1 weight  0.10000E+01 volume  0.90494E-03 ppm1      1.941 ppm2      1.338 CV     1
 OR {  530}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 14   and name HB2 ))
 OR {  530}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 139  and name HG2 ))
 ASSI {  539}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 63   and name HA  ))
      4.000     2.000     2.000 peak   539 spectrum    1 weight  0.10000E+01 volume  0.97132E-03 ppm1      1.059 ppm2      4.684 CV     1
 OR {  539}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 65   and name HA  ))
 ASSI {  554}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 57   and name HA  ))
      4.400     2.400     1.600 peak   554 spectrum    1 weight  0.10000E+01 volume  0.41641E-03 ppm1      0.668 ppm2      5.336 CV     1
 OR {  554}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI {  557}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 65   and name HA  ))
      4.000     2.000     2.000 peak   557 spectrum    1 weight  0.10000E+01 volume  0.10291E-02 ppm1      0.665 ppm2      4.682 CV     1
 OR {  557}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  564}
   (( segid "    " and resid 2    and name HG1 ))
   (( segid "    " and resid 3    and name HN  ))
      3.100     1.200     1.200 peak   564 spectrum    1 weight  0.10000E+01 volume  0.26553E-02 ppm1      2.332 ppm2      8.248 CV     1
 OR {  564}
   (( segid "    " and resid 2    and name HG1 ))
   (( segid "    " and resid 2    and name HN  ))
 ASSI {  566}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 3    and name HN  ))
      2.900     1.100     1.100 peak   566 spectrum    1 weight  0.10000E+01 volume  0.55904E-02 ppm1      2.288 ppm2      8.251 CV     1
 OR {  566}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 2    and name HN  ))
 ASSI {  567}
   (( segid "    " and resid 50   and name HG1 ))
   (  segid "    " and resid 55   and name HD% )
      3.400     1.400     1.400 peak   567 spectrum    1 weight  0.10000E+01 volume  0.23888E-02 ppm1      2.291 ppm2      6.591 CV     1
 OR {  567}
   (( segid "    " and resid 50   and name HG1 ))
   (  segid "    " and resid 66   and name HE% )
 ASSI {  570}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
      3.300     1.300     1.300 peak   570 spectrum    1 weight  0.10000E+01 volume  0.19498E-02 ppm1      2.268 ppm2      4.722 CV     1
 OR {  570}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 33   and name HA  ))
 ASSI {  585}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 96   and name HA  ))
      4.600     2.700     1.400 peak   585 spectrum    1 weight  0.10000E+01 volume  0.31390E-03 ppm1      2.171 ppm2      4.543 CV     1
 OR {  585}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 92   and name HA  ))
 ASSI {  586}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 29   and name HA  ))
      4.300     2.300     1.700 peak   586 spectrum    1 weight  0.10000E+01 volume  0.13886E-02 ppm1      2.174 ppm2      4.324 CV     1
 OR {  586}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 93   and name HA1 ))
 ASSI {  589}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 69   and name HN  ))
      4.500     2.600     1.500 peak   589 spectrum    1 weight  0.10000E+01 volume  0.27695E-03 ppm1      2.143 ppm2      8.128 CV     1
 OR {  589}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 55   and name HN  ))
 OR {  589}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 23   and name HN  ))
 ASSI {  591}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 101  and name HN  ))
      4.200     2.200     1.800 peak   591 spectrum    1 weight  0.10000E+01 volume  0.10301E-02 ppm1      2.076 ppm2      8.554 CV     1
 OR {  591}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI {  622}
   (( segid "    " and resid 18   and name HG1 ))
   (  segid "    " and resid 23   and name HB% )
      4.500     2.500     1.500 peak   622 spectrum    1 weight  0.10000E+01 volume  0.36245E-03 ppm1      2.527 ppm2      1.483 CV     1
 OR {  622}
   (( segid "    " and resid 18   and name HG1 ))
   (( segid "    " and resid 25   and name HB  ))
 OR {  622}
   (( segid "    " and resid 18   and name HG1 ))
   (( segid "    " and resid 25   and name HG11))
 ASSI {  631}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HA  ))
      3.000     1.100     1.100 peak   631 spectrum    1 weight  0.10000E+01 volume  0.43833E-02 ppm1      2.341 ppm2      4.368 CV     1
 OR {  631}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  634}
   (( segid "    " and resid 2    and name HG1 ))
   (( segid "    " and resid 4    and name HA  ))
      3.500     1.600     1.600 peak   634 spectrum    1 weight  0.10000E+01 volume  0.14718E-02 ppm1      2.333 ppm2      4.752 CV     1
 OR {  634}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 47   and name HA  ))
 OR {  634}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 53   and name HA  ))
 OR {  634}
   (( segid "    " and resid 2    and name HG1 ))
   (( segid "    " and resid 33   and name HA  ))
 ASSI {  635}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 25   and name HA  ))
      4.000     2.000     2.000 peak   635 spectrum    1 weight  0.10000E+01 volume  0.77787E-03 ppm1      2.328 ppm2      3.989 CV     1
 OR {  635}
   (( segid "    " and resid 2    and name HG1 ))
   (( segid "    " and resid 132  and name HB1 ))
 OR {  635}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 132  and name HB1 ))
 OR {  635}
   (( segid "    " and resid 2    and name HG1 ))
   (( segid "    " and resid 91   and name HA  ))
 OR {  635}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 91   and name HA  ))
 OR {  635}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 24   and name HD1 ))
 ASSI {  636}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 17   and name HA2 ))
      4.400     2.400     1.600 peak   636 spectrum    1 weight  0.10000E+01 volume  0.78468E-03 ppm1      2.336 ppm2      3.866 CV     1
 OR {  636}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 51   and name HA  ))
 OR {  636}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 17   and name HA1 ))
 OR {  636}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  638}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 53   and name HN  ))
      4.300     2.300     1.700 peak   638 spectrum    1 weight  0.10000E+01 volume  0.67950E-03 ppm1      2.282 ppm2      7.570 CV     1
 OR {  638}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI {  645}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 86   and name HE2 ))
      3.700     1.700     1.700 peak   645 spectrum    1 weight  0.10000E+01 volume  0.93648E-03 ppm1      1.590 ppm2      2.234 CV     1
 OR {  645}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 86   and name HE2 ))
 OR {  645}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI {  649}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 89   and name HA  ))
      4.900     3.000     1.100 peak   649 spectrum    1 weight  0.10000E+01 volume  0.36497E-03 ppm1      1.579 ppm2      4.085 CV     1
 OR {  649}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 91   and name HA  ))
 OR {  649}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI {  651}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 3    and name HB1 ))
      3.500     1.600     1.600 peak   651 spectrum    1 weight  0.10000E+01 volume  0.13774E-02 ppm1      1.573 ppm2      2.979 CV     1
 OR {  651}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 120  and name HB1 ))
 OR {  651}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 3    and name HB1 ))
 OR {  651}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 120  and name HB1 ))
 ASSI {  652}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 120  and name HB2 ))
      3.600     1.600     1.600 peak   652 spectrum    1 weight  0.10000E+01 volume  0.19669E-02 ppm1      1.574 ppm2      2.756 CV     1
 OR {  652}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 120  and name HB2 ))
 OR {  652}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 86   and name HE1 ))
 ASSI {  660}
   (( segid "    " and resid 18   and name HG1 ))
   (( segid "    " and resid 14   and name HB1 ))
      3.700     1.700     1.700 peak   660 spectrum    1 weight  0.10000E+01 volume  0.98242E-03 ppm1      2.523 ppm2      1.873 CV     1
 OR {  660}
   (( segid "    " and resid 18   and name HG1 ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI {  662}
   (( segid "    " and resid 18   and name HG1 ))
   (  segid "    " and resid 19   and name HD2%)
      4.300     2.400     1.700 peak   662 spectrum    1 weight  0.10000E+01 volume  0.32768E-03 ppm1      2.505 ppm2      0.428 CV     1
 OR {  662}
   (( segid "    " and resid 18   and name HG1 ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI {  663}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 54   and name HN  ))
      3.200     1.300     1.300 peak   663 spectrum    1 weight  0.10000E+01 volume  0.16959E-02 ppm1      2.210 ppm2      8.394 CV     1
 OR {  663}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 129  and name HN  ))
 OR {  663}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI {  664}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HN  ))
      3.500     1.600     1.600 peak   664 spectrum    1 weight  0.10000E+01 volume  0.19143E-02 ppm1      2.218 ppm2      7.553 CV     1
 OR {  664}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI {  665}
   (( segid "    " and resid 53   and name HB1 ))
   (  segid "    " and resid 66   and name HD% )
      2.800     0.900     0.900 peak   665 spectrum    1 weight  0.10000E+01 volume  0.22795E-02 ppm1      2.216 ppm2      7.282 CV     1
 OR {  665}
   (( segid "    " and resid 53   and name HB1 ))
   (  segid "    " and resid 54   and name HD% )
 ASSI {  667}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 43   and name HE2 ))
      4.100     2.100     1.900 peak   667 spectrum    1 weight  0.10000E+01 volume  0.69337E-03 ppm1      2.210 ppm2      2.836 CV     1
 OR {  667}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 54   and name HB2 ))
 OR {  667}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 43   and name HE2 ))
 OR {  667}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI {  670}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.200     1.300     1.300 peak   670 spectrum    1 weight  0.10000E+01 volume  0.16147E-02 ppm1      1.963 ppm2      8.388 CV     1
 OR {  670}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 54   and name HN  ))
 ASSI {  671}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
      2.700     0.900     0.900 peak   671 spectrum    1 weight  0.10000E+01 volume  0.28364E-02 ppm1      1.964 ppm2      7.572 CV     1
 OR {  671}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI {  672}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 66   and name HD% )
      3.500     1.500     1.500 peak   672 spectrum    1 weight  0.10000E+01 volume  0.16995E-02 ppm1      1.966 ppm2      7.281 CV     1
 OR {  672}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 55   and name HE% )
 ASSI {  673}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 66   and name HE% )
      3.100     1.200     1.200 peak   673 spectrum    1 weight  0.10000E+01 volume  0.14303E-02 ppm1      1.969 ppm2      6.630 CV     1
 OR {  673}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 55   and name HD% )
 ASSI {  688}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 139  and name HN  ))
      2.800     1.000     1.000 peak   688 spectrum    1 weight  0.10000E+01 volume  0.28454E-02 ppm1      1.874 ppm2      9.222 CV     1
 OR {  688}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 140  and name HN  ))
 ASSI {  689}
   (( segid "    " and resid 7    and name HB  ))
   (( segid "    " and resid 8    and name HN  ))
      3.900     1.900     1.900 peak   689 spectrum    1 weight  0.10000E+01 volume  0.87237E-03 ppm1      1.872 ppm2      8.861 CV     1
 OR {  689}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI {  691}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 11   and name HA  ))
      2.700     0.900     0.900 peak   691 spectrum    1 weight  0.10000E+01 volume  0.25924E-02 ppm1      1.879 ppm2      5.295 CV     1
 OR {  691}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 138  and name HA  ))
 ASSI {  692}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 139  and name HA  ))
      3.000     1.100     1.100 peak   692 spectrum    1 weight  0.10000E+01 volume  0.32610E-02 ppm1      1.884 ppm2      4.941 CV     1
 OR {  692}
   (( segid "    " and resid 7    and name HB  ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI {  707}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 139  and name HN  ))
      2.800     1.000     1.000 peak   707 spectrum    1 weight  0.10000E+01 volume  0.35071E-02 ppm1      1.656 ppm2      9.212 CV     1
 OR {  707}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 140  and name HN  ))
 ASSI {  708}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 12   and name HN  ))
      4.400     2.400     1.600 peak   708 spectrum    1 weight  0.10000E+01 volume  0.77721E-03 ppm1      1.664 ppm2      8.812 CV     1
 OR {  708}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 114  and name HN  ))
 ASSI {  709}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 11   and name HA  ))
      3.700     1.700     1.700 peak   709 spectrum    1 weight  0.10000E+01 volume  0.22291E-02 ppm1      1.659 ppm2      5.299 CV     1
 OR {  709}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 138  and name HA  ))
 ASSI {  710}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 139  and name HG1 ))
      2.400     0.700     0.700 peak   710 spectrum    1 weight  0.10000E+01 volume  0.50005E-02 ppm1      1.663 ppm2      1.249 CV     1
 OR {  710}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 96   and name HG11))
 ASSI {  717}
   (( segid "    " and resid 43   and name HB1 ))
   (  segid "    " and resid 44   and name HB% )
      4.600     2.600     1.400 peak   717 spectrum    1 weight  0.10000E+01 volume  0.64119E-03 ppm1      0.823 ppm2      1.483 CV     1
 OR {  717}
   (( segid "    " and resid 43   and name HB1 ))
   (  segid "    " and resid 117  and name HG2%)
 OR {  717}
   (( segid "    " and resid 43   and name HB1 ))
   (  segid "    " and resid 41   and name HB% )
 ASSI {  722}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 44   and name HA  ))
      4.800     2.900     1.200 peak   722 spectrum    1 weight  0.10000E+01 volume  0.48556E-03 ppm1      0.809 ppm2      5.357 CV     1
 OR {  722}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  725}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HE2 ))
      4.300     2.300     1.700 peak   725 spectrum    1 weight  0.10000E+01 volume  0.86233E-03 ppm1      0.806 ppm2      2.943 CV     1
 OR {  725}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 129  and name HB2 ))
 OR {  725}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI {  727}
   (( segid "    " and resid 43   and name HB2 ))
   (  segid "    " and resid 117  and name HG2%)
      4.600     2.600     1.400 peak   727 spectrum    1 weight  0.10000E+01 volume  0.39535E-03 ppm1     -0.405 ppm2      1.483 CV     1
 OR {  727}
   (( segid "    " and resid 43   and name HB2 ))
   (  segid "    " and resid 41   and name HB% )
 OR {  727}
   (( segid "    " and resid 43   and name HB2 ))
   (  segid "    " and resid 44   and name HB% )
 ASSI {  728}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HN  ))
      3.000     1.100     1.100 peak   728 spectrum    1 weight  0.10000E+01 volume  0.12797E-02 ppm1     -0.422 ppm2      8.872 CV     1
 OR {  728}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI {  735}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 129  and name HA  ))
      4.900     3.000     1.100 peak   735 spectrum    1 weight  0.10000E+01 volume  0.46339E-03 ppm1     -0.432 ppm2      4.653 CV     1
 OR {  735}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI {  736}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HE1 ))
      4.400     2.400     1.600 peak   736 spectrum    1 weight  0.10000E+01 volume  0.55619E-03 ppm1     -0.436 ppm2      2.956 CV     1
 OR {  736}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HE2 ))
 OR {  736}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 129  and name HB2 ))
 ASSI {  760}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 5    and name HN  ))
      3.000     1.200     1.200 peak   760 spectrum    1 weight  0.10000E+01 volume  0.15846E-02 ppm1      2.297 ppm2      9.294 CV     1
 OR {  760}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 5    and name HN  ))
 ASSI {  761}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HN  ))
      3.100     1.200     1.200 peak   761 spectrum    1 weight  0.10000E+01 volume  0.28356E-02 ppm1      2.302 ppm2      8.941 CV     1
 OR {  761}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 4    and name HN  ))
 OR {  761}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 6    and name HN  ))
 OR {  761}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 33   and name HN  ))
 ASSI {  764}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 6    and name HA  ))
      3.900     1.900     1.900 peak   764 spectrum    1 weight  0.10000E+01 volume  0.10860E-02 ppm1      2.306 ppm2      4.899 CV     1
 OR {  764}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 3    and name HA  ))
 OR {  764}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 3    and name HA  ))
 OR {  764}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 30   and name HA  ))
 OR {  764}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 117  and name HA  ))
 ASSI {  766}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 133  and name HA2 ))
      3.700     1.700     1.700 peak   766 spectrum    1 weight  0.10000E+01 volume  0.12987E-02 ppm1      2.299 ppm2      3.780 CV     1
 OR {  766}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 133  and name HA2 ))
 OR {  766}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 133  and name HA2 ))
 ASSI {  769}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 132  and name HA  ))
      4.100     2.100     1.900 peak   769 spectrum    1 weight  0.10000E+01 volume  0.10619E-02 ppm1      2.289 ppm2      4.370 CV     1
 OR {  769}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 132  and name HA  ))
 OR {  769}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 132  and name HA  ))
 OR {  769}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 93   and name HA1 ))
 ASSI {  780}
   (( segid "    " and resid 127  and name HG2 ))
   (  segid "    " and resid 43   and name HZ% )
      3.200     1.300     1.300 peak   780 spectrum    1 weight  0.10000E+01 volume  0.32184E-02 ppm1      2.214 ppm2      6.840 CV     1
 OR {  780}
   (( segid "    " and resid 127  and name HG1 ))
   (  segid "    " and resid 43   and name HZ% )
 OR {  780}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 121  and name HE3 ))
 ASSI {  784}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 14   and name HA  ))
      3.800     1.800     1.800 peak   784 spectrum    1 weight  0.10000E+01 volume  0.89094E-03 ppm1      2.196 ppm2      4.901 CV     1
 OR {  784}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 121  and name HA  ))
 OR {  784}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI {  800}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 6    and name HN  ))
      3.900     1.900     1.900 peak   800 spectrum    1 weight  0.10000E+01 volume  0.11916E-02 ppm1      2.260 ppm2      9.039 CV     1
 OR {  800}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 118  and name HN  ))
 OR {  800}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 132  and name HN  ))
 ASSI {  801}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 119  and name HN  ))
      3.200     1.300     1.300 peak   801 spectrum    1 weight  0.10000E+01 volume  0.20758E-02 ppm1      2.257 ppm2      8.868 CV     1
 OR {  801}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 31   and name HN  ))
 ASSI {  803}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 83   and name HA  ))
      2.600     0.900     0.900 peak   803 spectrum    1 weight  0.10000E+01 volume  0.31834E-02 ppm1      2.261 ppm2      4.705 CV     1
 OR {  803}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 5    and name HA  ))
 OR {  803}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 118  and name HA1 ))
 ASSI {  810}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 142  and name HA  ))
      2.900     1.000     1.000 peak   810 spectrum    1 weight  0.10000E+01 volume  0.19323E-02 ppm1      2.149 ppm2      5.109 CV     1
 OR {  810}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 141  and name HA  ))
 ASSI {  812}
   (( segid "    " and resid 142  and name HB  ))
   (  segid "    " and resid 15   and name HG2%)
      4.300     2.300     1.700 peak   812 spectrum    1 weight  0.10000E+01 volume  0.95654E-03 ppm1      2.139 ppm2      1.162 CV     1
 OR {  812}
   (( segid "    " and resid 142  and name HB  ))
   (  segid "    " and resid 141  and name HG2%)
 ASSI {  814}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 37   and name HA  ))
      2.700     0.900     0.900 peak   814 spectrum    1 weight  0.10000E+01 volume  0.32356E-02 ppm1      1.874 ppm2      4.508 CV     1
 OR {  814}
   (( segid "    " and resid 7    and name HB  ))
   (( segid "    " and resid 7    and name HA  ))
 OR {  814}
   (( segid "    " and resid 7    and name HB  ))
   (( segid "    " and resid 136  and name HA1 ))
 ASSI {  815}
   (( segid "    " and resid 7    and name HB  ))
   (( segid "    " and resid 134  and name HB  ))
      3.500     1.500     1.500 peak   815 spectrum    1 weight  0.10000E+01 volume  0.16315E-02 ppm1      1.866 ppm2      4.671 CV     1
 OR {  815}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 90   and name HA1 ))
 OR {  815}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 39   and name HA  ))
 OR {  815}
   (( segid "    " and resid 7    and name HB  ))
   (( segid "    " and resid 118  and name HA1 ))
 ASSI {  844}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 84   and name HA  ))
      4.400     2.400     1.600 peak   844 spectrum    1 weight  0.10000E+01 volume  0.63941E-03 ppm1      2.240 ppm2      5.688 CV     1
 OR {  844}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 41   and name HA  ))
 OR {  844}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 32   and name HA  ))
 OR {  844}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 82   and name HN  ))
 ASSI {  846}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 80   and name HB1 ))
      4.300     2.300     1.700 peak   846 spectrum    1 weight  0.10000E+01 volume  0.71310E-03 ppm1      2.243 ppm2      2.686 CV     1
 OR {  846}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 63   and name HB2 ))
 OR {  846}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 84   and name HB2 ))
 OR {  846}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 112  and name HB2 ))
 ASSI {  847}
   (( segid "    " and resid 83   and name HB  ))
   (  segid "    " and resid 83   and name HG1%)
      2.400     0.700     0.700 peak   847 spectrum    1 weight  0.10000E+01 volume  0.58405E-02 ppm1      2.239 ppm2      1.100 CV     1
 OR {  847}
   (( segid "    " and resid 5    and name HB  ))
   (  segid "    " and resid 5    and name HG2%)
 ASSI {  851}
   (( segid "    " and resid 27   and name HB1 ))
   (  segid "    " and resid 95   and name HG2%)
      3.500     1.500     1.500 peak   851 spectrum    1 weight  0.10000E+01 volume  0.28955E-02 ppm1      1.937 ppm2      1.071 CV     1
 OR {  851}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 96   and name HG12))
 ASSI {  852}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 90   and name HN  ))
      2.900     1.100     1.100 peak   852 spectrum    1 weight  0.10000E+01 volume  0.36242E-02 ppm1      1.866 ppm2      8.272 CV     1
 OR {  852}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 39   and name HN  ))
 ASSI {  856}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 86   and name HE1 ))
      4.600     2.700     1.400 peak   856 spectrum    1 weight  0.10000E+01 volume  0.35758E-03 ppm1      1.861 ppm2      2.657 CV     1
 OR {  856}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 35   and name HB2 ))
 OR {  856}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 84   and name HB2 ))
 OR {  856}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {  857}
   (( segid "    " and resid 89   and name HB  ))
   (  segid "    " and resid 89   and name HG1%)
      2.100     0.600     0.600 peak   857 spectrum    1 weight  0.10000E+01 volume  0.13344E-01 ppm1      1.869 ppm2      0.841 CV     1
 OR {  857}
   (( segid "    " and resid 7    and name HB  ))
   (  segid "    " and resid 7    and name HG1%)
 OR {  857}
   (( segid "    " and resid 89   and name HB  ))
   (  segid "    " and resid 89   and name HG2%)
 ASSI {  861}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 38   and name HA  ))
      2.600     0.800     0.800 peak   861 spectrum    1 weight  0.10000E+01 volume  0.46533E-02 ppm1      1.851 ppm2      4.844 CV     1
 OR {  861}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI {  871}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 124  and name HA  ))
      3.600     1.700     1.700 peak   871 spectrum    1 weight  0.10000E+01 volume  0.18200E-02 ppm1      1.787 ppm2      4.388 CV     1
 OR {  871}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 124  and name HA  ))
 OR {  871}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI {  882}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HN  ))
      3.100     1.200     1.200 peak   882 spectrum    1 weight  0.10000E+01 volume  0.32275E-02 ppm1      1.643 ppm2      8.485 CV     1
 OR {  882}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI {  901}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 39   and name HN  ))
      4.200     2.200     1.800 peak   901 spectrum    1 weight  0.10000E+01 volume  0.48130E-03 ppm1      2.754 ppm2      8.211 CV     1
 OR {  901}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 123  and name HN  ))
 ASSI {  903}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 121  and name HE3 ))
      4.500     2.600     1.500 peak   903 spectrum    1 weight  0.10000E+01 volume  0.92789E-03 ppm1      2.757 ppm2      6.865 CV     1
 OR {  903}
   (( segid "    " and resid 121  and name HB1 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI {  906}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 120  and name HA  ))
      4.300     2.400     1.700 peak   906 spectrum    1 weight  0.10000E+01 volume  0.56023E-03 ppm1      2.763 ppm2      5.682 CV     1
 OR {  906}
   (( segid "    " and resid 121  and name HB1 ))
   (  segid "    " and resid 85   and name HE% )
 OR {  906}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 41   and name HA  ))
 ASSI {  911}
   (( segid "    " and resid 121  and name HB1 ))
   (  segid "    " and resid 83   and name HG2%)
      4.800     2.800     1.200 peak   911 spectrum    1 weight  0.10000E+01 volume  0.33846E-03 ppm1      2.759 ppm2      0.830 CV     1
 OR {  911}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI {  917}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 105  and name HN  ))
      3.400     1.400     1.400 peak   917 spectrum    1 weight  0.10000E+01 volume  0.11707E-02 ppm1      2.514 ppm2      7.677 CV     1
 OR {  917}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 122  and name HN  ))
 ASSI {  918}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 121  and name HE3 ))
      2.900     1.100     1.100 peak   918 spectrum    1 weight  0.10000E+01 volume  0.13019E-02 ppm1      2.509 ppm2      6.862 CV     1
 OR {  918}
   (( segid "    " and resid 121  and name HB2 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI {  919}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 41   and name HA  ))
      4.500     2.500     1.500 peak   919 spectrum    1 weight  0.10000E+01 volume  0.58451E-03 ppm1      2.512 ppm2      5.687 CV     1
 OR {  919}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 120  and name HA  ))
 ASSI {  926}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 129  and name HA  ))
      3.000     1.100     1.100 peak   926 spectrum    1 weight  0.10000E+01 volume  0.26307E-02 ppm1      2.496 ppm2      4.687 CV     1
 OR {  926}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 65   and name HA  ))
 ASSI {  927}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 83   and name HB  ))
      3.400     1.500     1.500 peak   927 spectrum    1 weight  0.10000E+01 volume  0.24770E-02 ppm1      2.500 ppm2      2.226 CV     1
 OR {  927}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 103  and name HB1 ))
 OR {  927}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 103  and name HB1 ))
 OR {  927}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 101  and name HB2 ))
 ASSI {  928}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 16   and name HB1 ))
      2.800     1.000     1.000 peak   928 spectrum    1 weight  0.10000E+01 volume  0.26658E-02 ppm1      2.493 ppm2      2.051 CV     1
 OR {  928}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 16   and name HB1 ))
 OR {  928}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI {  935}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 84   and name HN  ))
      3.600     1.600     1.600 peak   935 spectrum    1 weight  0.10000E+01 volume  0.17562E-02 ppm1      2.243 ppm2      9.506 CV     1
 OR {  935}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 51   and name HN  ))
 OR {  935}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  936}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 16   and name HD2 ))
      3.700     1.700     1.700 peak   936 spectrum    1 weight  0.10000E+01 volume  0.78671E-03 ppm1      2.246 ppm2      3.185 CV     1
 OR {  936}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 129  and name HB1 ))
 ASSI {  951}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
      4.300     2.300     1.700 peak   951 spectrum    1 weight  0.10000E+01 volume  0.48490E-03 ppm1      2.004 ppm2      5.677 CV     1
 OR {  951}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 84   and name HA  ))
 OR {  951}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 85   and name HA  ))
 OR {  951}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 41   and name HA  ))
 OR {  951}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 32   and name HA  ))
 OR {  951}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 120  and name HA  ))
 OR {  951}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI {  952}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HA  ))
      2.600     0.800     0.800 peak   952 spectrum    1 weight  0.10000E+01 volume  0.45732E-02 ppm1      2.014 ppm2      4.695 CV     1
 OR {  952}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {  952}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {  952}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HA  ))
 ASSI {  953}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 40   and name HA  ))
      2.900     1.100     1.100 peak   953 spectrum    1 weight  0.10000E+01 volume  0.25459E-02 ppm1      2.009 ppm2      3.922 CV     1
 OR {  953}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 71   and name HD1 ))
 ASSI {  955}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HN  ))
      2.800     1.000     1.000 peak   955 spectrum    1 weight  0.10000E+01 volume  0.34340E-02 ppm1      1.973 ppm2      8.898 CV     1
 OR {  955}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HN  ))
 OR {  955}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 4    and name HN  ))
 ASSI {  957}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 133  and name HN  ))
      4.300     2.400     1.700 peak   957 spectrum    1 weight  0.10000E+01 volume  0.59871E-03 ppm1      1.965 ppm2      8.337 CV     1
 OR {  957}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 133  and name HN  ))
 OR {  957}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 3    and name HN  ))
 OR {  957}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 143  and name HN  ))
 OR {  957}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 134  and name HN  ))
 OR {  957}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 134  and name HN  ))
 ASSI {  958}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.500     0.800     0.800 peak   958 spectrum    1 weight  0.10000E+01 volume  0.54533E-02 ppm1      1.965 ppm2      4.743 CV     1
 OR {  958}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {  958}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HA  ))
 ASSI {  960}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 5    and name HN  ))
      3.700     1.700     1.700 peak   960 spectrum    1 weight  0.10000E+01 volume  0.10740E-02 ppm1      1.949 ppm2      9.324 CV     1
 OR {  960}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HN  ))
 OR {  960}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 97   and name HN  ))
 ASSI {  962}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 16   and name HD2 ))
      3.500     1.500     1.500 peak   962 spectrum    1 weight  0.10000E+01 volume  0.12465E-02 ppm1      1.956 ppm2      3.159 CV     1
 OR {  962}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 94   and name HA2 ))
 OR {  962}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 92   and name HB1 ))
 ASSI {  963}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HB1 ))
      1.500     0.300     0.700 peak   963 spectrum    1 weight  0.10000E+01 volume  0.25052E-01 ppm1      1.946 ppm2      2.289 CV     1
 OR {  963}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 24   and name HG1 ))
 ASSI {  964}
   (( segid "    " and resid 109  and name HB2 ))
   (  segid "    " and resid 140  and name HD1%)
      3.800     1.800     1.800 peak   964 spectrum    1 weight  0.10000E+01 volume  0.13614E-02 ppm1      1.947 ppm2      0.704 CV     1
 OR {  964}
   (( segid "    " and resid 109  and name HB2 ))
   (  segid "    " and resid 140  and name HD2%)
 OR {  964}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 98   and name HG12))
 OR {  964}
   (( segid "    " and resid 27   and name HB1 ))
   (  segid "    " and resid 28   and name HG1%)
 OR {  964}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 98   and name HG12))
 ASSI {  967}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 84   and name HZ  ))
      4.600     2.700     1.400 peak   967 spectrum    1 weight  0.10000E+01 volume  0.75711E-03 ppm1      1.660 ppm2      6.366 CV     1
 OR {  967}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 77   and name HZ3 ))
 ASSI {  970}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 16   and name HB1 ))
      3.200     1.300     1.300 peak   970 spectrum    1 weight  0.10000E+01 volume  0.18503E-02 ppm1      1.456 ppm2      2.027 CV     1
 OR {  970}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 77   and name HB1 ))
 ASSI {  978}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 107  and name HB  ))
      4.700     2.800     1.300 peak   978 spectrum    1 weight  0.10000E+01 volume  0.38939E-03 ppm1      1.421 ppm2      3.746 CV     1
 OR {  978}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 17   and name HA1 ))
 OR {  978}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 16   and name HA  ))
 OR {  978}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 17   and name HA2 ))
 OR {  978}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI {  979}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HB1 ))
      1.900     0.500     0.500 peak   979 spectrum    1 weight  0.10000E+01 volume  0.55821E-02 ppm1      1.432 ppm2      2.460 CV     1
 OR {  979}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  980}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 72   and name HB2 ))
      3.800     1.800     1.800 peak   980 spectrum    1 weight  0.10000E+01 volume  0.18469E-02 ppm1      1.424 ppm2      2.225 CV     1
 OR {  980}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 72   and name HB1 ))
 OR {  980}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 103  and name HB1 ))
 ASSI {  981}
   (( segid "    " and resid 104  and name HB2 ))
   (  segid "    " and resid 105  and name HG2%)
      4.100     2.100     1.900 peak   981 spectrum    1 weight  0.10000E+01 volume  0.63029E-03 ppm1      1.421 ppm2      1.111 CV     1
 OR {  981}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 96   and name HG12))
 OR {  981}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI {  998}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 77   and name HB1 ))
      3.500     1.500     1.500 peak   998 spectrum    1 weight  0.10000E+01 volume  0.12358E-02 ppm1      1.268 ppm2      2.001 CV     1
 OR {  998}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 40   and name HB  ))
 ASSI { 1016}
   (( segid "    " and resid 104  and name HB1 ))
   (  segid "    " and resid 65   and name HD2%)
      3.500     1.500     1.500 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.10844E-02 ppm1      2.478 ppm2      0.385 CV     1
 OR { 1016}
   (( segid "    " and resid 100  and name HB  ))
   (  segid "    " and resid 19   and name HD2%)
 ASSI { 1020}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 74   and name HN  ))
      2.800     1.000     1.000 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.19113E-02 ppm1      2.404 ppm2      8.100 CV     1
 OR { 1020}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI { 1023}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 92   and name HH2 ))
      4.200     2.200     1.800 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.98581E-03 ppm1      2.404 ppm2      6.808 CV     1
 OR { 1023}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 74   and name HD22))
 ASSI { 1027}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 77   and name HE1 ))
      4.100     2.100     1.900 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.94981E-03 ppm1      2.400 ppm2      9.197 CV     1
 OR { 1027}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 97   and name HN  ))
 ASSI { 1035}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 55   and name HZ  ))
      3.800     1.800     1.800 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.13706E-02 ppm1      2.270 ppm2      6.957 CV     1
 OR { 1035}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 55   and name HZ  ))
 OR { 1035}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 121  and name HH2 ))
 OR { 1035}
   (( segid "    " and resid 83   and name HB  ))
   (  segid "    " and resid 84   and name HD% )
 ASSI { 1036}
   (( segid "    " and resid 50   and name HB2 ))
   (  segid "    " and resid 55   and name HD% )
      4.000     2.000     2.000 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.88306E-03 ppm1      2.278 ppm2      6.616 CV     1
 OR { 1036}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 55   and name HD% )
 OR { 1036}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 49   and name HD% )
 OR { 1036}
   (( segid "    " and resid 50   and name HB2 ))
   (  segid "    " and resid 49   and name HD% )
 ASSI { 1039}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HD1 ))
      3.400     1.500     1.500 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.25157E-02 ppm1      2.255 ppm2      3.877 CV     1
 OR { 1039}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 131  and name HD1 ))
 OR { 1039}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 110  and name HA2 ))
 ASSI { 1046}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 78   and name HN  ))
      3.200     1.300     1.300 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.15657E-02 ppm1      2.053 ppm2      9.227 CV     1
 OR { 1046}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 85   and name HN  ))
 OR { 1046}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HE1 ))
 ASSI { 1050}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 77   and name HZ3 ))
      4.100     2.100     1.900 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.96735E-03 ppm1      2.050 ppm2      6.387 CV     1
 OR { 1050}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HZ3 ))
 ASSI { 1052}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 25   and name HN  ))
      4.000     2.000     2.000 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.18418E-02 ppm1      1.974 ppm2      8.567 CV     1
 OR { 1052}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 111  and name HN  ))
 OR { 1052}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 1053}
   (( segid "    " and resid 24   and name HB1 ))
   (  segid "    " and resid 99   and name HD% )
      3.500     1.500     1.500 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.17238E-02 ppm1      1.973 ppm2      6.796 CV     1
 OR { 1053}
   (( segid "    " and resid 109  and name HB2 ))
   (  segid "    " and resid 112  and name HD% )
 OR { 1053}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 26   and name HN  ))
 ASSI { 1055}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 30   and name HA  ))
      4.100     2.100     1.900 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.11026E-02 ppm1      1.968 ppm2      5.005 CV     1
 OR { 1055}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 3    and name HA  ))
 OR { 1055}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 3    and name HA  ))
 OR { 1055}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 1056}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 24   and name HA  ))
      2.300     0.700     0.700 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.61485E-02 ppm1      1.969 ppm2      4.170 CV     1
 OR { 1056}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HA  ))
 ASSI { 1062}
   (( segid "    " and resid 126  and name HB1 ))
   (( segid "    " and resid 127  and name HN  ))
      3.700     1.700     1.700 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.16266E-02 ppm1      1.798 ppm2      7.890 CV     1
 OR { 1062}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI { 1065}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 127  and name HN  ))
      3.600     1.600     1.600 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.15623E-02 ppm1      1.740 ppm2      7.953 CV     1
 OR { 1065}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI { 1070}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 77   and name HD1 ))
      3.100     1.200     1.200 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.19107E-02 ppm1      1.667 ppm2      6.819 CV     1
 OR { 1070}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 26   and name HN  ))
 OR { 1070}
   (( segid "    " and resid 24   and name HB2 ))
   (  segid "    " and resid 99   and name HD% )
 ASSI { 1074}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 77   and name HA  ))
      3.100     1.200     1.200 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.21609E-02 ppm1      1.678 ppm2      4.695 CV     1
 OR { 1074}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 76   and name HA  ))
 ASSI { 1077}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 77   and name HB1 ))
      1.600     0.300     0.600 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.23217E-01 ppm1      1.672 ppm2      1.993 CV     1
 OR { 1077}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 24   and name HB1 ))
 ASSI { 1079}
   (( segid "    " and resid 24   and name HB2 ))
   (  segid "    " and resid 25   and name HG2%)
      4.200     2.200     1.800 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.80896E-03 ppm1      1.673 ppm2      0.524 CV     1
 OR { 1079}
   (( segid "    " and resid 24   and name HB2 ))
   (  segid "    " and resid 98   and name HD1%)
 OR { 1079}
   (( segid "    " and resid 24   and name HB2 ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 1080}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 78   and name HN  ))
      3.700     1.800     1.800 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.18131E-02 ppm1      1.668 ppm2      9.218 CV     1
 OR { 1080}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 97   and name HN  ))
 OR { 1080}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 1081}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
      4.600     2.600     1.400 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.77758E-03 ppm1      1.662 ppm2      2.686 CV     1
 OR { 1081}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 1085}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 77   and name HE1 ))
      3.600     1.700     1.700 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.11477E-02 ppm1      1.470 ppm2      9.214 CV     1
 OR { 1085}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 97   and name HN  ))
 ASSI { 1087}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 74   and name HN  ))
      4.100     2.200     1.900 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.99580E-03 ppm1      1.467 ppm2      8.098 CV     1
 OR { 1087}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI { 1088}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 92   and name HZ2 ))
      3.000     1.200     1.200 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.85131E-03 ppm1      1.468 ppm2      7.645 CV     1
 OR { 1088}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 74   and name HD21))
 ASSI { 1089}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 92   and name HH2 ))
      3.400     1.400     1.400 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.10399E-02 ppm1      1.466 ppm2      6.813 CV     1
 OR { 1089}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 74   and name HD22))
 ASSI { 1125}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 101  and name HN  ))
      3.700     1.700     1.700 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.17391E-02 ppm1      2.466 ppm2      8.577 CV     1
 OR { 1125}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 104  and name HN  ))
 OR { 1125}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 1127}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 19   and name HA  ))
      5.100     3.200     0.900 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.40369E-03 ppm1      2.468 ppm2      4.343 CV     1
 OR { 1127}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI { 1128}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 40   and name HA  ))
      4.100     2.100     1.900 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.91460E-03 ppm1      2.460 ppm2      3.879 CV     1
 OR { 1128}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 1144}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HA  ))
      3.000     1.100     1.100 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.35719E-02 ppm1      2.013 ppm2      3.989 CV     1
 OR { 1144}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 71   and name HD1 ))
 ASSI { 1146}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 117  and name HG2%)
      3.400     1.500     1.500 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.26396E-02 ppm1      2.017 ppm2      1.409 CV     1
 OR { 1146}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 71   and name HB1 ))
 ASSI { 1148}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 27   and name HD1 ))
      4.300     2.300     1.700 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.11900E-02 ppm1      2.000 ppm2      3.507 CV     1
 OR { 1148}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 93   and name HA2 ))
 OR { 1148}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 27   and name HD2 ))
 ASSI { 1150}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 72   and name HA  ))
      3.600     1.600     1.600 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.30059E-02 ppm1      1.699 ppm2      4.575 CV     1
 OR { 1150}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 23   and name HA  ))
 ASSI { 1157}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 85   and name HB1 ))
      3.500     1.500     1.500 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.15332E-02 ppm1      2.492 ppm2      2.730 CV     1
 OR { 1157}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 121  and name HB1 ))
 ASSI { 1158}
   (( segid "    " and resid 39   and name HB1 ))
   (  segid "    " and resid 85   and name HE% )
      4.800     2.800     1.200 peak  1158 spectrum    1 weight  0.10000E+01 volume  0.32916E-03 ppm1      2.477 ppm2      5.731 CV     1
 OR { 1158}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
 OR { 1158}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 41   and name HA  ))
 ASSI { 1162}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 85   and name HE% )
      5.000     3.100     1.000 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.26403E-03 ppm1      2.386 ppm2      5.733 CV     1
 OR { 1162}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 120  and name HA  ))
 OR { 1162}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 1163}
   (( segid "    " and resid 2    and name HB1 ))
   (( segid "    " and resid 2    and name HN  ))
      2.600     0.900     0.900 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.58187E-02 ppm1      1.994 ppm2      8.240 CV     1
 OR { 1163}
   (( segid "    " and resid 2    and name HB1 ))
   (( segid "    " and resid 3    and name HN  ))
 ASSI { 1169}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 5    and name HA  ))
      4.400     2.400     1.600 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.11356E-02 ppm1      1.923 ppm2      4.688 CV     1
 OR { 1169}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 134  and name HB  ))
 ASSI { 1173}
   (( segid "    " and resid 6    and name HB1 ))
   (  segid "    " and resid 134  and name HG2%)
      4.100     2.100     1.900 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      1.890 ppm2      1.225 CV     1
 OR { 1173}
   (( segid "    " and resid 6    and name HB2 ))
   (  segid "    " and resid 134  and name HG2%)
 OR { 1173}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 86   and name HB1 ))
 OR { 1173}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 96   and name HG11))
 OR { 1173}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 86   and name HB1 ))
 OR { 1173}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 96   and name HG11))
 OR { 1173}
   (( segid "    " and resid 71   and name HG2 ))
   (  segid "    " and resid 79   and name HG2%)
 ASSI { 1180}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HA  ))
      3.200     1.300     1.300 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.22134E-02 ppm1      1.841 ppm2      4.864 CV     1
 OR { 1180}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 71   and name HA  ))
 OR { 1180}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 70   and name HA  ))
 OR { 1180}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 1181}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 5    and name HA  ))
      4.200     2.200     1.800 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.89524E-03 ppm1      1.839 ppm2      4.683 CV     1
 OR { 1181}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 77   and name HA  ))
 OR { 1181}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 76   and name HA  ))
 OR { 1181}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 74   and name HA  ))
 OR { 1181}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 77   and name HA  ))
 OR { 1181}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 76   and name HA  ))
 OR { 1181}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 1186}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
      4.100     2.100     1.900 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.62732E-03 ppm1      2.487 ppm2      9.083 CV     1
 OR { 1186}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 121  and name HN  ))
 ASSI { 1188}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 121  and name HN  ))
      3.900     1.900     1.900 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.69279E-03 ppm1      2.408 ppm2      9.100 CV     1
 OR { 1188}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 40   and name HN  ))
 OR { 1188}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 1189}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HN  ))
      3.000     1.100     1.100 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.16915E-02 ppm1      2.398 ppm2      8.220 CV     1
 OR { 1189}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 17   and name HN  ))
 ASSI { 1190}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 120  and name HB1 ))
      4.500     2.600     1.500 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.43449E-03 ppm1      2.409 ppm2      2.969 CV     1
 OR { 1190}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 14   and name HE1 ))
 OR { 1190}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 43   and name HE1 ))
 OR { 1190}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 43   and name HE2 ))
 ASSI { 1191}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 121  and name HB1 ))
      2.900     1.000     1.000 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.12380E-02 ppm1      2.404 ppm2      2.777 CV     1
 OR { 1191}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 85   and name HB1 ))
 ASSI { 1193}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 38   and name HA  ))
      4.200     2.200     1.800 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.88326E-03 ppm1      2.385 ppm2      4.868 CV     1
 OR { 1193}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 1194}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 89   and name HG1%)
      4.600     2.600     1.400 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.53613E-03 ppm1      2.385 ppm2      0.907 CV     1
 OR { 1194}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 38   and name HG2 ))
 OR { 1194}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 86   and name HG1 ))
 ASSI { 1195}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 15   and name HN  ))
      3.600     1.600     1.600 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.82175E-03 ppm1      2.378 ppm2      8.536 CV     1
 OR { 1195}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 86   and name HN  ))
 ASSI { 1197}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 121  and name HE3 ))
      5.000     3.100     1.000 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.44716E-03 ppm1      2.379 ppm2      6.832 CV     1
 OR { 1197}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI { 1198}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 41   and name HB% )
      4.300     2.300     1.700 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.73052E-03 ppm1      2.370 ppm2      1.506 CV     1
 OR { 1198}
   (( segid "    " and resid 18   and name HB1 ))
   (  segid "    " and resid 23   and name HB% )
 ASSI { 1199}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 14   and name HB2 ))
      4.300     2.300     1.700 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.59772E-03 ppm1      2.372 ppm2      1.265 CV     1
 OR { 1199}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 38   and name HG1 ))
 OR { 1199}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 122  and name HB% )
 OR { 1199}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 40   and name HG2%)
 ASSI { 1200}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 25   and name HG12))
      3.600     1.700     1.700 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.90981E-03 ppm1      2.379 ppm2      1.095 CV     1
 OR { 1200}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 19   and name HB2 ))
 OR { 1200}
   (( segid "    " and resid 18   and name HB1 ))
   (  segid "    " and resid 20   and name HG2%)
 ASSI { 1204}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 95   and name HN  ))
      4.200     2.200     1.800 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.52894E-03 ppm1      2.251 ppm2      8.527 CV     1
 OR { 1204}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 1207}
   (( segid "    " and resid 18   and name HB2 ))
   (  segid "    " and resid 19   and name HD2%)
      4.300     2.300     1.700 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.50636E-03 ppm1      2.244 ppm2      0.390 CV     1
 OR { 1207}
   (( segid "    " and resid 18   and name HB2 ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI { 1211}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 132  and name HA  ))
      4.300     2.300     1.700 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.26483E-03 ppm1      1.977 ppm2      4.457 CV     1
 OR { 1211}
   (( segid "    " and resid 2    and name HB1 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI { 1217}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 107  and name HN  ))
      4.000     2.000     2.000 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.86572E-03 ppm1      1.728 ppm2      7.279 CV     1
 OR { 1217}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HE  ))
 ASSI { 1220}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 15   and name HG2%)
      4.400     2.400     1.600 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.60626E-03 ppm1      1.734 ppm2      1.118 CV     1
 OR { 1220}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 1225}
   (( segid "    " and resid 18   and name HB1 ))
   (  segid "    " and resid 19   and name HD2%)
      3.900     1.900     1.900 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.43511E-03 ppm1      2.363 ppm2      0.435 CV     1
 OR { 1225}
   (( segid "    " and resid 18   and name HB1 ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI { 1233}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 97   and name HA2 ))
      4.800     2.900     1.200 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.30894E-03 ppm1      2.281 ppm2      3.348 CV     1
 OR { 1233}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI { 1246}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 95   and name HB  ))
      3.700     1.700     1.700 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.78274E-03 ppm1      2.186 ppm2      3.750 CV     1
 OR { 1246}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 17   and name HA2 ))
 OR { 1246}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 17   and name HA1 ))
 ASSI { 1247}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name HB1 ))
      4.900     3.100     1.100 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.26202E-03 ppm1      2.175 ppm2      3.350 CV     1
 OR { 1247}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 97   and name HA2 ))
 ASSI { 1248}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 65   and name HB1 ))
      4.100     2.100     1.900 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.50611E-03 ppm1      2.091 ppm2      1.548 CV     1
 OR { 1248}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 1249}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 16   and name HE  ))
      4.600     2.700     1.400 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.77886E-03 ppm1      2.072 ppm2      7.287 CV     1
 OR { 1249}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 107  and name HN  ))
 ASSI { 1253}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 106  and name HN  ))
      3.200     1.300     1.300 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.30617E-02 ppm1      2.052 ppm2      8.280 CV     1
 OR { 1253}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 17   and name HN  ))
 ASSI { 1255}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 15   and name HB  ))
      4.400     2.500     1.600 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.11064E-02 ppm1      2.052 ppm2      4.473 CV     1
 OR { 1255}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI { 1260}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 19   and name HG  ))
      3.100     1.200     1.200 peak  1260 spectrum    1 weight  0.10000E+01 volume  0.26633E-02 ppm1      2.056 ppm2      0.731 CV     1
 OR { 1260}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 65   and name HB2 ))
 ASSI { 1264}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 133  and name HA2 ))
      4.200     2.200     1.800 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.49753E-03 ppm1      1.911 ppm2      3.832 CV     1
 OR { 1264}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 8    and name HA2 ))
 OR { 1264}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 131  and name HD1 ))
 ASSI { 1310}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HN  ))
      2.800     1.000     1.000 peak  1310 spectrum    1 weight  0.10000E+01 volume  0.39415E-02 ppm1      1.885 ppm2      7.886 CV     1
 OR { 1310}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 127  and name HN  ))
 OR { 1310}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 75   and name HN  ))
 ASSI { 1320}
   (( segid "    " and resid 42   and name HG  ))
   (( segid "    " and resid 85   and name HB2 ))
      4.800     2.900     1.200 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.49237E-03 ppm1      1.769 ppm2      2.398 CV     1
 OR { 1320}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 18   and name HB1 ))
 OR { 1320}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 1321}
   (( segid "    " and resid 42   and name HG  ))
   (( segid "    " and resid 83   and name HB  ))
      4.600     2.600     1.400 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.57097E-03 ppm1      1.774 ppm2      2.286 CV     1
 OR { 1321}
   (( segid "    " and resid 42   and name HG  ))
   (( segid "    " and resid 5    and name HB  ))
 OR { 1321}
   (( segid "    " and resid 42   and name HG  ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI { 1327}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 17   and name HN  ))
      3.100     1.200     1.200 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.13455E-02 ppm1      1.745 ppm2      8.287 CV     1
 OR { 1327}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 1337}
   (( segid "    " and resid 126  and name HD1 ))
   (( segid "    " and resid 126  and name HG2 ))
      1.900     0.500     0.500 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.19158E-01 ppm1      1.642 ppm2      1.319 CV     1
 OR { 1337}
   (( segid "    " and resid 139  and name HD1 ))
   (( segid "    " and resid 139  and name HG1 ))
 OR { 1337}
   (( segid "    " and resid 126  and name HD2 ))
   (( segid "    " and resid 126  and name HG1 ))
 OR { 1337}
   (( segid "    " and resid 139  and name HD1 ))
   (( segid "    " and resid 139  and name HG2 ))
 OR { 1337}
   (( segid "    " and resid 126  and name HD1 ))
   (( segid "    " and resid 126  and name HG1 ))
 ASSI { 1341}
   (( segid "    " and resid 139  and name HD1 ))
   (( segid "    " and resid 111  and name HB2 ))
      4.100     2.100     1.900 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.49972E-03 ppm1      1.621 ppm2      2.513 CV     1
 OR { 1341}
   (( segid "    " and resid 126  and name HD2 ))
   (( segid "    " and resid 121  and name HB2 ))
 ASSI { 1343}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 16   and name HN  ))
      3.400     1.500     1.500 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.17168E-02 ppm1      1.836 ppm2      8.541 CV     1
 OR { 1343}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 111  and name HN  ))
 ASSI { 1389}
   (( segid "    " and resid 64   and name HG1 ))
   (  segid "    " and resid 55   and name HE% )
      4.300     2.300     1.700 peak  1389 spectrum    1 weight  0.10000E+01 volume  0.81180E-03 ppm1      0.761 ppm2      7.178 CV     1
 OR { 1389}
   (( segid "    " and resid 64   and name HG1 ))
   (  segid "    " and resid 66   and name HD% )
 ASSI { 1390}
   (( segid "    " and resid 64   and name HG1 ))
   (  segid "    " and resid 55   and name HD% )
      4.400     2.400     1.600 peak  1390 spectrum    1 weight  0.10000E+01 volume  0.88830E-03 ppm1      0.770 ppm2      6.592 CV     1
 OR { 1390}
   (( segid "    " and resid 64   and name HG1 ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 1397}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 55   and name HD% )
      3.800     1.800     1.800 peak  1397 spectrum    1 weight  0.10000E+01 volume  0.12243E-02 ppm1     -0.138 ppm2      6.595 CV     1
 OR { 1397}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 1399}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 63   and name HA  ))
      4.100     2.100     1.900 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.14902E-02 ppm1     -0.140 ppm2      4.661 CV     1
 OR { 1399}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 65   and name HA  ))
 ASSI { 1404}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 103  and name HN  ))
      2.800     1.000     1.000 peak  1404 spectrum    1 weight  0.10000E+01 volume  0.48423E-02 ppm1      2.209 ppm2      8.574 CV     1
 OR { 1404}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 104  and name HN  ))
 OR { 1404}
   (( segid "    " and resid 24   and name HG1 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 1407}
   (( segid "    " and resid 103  and name HB1 ))
   (  segid "    " and resid 20   and name HG2%)
      3.800     1.800     1.800 peak  1407 spectrum    1 weight  0.10000E+01 volume  0.92277E-03 ppm1      2.204 ppm2      1.088 CV     1
 OR { 1407}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 1408}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 16   and name HN  ))
      2.800     1.000     1.000 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.52721E-02 ppm1      2.148 ppm2      8.523 CV     1
 OR { 1408}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 104  and name HN  ))
 OR { 1408}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI { 1412}
   (( segid "    " and resid 86   and name HD1 ))
   (( segid "    " and resid 39   and name HA  ))
      3.800     1.800     1.800 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.20612E-02 ppm1      1.364 ppm2      4.666 CV     1
 OR { 1412}
   (( segid "    " and resid 86   and name HD1 ))
   (( segid "    " and resid 77   and name HA  ))
 ASSI { 1431}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 39   and name HA  ))
      3.900     1.900     1.900 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.18575E-02 ppm1      0.265 ppm2      4.675 CV     1
 OR { 1431}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 77   and name HA  ))
 ASSI { 1438}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 55   and name HE% )
      3.600     1.600     1.600 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1     -0.143 ppm2      7.233 CV     1
 OR { 1438}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 66   and name HD% )
 ASSI { 1440}
   (( segid "    " and resid 24   and name HG1 ))
   (( segid "    " and resid 24   and name HD1 ))
      2.300     0.700     0.700 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.59421E-02 ppm1      2.207 ppm2      4.061 CV     1
 OR { 1440}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 103  and name HA  ))
 ASSI { 1443}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 106  and name HD21))
      3.900     1.900     1.900 peak  1443 spectrum    1 weight  0.10000E+01 volume  0.59004E-03 ppm1      2.146 ppm2      7.582 CV     1
 OR { 1443}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 98   and name HN  ))
 ASSI { 1444}
   (( segid "    " and resid 109  and name HG2 ))
   (  segid "    " and resid 112  and name HD% )
      4.200     2.200     1.800 peak  1444 spectrum    1 weight  0.10000E+01 volume  0.15004E-02 ppm1      2.128 ppm2      6.778 CV     1
 OR { 1444}
   (( segid "    " and resid 24   and name HG2 ))
   (  segid "    " and resid 99   and name HD% )
 ASSI { 1446}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 23   and name HA  ))
      3.500     1.500     1.500 peak  1446 spectrum    1 weight  0.10000E+01 volume  0.43445E-02 ppm1      2.123 ppm2      4.565 CV     1
 OR { 1446}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI { 1447}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HA  ))
      2.200     0.600     0.600 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.11513E-01 ppm1      2.129 ppm2      4.054 CV     1
 OR { 1447}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 24   and name HD1 ))
 ASSI { 1450}
   (( segid "    " and resid 103  and name HB2 ))
   (  segid "    " and resid 20   and name HG2%)
      3.700     1.700     1.700 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.11528E-02 ppm1      2.131 ppm2      1.128 CV     1
 OR { 1450}
   (( segid "    " and resid 109  and name HG2 ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 1454}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 106  and name HB1 ))
      3.700     1.700     1.700 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.60820E-03 ppm1      2.115 ppm2      2.943 CV     1
 OR { 1454}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 63   and name HB1 ))
 OR { 1454}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 106  and name HB1 ))
 ASSI { 1489}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 109  and name HD2 ))
      2.300     0.700     0.700 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.96017E-02 ppm1      1.817 ppm2      3.680 CV     1
 OR { 1489}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 16   and name HA  ))
 ASSI { 1490}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 16   and name HD2 ))
      2.300     0.700     0.700 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.44848E-02 ppm1      1.820 ppm2      3.079 CV     1
 OR { 1490}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 16   and name HD2 ))
 ASSI { 1494}
   (( segid "    " and resid 16   and name HG1 ))
   (  segid "    " and resid 112  and name HD% )
      3.600     1.600     1.600 peak  1494 spectrum    1 weight  0.10000E+01 volume  0.27653E-02 ppm1      1.804 ppm2      6.781 CV     1
 OR { 1494}
   (( segid "    " and resid 109  and name HG1 ))
   (  segid "    " and resid 112  and name HD% )
 ASSI { 1499}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 65   and name HA  ))
      4.200     2.200     1.800 peak  1499 spectrum    1 weight  0.10000E+01 volume  0.87839E-03 ppm1      1.734 ppm2      4.669 CV     1
 OR { 1499}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 56   and name HA  ))
 ASSI { 1500}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 65   and name HG  ))
      3.500     1.500     1.500 peak  1500 spectrum    1 weight  0.10000E+01 volume  0.22789E-02 ppm1      1.737 ppm2      1.209 CV     1
 OR { 1500}
   (( segid "    " and resid 16   and name HG2 ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 1505}
   (( segid "    " and resid 16   and name HG2 ))
   (  segid "    " and resid 65   and name HD2%)
      3.800     1.800     1.800 peak  1505 spectrum    1 weight  0.10000E+01 volume  0.40317E-03 ppm1      1.694 ppm2      0.421 CV     1
 OR { 1505}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 140  and name HG  ))
 ASSI { 1517}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 140  and name HA  ))
      4.000     2.000     2.000 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.82749E-03 ppm1      1.307 ppm2      5.362 CV     1
 OR { 1517}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI { 1519}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 140  and name HB1 ))
      3.200     1.300     1.300 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.30253E-02 ppm1      1.311 ppm2      1.694 CV     1
 OR { 1519}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 139  and name HB2 ))
 ASSI { 1522}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 113  and name HN  ))
      4.500     2.500     1.500 peak  1522 spectrum    1 weight  0.10000E+01 volume  0.56201E-03 ppm1      1.290 ppm2      8.709 CV     1
 OR { 1522}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 116  and name HN  ))
 ASSI { 1524}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 139  and name HA  ))
      3.800     1.800     1.800 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.66315E-03 ppm1      1.293 ppm2      4.968 CV     1
 OR { 1524}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 115  and name HA  ))
 OR { 1524}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 1533}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 112  and name HB2 ))
      4.700     2.700     1.300 peak  1533 spectrum    1 weight  0.10000E+01 volume  0.59520E-03 ppm1      1.280 ppm2      2.624 CV     1
 OR { 1533}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI { 1534}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 139  and name HB1 ))
      4.100     2.100     1.900 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.10099E-02 ppm1      1.279 ppm2      1.894 CV     1
 OR { 1534}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 10   and name HB1 ))
 OR { 1534}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 16   and name HG1 ))
 ASSI { 1542}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 100  and name HA  ))
      4.400     2.400     1.600 peak  1542 spectrum    1 weight  0.10000E+01 volume  0.58876E-03 ppm1      1.217 ppm2      3.499 CV     1
 OR { 1542}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 66   and name HB1 ))
 ASSI { 1543}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 26   and name HA1 ))
      4.400     2.400     1.600 peak  1543 spectrum    1 weight  0.10000E+01 volume  0.41302E-03 ppm1      1.172 ppm2      4.263 CV     1
 OR { 1543}
   (( segid "    " and resid 10   and name HG  ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI { 1582}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 26   and name HA1 ))
      3.900     1.900     1.900 peak  1582 spectrum    1 weight  0.10000E+01 volume  0.11997E-02 ppm1      0.649 ppm2      4.275 CV     1
 OR { 1582}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 97   and name HA1 ))
 ASSI { 1585}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 142  and name HN  ))
      3.500     1.500     1.500 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.20592E-02 ppm1      0.632 ppm2      9.492 CV     1
 OR { 1585}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 112  and name HN  ))
 ASSI { 1589}
   (  segid "    " and resid 140  and name HD1%)
   (  segid "    " and resid 112  and name HD% )
      3.700     1.800     1.800 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.21823E-02 ppm1      0.638 ppm2      6.752 CV     1
 OR { 1589}
   (( segid "    " and resid 98   and name HG12))
   (  segid "    " and resid 99   and name HD% )
 ASSI { 1594}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 141  and name HB  ))
      3.500     1.500     1.500 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.23153E-02 ppm1      0.627 ppm2      3.988 CV     1
 OR { 1594}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 138  and name HB  ))
 ASSI { 1599}
   (( segid "    " and resid 98   and name HG12))
   (  segid "    " and resid 98   and name HD1%)
      2.000     0.500     0.500 peak  1599 spectrum    1 weight  0.10000E+01 volume  0.18734E-01 ppm1      0.629 ppm2      0.412 CV     1
 OR { 1599}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 140  and name HG  ))
 ASSI { 1608}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 141  and name HA  ))
      3.300     1.300     1.300 peak  1608 spectrum    1 weight  0.10000E+01 volume  0.98932E-03 ppm1      0.374 ppm2      5.113 CV     1
 OR { 1608}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI { 1611}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 141  and name HB  ))
      4.500     2.600     1.500 peak  1611 spectrum    1 weight  0.10000E+01 volume  0.46669E-03 ppm1      0.376 ppm2      3.888 CV     1
 OR { 1611}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 110  and name HA2 ))
 ASSI { 1612}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 140  and name HB1 ))
      2.200     0.600     0.600 peak  1612 spectrum    1 weight  0.10000E+01 volume  0.61299E-02 ppm1      0.372 ppm2      1.716 CV     1
 OR { 1612}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI { 1615}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 14   and name HN  ))
      3.900     1.900     1.900 peak  1615 spectrum    1 weight  0.10000E+01 volume  0.81800E-03 ppm1      0.357 ppm2      8.740 CV     1
 OR { 1615}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 110  and name HN  ))
 ASSI { 1649}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 52   and name HN  ))
      2.900     1.100     1.100 peak  1649 spectrum    1 weight  0.10000E+01 volume  0.39184E-02 ppm1      1.997 ppm2      7.499 CV     1
 OR { 1649}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 1657}
   (( segid "    " and resid 109  and name HG1 ))
   (  segid "    " and resid 15   and name HG2%)
      4.700     2.800     1.300 peak  1657 spectrum    1 weight  0.10000E+01 volume  0.74658E-03 ppm1      1.833 ppm2      1.199 CV     1
 OR { 1657}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 65   and name HG  ))
 OR { 1657}
   (( segid "    " and resid 16   and name HG1 ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 1658}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 16   and name HN  ))
      2.900     1.000     1.000 peak  1658 spectrum    1 weight  0.10000E+01 volume  0.21205E-02 ppm1      1.824 ppm2      8.554 CV     1
 OR { 1658}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI { 1659}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 17   and name HN  ))
      4.100     2.100     1.900 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.80619E-03 ppm1      1.824 ppm2      8.264 CV     1
 OR { 1659}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 1660}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 16   and name HE  ))
      3.200     1.300     1.300 peak  1660 spectrum    1 weight  0.10000E+01 volume  0.12333E-02 ppm1      1.826 ppm2      7.268 CV     1
 OR { 1660}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 16   and name HE  ))
 ASSI { 1661}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 15   and name HA  ))
      4.500     2.500     1.500 peak  1661 spectrum    1 weight  0.10000E+01 volume  0.59681E-03 ppm1      1.819 ppm2      5.095 CV     1
 OR { 1661}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 15   and name HA  ))
 OR { 1661}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI { 1662}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 16   and name HD1 ))
      2.800     1.000     1.000 peak  1662 spectrum    1 weight  0.10000E+01 volume  0.27911E-02 ppm1      1.822 ppm2      3.297 CV     1
 OR { 1662}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 16   and name HD1 ))
 ASSI { 1663}
   (( segid "    " and resid 16   and name HG1 ))
   (  segid "    " and resid 140  and name HD2%)
      2.500     0.800     0.800 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.40612E-02 ppm1      1.820 ppm2      0.713 CV     1
 OR { 1663}
   (( segid "    " and resid 16   and name HG1 ))
   (  segid "    " and resid 140  and name HD1%)
 OR { 1663}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 19   and name HG  ))
 ASSI { 1670}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 17   and name HN  ))
      4.500     2.600     1.500 peak  1670 spectrum    1 weight  0.10000E+01 volume  0.77184E-03 ppm1      1.704 ppm2      8.257 CV     1
 OR { 1670}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 1693}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HN  ))
      2.900     1.100     1.100 peak  1693 spectrum    1 weight  0.10000E+01 volume  0.17888E-02 ppm1      1.390 ppm2      8.476 CV     1
 OR { 1693}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI { 1696}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 98   and name HA  ))
      2.600     0.900     0.900 peak  1696 spectrum    1 weight  0.10000E+01 volume  0.34592E-02 ppm1      1.390 ppm2      4.430 CV     1
 OR { 1696}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 1698}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HG1 ))
      1.600     0.300     0.600 peak  1698 spectrum    1 weight  0.10000E+01 volume  0.40388E-01 ppm1      1.395 ppm2      1.566 CV     1
 OR { 1698}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HB1 ))
 OR { 1698}
   (( segid "    " and resid 25   and name HG11))
   (( segid "    " and resid 25   and name HB  ))
 OR { 1698}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 1704}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 140  and name HN  ))
      4.500     2.600     1.500 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.26832E-03 ppm1      1.268 ppm2      9.230 CV     1
 OR { 1704}
   (( segid "    " and resid 114  and name HG  ))
   (( segid "    " and resid 139  and name HN  ))
 ASSI { 1706}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 72   and name HN  ))
      4.700     2.800     1.300 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.42916E-03 ppm1      1.221 ppm2      8.734 CV     1
 OR { 1706}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 67   and name HN  ))
 ASSI { 1707}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 101  and name HB1 ))
      4.100     2.100     1.900 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.52003E-03 ppm1      1.225 ppm2      2.660 CV     1
 OR { 1707}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI { 1710}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 23   and name HA  ))
      4.300     2.300     1.700 peak  1710 spectrum    1 weight  0.10000E+01 volume  0.48956E-03 ppm1      1.043 ppm2      4.500 CV     1
 OR { 1710}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 1712}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 25   and name HB  ))
      2.500     0.800     0.800 peak  1712 spectrum    1 weight  0.10000E+01 volume  0.78906E-02 ppm1      1.041 ppm2      1.515 CV     1
 OR { 1712}
   (( segid "    " and resid 25   and name HG12))
   (  segid "    " and resid 23   and name HB% )
 ASSI { 1717}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 98   and name HN  ))
      5.000     3.200     1.000 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.43693E-03 ppm1      1.032 ppm2      7.609 CV     1
 OR { 1717}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 19   and name HN  ))
 ASSI { 1721}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 18   and name HB1 ))
      3.800     1.800     1.800 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.94048E-03 ppm1      1.033 ppm2      2.450 CV     1
 OR { 1721}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 18   and name HG1 ))
 OR { 1721}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 100  and name HB  ))
 ASSI { 1722}
   (( segid "    " and resid 25   and name HG12))
   (  segid "    " and resid 25   and name HD1%)
      2.000     0.500     0.500 peak  1722 spectrum    1 weight  0.10000E+01 volume  0.14093E-01 ppm1      1.033 ppm2      0.402 CV     1
 OR { 1722}
   (( segid "    " and resid 25   and name HG12))
   (  segid "    " and resid 19   and name HD2%)
 ASSI { 1727}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 86   and name HE2 ))
      3.700     1.700     1.700 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.67859E-03 ppm1      0.984 ppm2      2.213 CV     1
 OR { 1727}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 1737}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 40   and name HN  ))
      3.700     1.700     1.700 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.42347E-03 ppm1     -0.584 ppm2      9.180 CV     1
 OR { 1737}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 77   and name HE1 ))
 ASSI { 1741}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 39   and name HA  ))
      3.300     1.300     1.300 peak  1741 spectrum    1 weight  0.10000E+01 volume  0.16986E-02 ppm1     -0.583 ppm2      4.689 CV     1
 OR { 1741}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 77   and name HA  ))
 ASSI { 1758}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 97   and name HN  ))
      4.200     2.200     1.800 peak  1758 spectrum    1 weight  0.10000E+01 volume  0.46698E-03 ppm1      1.369 ppm2      9.237 CV     1
 OR { 1758}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 139  and name HN  ))
 OR { 1758}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 140  and name HN  ))
 ASSI { 1761}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 35   and name HB1 ))
      3.800     1.800     1.800 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.69770E-03 ppm1      1.368 ppm2      3.344 CV     1
 OR { 1761}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 97   and name HA2 ))
 ASSI { 1769}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 95   and name HA  ))
      3.900     1.900     1.900 peak  1769 spectrum    1 weight  0.10000E+01 volume  0.73011E-03 ppm1      1.206 ppm2      5.147 CV     1
 OR { 1769}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 27   and name HA  ))
 ASSI { 1771}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 65   and name HB1 ))
      2.500     0.800     0.800 peak  1771 spectrum    1 weight  0.10000E+01 volume  0.38852E-02 ppm1      1.206 ppm2      1.500 CV     1
 OR { 1771}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 96   and name HB  ))
 ASSI { 1777}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 95   and name HA  ))
      3.600     1.600     1.600 peak  1777 spectrum    1 weight  0.10000E+01 volume  0.94424E-03 ppm1      1.103 ppm2      5.147 CV     1
 OR { 1777}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 27   and name HA  ))
 ASSI { 1779}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 96   and name HB  ))
      3.000     1.100     1.100 peak  1779 spectrum    1 weight  0.10000E+01 volume  0.29059E-02 ppm1      1.103 ppm2      1.496 CV     1
 OR { 1779}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 25   and name HB  ))
 ASSI { 1780}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 69   and name HB  ))
      3.500     1.500     1.500 peak  1780 spectrum    1 weight  0.10000E+01 volume  0.15009E-02 ppm1      1.104 ppm2      0.641 CV     1
 OR { 1780}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 98   and name HG12))
 ASSI { 1788}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 25   and name HN  ))
      5.000     3.100     1.000 peak  1788 spectrum    1 weight  0.10000E+01 volume  0.47412E-03 ppm1      0.663 ppm2      8.549 CV     1
 OR { 1788}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 1830}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 69   and name HN  ))
      3.600     1.600     1.600 peak  1830 spectrum    1 weight  0.10000E+01 volume  0.38791E-03 ppm1      1.362 ppm2      8.027 CV     1
 OR { 1830}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 130  and name HN  ))
 OR { 1830}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 124  and name HN  ))
 ASSI { 1831}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 67   and name HA  ))
      4.800     2.900     1.200 peak  1831 spectrum    1 weight  0.10000E+01 volume  0.54042E-03 ppm1      1.366 ppm2      5.257 CV     1
 OR { 1831}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 138  and name HA  ))
 ASSI { 1845}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 119  and name HA1 ))
      4.500     2.600     1.500 peak  1845 spectrum    1 weight  0.10000E+01 volume  0.31009E-03 ppm1      1.210 ppm2      4.352 CV     1
 OR { 1845}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 97   and name HA1 ))
 OR { 1845}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 105  and name HB  ))
 ASSI { 1846}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 30   and name HB  ))
      4.300     2.400     1.700 peak  1846 spectrum    1 weight  0.10000E+01 volume  0.55788E-03 ppm1      1.207 ppm2      2.185 CV     1
 OR { 1846}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 83   and name HB  ))
 OR { 1846}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 82   and name HA2 ))
 OR { 1846}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 127  and name HG2 ))
 OR { 1846}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 55   and name HB2 ))
 OR { 1846}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 127  and name HG1 ))
 ASSI { 1847}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 16   and name HG2 ))
      3.000     1.200     1.200 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.18141E-02 ppm1      1.201 ppm2      1.710 CV     1
 OR { 1847}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 28   and name HB  ))
 OR { 1847}
   (( segid "    " and resid 65   and name HG  ))
   (( segid "    " and resid 16   and name HB2 ))
 ASSI { 1852}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 27   and name HB2 ))
      3.400     1.400     1.400 peak  1852 spectrum    1 weight  0.10000E+01 volume  0.17256E-02 ppm1      1.099 ppm2      1.721 CV     1
 OR { 1852}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 42   and name HB1 ))
 OR { 1852}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 42   and name HG  ))
 OR { 1852}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI { 1871}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 40   and name HA  ))
      4.000     2.000     2.000 peak  1871 spectrum    1 weight  0.10000E+01 volume  0.80867E-03 ppm1      0.917 ppm2      3.966 CV     1
 OR { 1871}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 71   and name HD1 ))
 OR { 1871}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 117  and name HB  ))
 ASSI { 1873}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 42   and name HN  ))
      3.300     1.400     1.400 peak  1873 spectrum    1 weight  0.10000E+01 volume  0.23785E-02 ppm1      0.891 ppm2      9.188 CV     1
 OR { 1873}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 40   and name HN  ))
 ASSI { 1879}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 119  and name HN  ))
      3.600     1.600     1.600 peak  1879 spectrum    1 weight  0.10000E+01 volume  0.17547E-02 ppm1      0.880 ppm2      8.824 CV     1
 OR { 1879}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 43   and name HN  ))
 OR { 1879}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 41   and name HN  ))
 ASSI { 1880}
   (( segid "    " and resid 38   and name HG2 ))
   (  segid "    " and resid 120  and name HD% )
      2.800     1.000     1.000 peak  1880 spectrum    1 weight  0.10000E+01 volume  0.35970E-02 ppm1      0.887 ppm2      6.608 CV     1
 OR { 1880}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 77   and name HH2 ))
 ASSI { 1883}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 41   and name HA  ))
      3.500     1.500     1.500 peak  1883 spectrum    1 weight  0.10000E+01 volume  0.16408E-02 ppm1      0.889 ppm2      5.615 CV     1
 OR { 1883}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 1884}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 40   and name HA  ))
      4.800     2.800     1.200 peak  1884 spectrum    1 weight  0.10000E+01 volume  0.24743E-03 ppm1      0.864 ppm2      3.980 CV     1
 OR { 1884}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 40   and name HA  ))
 OR { 1884}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 71   and name HD1 ))
 OR { 1884}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 89   and name HA  ))
 OR { 1884}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 119  and name HA2 ))
 OR { 1884}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 132  and name HB1 ))
 ASSI { 1886}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 38   and name HA  ))
      3.600     1.700     1.700 peak  1886 spectrum    1 weight  0.10000E+01 volume  0.12879E-02 ppm1      0.850 ppm2      4.848 CV     1
 OR { 1886}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI { 1887}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 119  and name HA1 ))
      3.500     1.500     1.500 peak  1887 spectrum    1 weight  0.10000E+01 volume  0.91154E-03 ppm1      0.855 ppm2      4.319 CV     1
 OR { 1887}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 35   and name HA  ))
 OR { 1887}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 122  and name HA  ))
 OR { 1887}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 119  and name HA1 ))
 OR { 1887}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 119  and name HA1 ))
 OR { 1887}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 1897}
   (( segid "    " and resid 19   and name HG  ))
   (  segid "    " and resid 23   and name HB% )
      3.900     1.900     1.900 peak  1897 spectrum    1 weight  0.10000E+01 volume  0.16718E-02 ppm1      0.799 ppm2      1.465 CV     1
 OR { 1897}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 25   and name HG11))
 OR { 1897}
   (( segid "    " and resid 43   and name HG2 ))
   (  segid "    " and resid 41   and name HB% )
 ASSI { 1898}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 19   and name HB2 ))
      2.400     0.700     0.700 peak  1898 spectrum    1 weight  0.10000E+01 volume  0.49967E-02 ppm1      0.800 ppm2      1.080 CV     1
 OR { 1898}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 25   and name HG12))
 ASSI { 1902}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 16   and name HN  ))
      3.800     1.800     1.800 peak  1902 spectrum    1 weight  0.10000E+01 volume  0.14855E-02 ppm1      0.781 ppm2      8.570 CV     1
 OR { 1902}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 25   and name HN  ))
 OR { 1902}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 104  and name HN  ))
 OR { 1902}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 1903}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 17   and name HN  ))
      3.900     1.900     1.900 peak  1903 spectrum    1 weight  0.10000E+01 volume  0.10324E-02 ppm1      0.784 ppm2      8.275 CV     1
 OR { 1903}
   (( segid "    " and resid 19   and name HG  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI { 1905}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 24   and name HB2 ))
      3.900     1.900     1.900 peak  1905 spectrum    1 weight  0.10000E+01 volume  0.86836E-03 ppm1      0.638 ppm2      1.694 CV     1
 OR { 1905}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 116  and name HB1 ))
 OR { 1905}
   (( segid "    " and resid 98   and name HG12))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 1908}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 26   and name HA1 ))
      4.500     2.500     1.500 peak  1908 spectrum    1 weight  0.10000E+01 volume  0.85383E-03 ppm1      2.190 ppm2      4.226 CV     1
 OR { 1908}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 24   and name HA  ))
 ASSI { 1909}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 26   and name HA2 ))
      4.200     2.200     1.800 peak  1909 spectrum    1 weight  0.10000E+01 volume  0.12659E-02 ppm1      2.183 ppm2      3.752 CV     1
 OR { 1909}
   (( segid "    " and resid 27   and name HG1 ))
   (( segid "    " and resid 95   and name HB  ))
 ASSI { 1917}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 24   and name HA  ))
      4.900     3.000     1.100 peak  1917 spectrum    1 weight  0.10000E+01 volume  0.93053E-03 ppm1      2.028 ppm2      4.224 CV     1
 OR { 1917}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 26   and name HA1 ))
 ASSI { 1918}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 26   and name HA2 ))
      4.000     2.000     2.000 peak  1918 spectrum    1 weight  0.10000E+01 volume  0.15458E-02 ppm1      2.022 ppm2      3.755 CV     1
 OR { 1918}
   (( segid "    " and resid 27   and name HG2 ))
   (( segid "    " and resid 95   and name HB  ))
 ASSI { 1929}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 39   and name HA  ))
      3.800     1.800     1.800 peak  1929 spectrum    1 weight  0.10000E+01 volume  0.10043E-02 ppm1      1.351 ppm2      4.714 CV     1
 OR { 1929}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 90   and name HA1 ))
 ASSI { 1933}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 38   and name HN  ))
      3.900     1.900     1.900 peak  1933 spectrum    1 weight  0.10000E+01 volume  0.92851E-03 ppm1      0.884 ppm2      7.341 CV     1
 OR { 1933}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 92   and name HE3 ))
 ASSI { 1936}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 138  and name HN  ))
      4.200     2.200     1.800 peak  1936 spectrum    1 weight  0.10000E+01 volume  0.69490E-03 ppm1      0.550 ppm2      9.514 CV     1
 OR { 1936}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 138  and name HN  ))
 ASSI { 1938}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 44   and name HA  ))
      3.700     1.700     1.700 peak  1938 spectrum    1 weight  0.10000E+01 volume  0.12398E-02 ppm1      0.547 ppm2      5.288 CV     1
 OR { 1938}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 138  and name HA  ))
 ASSI { 1955}
   (( segid "    " and resid 69   and name HG11))
   (  segid "    " and resid 116  and name HD2%)
      3.800     1.800     1.800 peak  1955 spectrum    1 weight  0.10000E+01 volume  0.14880E-02 ppm1      0.283 ppm2      0.547 CV     1
 OR { 1955}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 116  and name HG  ))
 OR { 1955}
   (( segid "    " and resid 69   and name HG11))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 1958}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 67   and name HB  ))
      4.200     2.200     1.800 peak  1958 spectrum    1 weight  0.10000E+01 volume  0.32745E-03 ppm1      0.089 ppm2      2.145 CV     1
 OR { 1958}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 24   and name HG1 ))
 ASSI { 1970}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 77   and name HZ3 ))
      5.200     3.400     0.800 peak  1970 spectrum    1 weight  0.10000E+01 volume  0.37088E-03 ppm1      1.493 ppm2      6.394 CV     1
 OR { 1970}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 121  and name HD1 ))
 ASSI { 1978}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 120  and name HN  ))
      3.800     1.800     1.800 peak  1978 spectrum    1 weight  0.10000E+01 volume  0.13886E-02 ppm1      1.485 ppm2      7.652 CV     1
 OR { 1978}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 122  and name HN  ))
 ASSI { 1980}
   (  segid "    " and resid 41   and name HB% )
   (  segid "    " and resid 120  and name HD% )
      3.900     1.900     1.900 peak  1980 spectrum    1 weight  0.10000E+01 volume  0.13545E-02 ppm1      1.485 ppm2      6.638 CV     1
 OR { 1980}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 77   and name HH2 ))
 ASSI { 1982}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 41   and name HA  ))
      2.100     0.600     0.600 peak  1982 spectrum    1 weight  0.10000E+01 volume  0.11146E-01 ppm1      1.493 ppm2      5.673 CV     1
 OR { 1982}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 120  and name HA  ))
 ASSI { 1987}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 85   and name HB2 ))
      3.000     1.100     1.100 peak  1987 spectrum    1 weight  0.10000E+01 volume  0.51020E-02 ppm1      1.490 ppm2      2.383 CV     1
 OR { 1987}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 39   and name HB2 ))
 ASSI { 1994}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 117  and name HB  ))
      4.300     2.300     1.700 peak  1994 spectrum    1 weight  0.10000E+01 volume  0.70666E-03 ppm1      1.142 ppm2      3.918 CV     1
 OR { 1994}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 131  and name HD1 ))
 ASSI { 1997}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 65   and name HA  ))
      3.400     1.400     1.400 peak  1997 spectrum    1 weight  0.10000E+01 volume  0.17482E-02 ppm1      1.135 ppm2      4.677 CV     1
 OR { 1997}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI { 2004}
   (( segid "    " and resid 64   and name HD1 ))
   (  segid "    " and resid 66   and name HD% )
      3.600     1.700     1.700 peak  2004 spectrum    1 weight  0.10000E+01 volume  0.82708E-03 ppm1      1.114 ppm2      7.197 CV     1
 OR { 2004}
   (( segid "    " and resid 64   and name HD1 ))
   (  segid "    " and resid 55   and name HE% )
 ASSI { 2006}
   (( segid "    " and resid 64   and name HD1 ))
   (  segid "    " and resid 66   and name HE% )
      3.500     1.500     1.500 peak  2006 spectrum    1 weight  0.10000E+01 volume  0.11349E-02 ppm1      1.112 ppm2      6.641 CV     1
 OR { 2006}
   (( segid "    " and resid 64   and name HD1 ))
   (  segid "    " and resid 55   and name HD% )
 ASSI { 2007}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 55   and name HA  ))
      4.400     2.400     1.600 peak  2007 spectrum    1 weight  0.10000E+01 volume  0.60507E-03 ppm1      1.123 ppm2      5.383 CV     1
 OR { 2007}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI { 2013}
   (( segid "    " and resid 64   and name HD2 ))
   (  segid "    " and resid 55   and name HD% )
      3.200     1.300     1.300 peak  2013 spectrum    1 weight  0.10000E+01 volume  0.14617E-02 ppm1      0.685 ppm2      6.618 CV     1
 OR { 2013}
   (( segid "    " and resid 64   and name HD2 ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2036}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 84   and name HB1 ))
      4.300     2.300     1.700 peak  2036 spectrum    1 weight  0.10000E+01 volume  0.41690E-03 ppm1      0.345 ppm2      3.030 CV     1
 OR { 2036}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 71   and name HD2 ))
 ASSI { 2041}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 67   and name HB  ))
      4.500     2.500     1.500 peak  2041 spectrum    1 weight  0.10000E+01 volume  0.41909E-03 ppm1      0.330 ppm2      2.122 CV     1
 OR { 2041}
   (( segid "    " and resid 69   and name HG11))
   (( segid "    " and resid 82   and name HA2 ))
 ASSI { 2050}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 98   and name HG11))
      4.500     2.500     1.500 peak  2050 spectrum    1 weight  0.10000E+01 volume  0.56168E-03 ppm1      0.115 ppm2      1.322 CV     1
 OR { 2050}
   (( segid "    " and resid 69   and name HG12))
   (( segid "    " and resid 42   and name HB2 ))
 ASSI { 2066}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HN  ))
      2.900     1.000     1.000 peak  2066 spectrum    1 weight  0.10000E+01 volume  0.45253E-02 ppm1      1.413 ppm2      7.555 CV     1
 OR { 2066}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HN  ))
 OR { 2066}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI { 2067}
   (( segid "    " and resid 126  and name HG1 ))
   (( segid "    " and resid 121  and name HZ2 ))
      3.400     1.500     1.500 peak  2067 spectrum    1 weight  0.10000E+01 volume  0.14455E-02 ppm1      1.414 ppm2      7.254 CV     1
 OR { 2067}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 121  and name HZ2 ))
 OR { 2067}
   (( segid "    " and resid 53   and name HD1 ))
   (  segid "    " and resid 66   and name HD% )
 OR { 2067}
   (( segid "    " and resid 53   and name HD2 ))
   (  segid "    " and resid 66   and name HD% )
 OR { 2067}
   (( segid "    " and resid 53   and name HD1 ))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 2074}
   (( segid "    " and resid 126  and name HG1 ))
   (( segid "    " and resid 127  and name HN  ))
      3.300     1.400     1.400 peak  2074 spectrum    1 weight  0.10000E+01 volume  0.78340E-03 ppm1      1.369 ppm2      7.952 CV     1
 OR { 2074}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 127  and name HN  ))
 OR { 2074}
   (( segid "    " and resid 126  and name HG1 ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI { 2075}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 126  and name HD1 ))
      2.000     0.500     0.500 peak  2075 spectrum    1 weight  0.10000E+01 volume  0.19426E-01 ppm1      1.354 ppm2      1.659 CV     1
 OR { 2075}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 139  and name HB2 ))
 OR { 2075}
   (( segid "    " and resid 126  and name HG1 ))
   (( segid "    " and resid 126  and name HD2 ))
 OR { 2075}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 139  and name HD1 ))
 OR { 2075}
   (( segid "    " and resid 126  and name HG1 ))
   (( segid "    " and resid 126  and name HD1 ))
 ASSI { 2077}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 140  and name HN  ))
      3.400     1.500     1.500 peak  2077 spectrum    1 weight  0.10000E+01 volume  0.11570E-02 ppm1      1.275 ppm2      9.228 CV     1
 OR { 2077}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HN  ))
 ASSI { 2083}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 114  and name HN  ))
      4.300     2.300     1.700 peak  2083 spectrum    1 weight  0.10000E+01 volume  0.72990E-03 ppm1      1.272 ppm2      8.862 CV     1
 OR { 2083}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 141  and name HN  ))
 OR { 2083}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI { 2092}
   (( segid "    " and resid 43   and name HG1 ))
   (  segid "    " and resid 49   and name HE% )
      3.300     1.400     1.400 peak  2092 spectrum    1 weight  0.10000E+01 volume  0.13992E-02 ppm1      1.178 ppm2      6.919 CV     1
 OR { 2092}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 121  and name HE3 ))
 ASSI { 2093}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 43   and name HE2 ))
      2.600     0.900     0.900 peak  2093 spectrum    1 weight  0.10000E+01 volume  0.38871E-02 ppm1      1.173 ppm2      2.935 CV     1
 OR { 2093}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 129  and name HB2 ))
 OR { 2093}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI { 2104}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 129  and name HB2 ))
      2.600     0.800     0.800 peak  2104 spectrum    1 weight  0.10000E+01 volume  0.30603E-02 ppm1      0.806 ppm2      2.935 CV     1
 OR { 2104}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 43   and name HE2 ))
 OR { 2104}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI { 2115}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 140  and name HB1 ))
      2.500     0.800     0.800 peak  2115 spectrum    1 weight  0.10000E+01 volume  0.44076E-02 ppm1      0.654 ppm2      1.685 CV     1
 OR { 2115}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 2124}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 116  and name HA  ))
      3.000     1.100     1.100 peak  2124 spectrum    1 weight  0.10000E+01 volume  0.23363E-02 ppm1      0.527 ppm2      5.000 CV     1
 OR { 2124}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 115  and name HA  ))
 ASSI { 2131}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 116  and name HN  ))
      3.500     1.500     1.500 peak  2131 spectrum    1 weight  0.10000E+01 volume  0.17388E-02 ppm1      0.519 ppm2      8.685 CV     1
 OR { 2131}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 11   and name HN  ))
 ASSI { 2136}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 44   and name HA  ))
      3.400     1.400     1.400 peak  2136 spectrum    1 weight  0.10000E+01 volume  0.21004E-02 ppm1      0.488 ppm2      5.271 CV     1
 OR { 2136}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 138  and name HA  ))
 ASSI { 2137}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 115  and name HA  ))
      3.900     1.900     1.900 peak  2137 spectrum    1 weight  0.10000E+01 volume  0.10513E-02 ppm1      0.484 ppm2      5.096 CV     1
 OR { 2137}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 27   and name HA  ))
 OR { 2137}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 9    and name HA  ))
 ASSI { 2141}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 28   and name HA  ))
      3.200     1.300     1.300 peak  2141 spectrum    1 weight  0.10000E+01 volume  0.16767E-02 ppm1      0.487 ppm2      4.039 CV     1
 OR { 2141}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 138  and name HB  ))
 ASSI { 2146}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HN  ))
      3.900     1.900     1.900 peak  2146 spectrum    1 weight  0.10000E+01 volume  0.16369E-02 ppm1      0.478 ppm2      8.375 CV     1
 OR { 2146}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 29   and name HN  ))
 ASSI { 2149}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 116  and name HB1 ))
      2.400     0.700     0.700 peak  2149 spectrum    1 weight  0.10000E+01 volume  0.99311E-02 ppm1      0.481 ppm2      1.835 CV     1
 OR { 2149}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HB1 ))
 ASSI { 2151}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 10   and name HD2%)
      2.000     0.500     0.500 peak  2151 spectrum    1 weight  0.10000E+01 volume  0.27100E-01 ppm1      0.483 ppm2      0.937 CV     1
 OR { 2151}
   (( segid "    " and resid 116  and name HG  ))
   (( segid "    " and resid 116  and name HB2 ))
 ASSI { 2160}
   (  segid "    " and resid 114  and name HD2%)
   (( segid "    " and resid 112  and name HN  ))
      4.600     2.600     1.400 peak  2160 spectrum    1 weight  0.10000E+01 volume  0.53142E-03 ppm1      0.804 ppm2      9.535 CV     1
 OR { 2160}
   (  segid "    " and resid 114  and name HD2%)
   (( segid "    " and resid 138  and name HN  ))
 ASSI { 2163}
   (  segid "    " and resid 114  and name HD2%)
   (( segid "    " and resid 139  and name HA  ))
      3.500     1.500     1.500 peak  2163 spectrum    1 weight  0.10000E+01 volume  0.16645E-02 ppm1      0.810 ppm2      4.959 CV     1
 OR { 2163}
   (  segid "    " and resid 114  and name HD2%)
   (( segid "    " and resid 112  and name HA  ))
 ASSI { 2174}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 40   and name HB  ))
      4.100     2.100     1.900 peak  2174 spectrum    1 weight  0.10000E+01 volume  0.10684E-02 ppm1      1.761 ppm2      2.053 CV     1
 OR { 2174}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 31   and name HB1 ))
 OR { 2174}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 31   and name HB2 ))
 OR { 2174}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 2175}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 40   and name HB  ))
      4.300     2.300     1.700 peak  2175 spectrum    1 weight  0.10000E+01 volume  0.65853E-03 ppm1      1.769 ppm2      1.941 CV     1
 OR { 2175}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 31   and name HB2 ))
 OR { 2175}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 2178}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 91   and name HN  ))
      4.300     2.400     1.700 peak  2178 spectrum    1 weight  0.10000E+01 volume  0.65052E-03 ppm1      1.748 ppm2      8.207 CV     1
 OR { 2178}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 36   and name HN  ))
 ASSI { 2183}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 5    and name HA  ))
      3.000     1.100     1.100 peak  2183 spectrum    1 weight  0.10000E+01 volume  0.58282E-02 ppm1      1.741 ppm2      4.687 CV     1
 OR { 2183}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 31   and name HA  ))
 ASSI { 2185}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 5    and name HB  ))
      4.100     2.100     1.900 peak  2185 spectrum    1 weight  0.10000E+01 volume  0.10640E-02 ppm1      1.748 ppm2      2.230 CV     1
 OR { 2185}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 4    and name HG2 ))
 OR { 2185}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 30   and name HB  ))
 OR { 2185}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 4    and name HG1 ))
 ASSI { 2193}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 92   and name HB2 ))
      3.600     1.600     1.600 peak  2193 spectrum    1 weight  0.10000E+01 volume  0.20820E-02 ppm1      1.739 ppm2      2.932 CV     1
 OR { 2193}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 3    and name HB1 ))
 ASSI { 2195}
   (  segid "    " and resid 135  and name HG2%)
   (( segid "    " and resid 136  and name HN  ))
      2.700     0.900     0.900 peak  2195 spectrum    1 weight  0.10000E+01 volume  0.74782E-02 ppm1      1.088 ppm2      9.453 CV     1
 OR { 2195}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 2199}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 82   and name HN  ))
      3.500     1.500     1.500 peak  2199 spectrum    1 weight  0.10000E+01 volume  0.32980E-02 ppm1      1.083 ppm2      5.696 CV     1
 OR { 2199}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 84   and name HA  ))
 OR { 2199}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 41   and name HA  ))
 ASSI { 2209}
   (  segid "    " and resid 30   and name HG2%)
   (( segid "    " and resid 31   and name HN  ))
      3.300     1.300     1.300 peak  2209 spectrum    1 weight  0.10000E+01 volume  0.46442E-02 ppm1      1.047 ppm2      8.974 CV     1
 OR { 2209}
   (  segid "    " and resid 30   and name HG2%)
   (( segid "    " and resid 28   and name HN  ))
 ASSI { 2229}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 7    and name HN  ))
      3.500     1.500     1.500 peak  2229 spectrum    1 weight  0.10000E+01 volume  0.22218E-02 ppm1      1.261 ppm2      7.598 CV     1
 OR { 2229}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 92   and name HN  ))
 ASSI { 2234}
   (  segid "    " and resid 11   and name HG2%)
   (( segid "    " and resid 139  and name HN  ))
      3.600     1.600     1.600 peak  2234 spectrum    1 weight  0.10000E+01 volume  0.22239E-02 ppm1      1.247 ppm2      9.242 CV     1
 OR { 2234}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 42   and name HN  ))
 OR { 2234}
   (  segid "    " and resid 79   and name HG2%)
   (( segid "    " and resid 78   and name HN  ))
 OR { 2234}
   (  segid "    " and resid 79   and name HG2%)
   (( segid "    " and resid 81   and name HN  ))
 OR { 2234}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 77   and name HE1 ))
 OR { 2234}
   (  segid "    " and resid 79   and name HG2%)
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 2248}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 105  and name HB  ))
      1.900     0.400     0.400 peak  2248 spectrum    1 weight  0.10000E+01 volume  0.40349E-01 ppm1      1.136 ppm2      4.314 CV     1
 OR { 2248}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 29   and name HB  ))
 ASSI { 2252}
   (  segid "    " and resid 30   and name HG2%)
   (( segid "    " and resid 92   and name HZ3 ))
      3.200     1.300     1.300 peak  2252 spectrum    1 weight  0.10000E+01 volume  0.41938E-02 ppm1      1.054 ppm2      6.733 CV     1
 OR { 2252}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 92   and name HZ3 ))
 OR { 2252}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 92   and name HH2 ))
 ASSI { 2253}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 137  and name HA  ))
      2.400     0.700     0.700 peak  2253 spectrum    1 weight  0.10000E+01 volume  0.76367E-02 ppm1      1.065 ppm2      4.912 CV     1
 OR { 2253}
   (  segid "    " and resid 30   and name HG2%)
   (( segid "    " and resid 30   and name HA  ))
 ASSI { 2257}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 28   and name HA  ))
      3.500     1.600     1.600 peak  2257 spectrum    1 weight  0.10000E+01 volume  0.15208E-02 ppm1      0.953 ppm2      4.030 CV     1
 OR { 2257}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 138  and name HB  ))
 ASSI { 2272}
   (  segid "    " and resid 7    and name HG1%)
   (( segid "    " and resid 135  and name HA  ))
      3.500     1.500     1.500 peak  2272 spectrum    1 weight  0.10000E+01 volume  0.24985E-02 ppm1      0.885 ppm2      5.287 CV     1
 OR { 2272}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 79   and name HA  ))
 ASSI { 2274}
   (  segid "    " and resid 7    and name HG1%)
   (( segid "    " and resid 8    and name HA1 ))
      3.300     1.400     1.400 peak  2274 spectrum    1 weight  0.10000E+01 volume  0.39294E-02 ppm1      0.888 ppm2      4.168 CV     1
 OR { 2274}
   (  segid "    " and resid 7    and name HG1%)
   (( segid "    " and resid 118  and name HA2 ))
 ASSI { 2311}
   (  segid "    " and resid 117  and name HG2%)
   (( segid "    " and resid 131  and name HB2 ))
      3.400     1.500     1.500 peak  2311 spectrum    1 weight  0.10000E+01 volume  0.28675E-02 ppm1      1.410 ppm2      1.971 CV     1
 OR { 2311}
   (  segid "    " and resid 5    and name HG1%)
   (( segid "    " and resid 7    and name HB  ))
 OR { 2311}
   (  segid "    " and resid 5    and name HG1%)
   (( segid "    " and resid 6    and name HB1 ))
 OR { 2311}
   (  segid "    " and resid 13   and name HB% )
   (( segid "    " and resid 12   and name HB  ))
 ASSI { 2315}
   (  segid "    " and resid 5    and name HG1%)
   (( segid "    " and resid 119  and name HN  ))
      2.900     1.100     1.100 peak  2315 spectrum    1 weight  0.10000E+01 volume  0.50450E-02 ppm1      1.406 ppm2      8.803 CV     1
 OR { 2315}
   (  segid "    " and resid 117  and name HG2%)
   (( segid "    " and resid 43   and name HN  ))
 OR { 2315}
   (  segid "    " and resid 117  and name HG2%)
   (( segid "    " and resid 119  and name HN  ))
 OR { 2315}
   (  segid "    " and resid 5    and name HG1%)
   (( segid "    " and resid 32   and name HN  ))
 OR { 2315}
   (  segid "    " and resid 13   and name HB% )
   (( segid "    " and resid 12   and name HN  ))
 ASSI { 2316}
   (  segid "    " and resid 5    and name HG1%)
   (( segid "    " and resid 5    and name HA  ))
      2.500     0.800     0.800 peak  2316 spectrum    1 weight  0.10000E+01 volume  0.67021E-02 ppm1      1.401 ppm2      4.604 CV     1
 OR { 2316}
   (  segid "    " and resid 13   and name HB% )
   (( segid "    " and resid 12   and name HA  ))
 ASSI { 2317}
   (  segid "    " and resid 5    and name HG1%)
   (( segid "    " and resid 5    and name HB  ))
      2.300     0.600     0.600 peak  2317 spectrum    1 weight  0.10000E+01 volume  0.89383E-02 ppm1      1.402 ppm2      2.206 CV     1
 OR { 2317}
   (  segid "    " and resid 117  and name HG2%)
   (( segid "    " and resid 131  and name HB1 ))
 ASSI { 2322}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 40   and name HN  ))
      3.100     1.200     1.200 peak  2322 spectrum    1 weight  0.10000E+01 volume  0.37690E-02 ppm1      1.265 ppm2      9.086 CV     1
 OR { 2322}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 121  and name HN  ))
 ASSI { 2323}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 41   and name HN  ))
      2.800     1.000     1.000 peak  2323 spectrum    1 weight  0.10000E+01 volume  0.47152E-02 ppm1      1.259 ppm2      8.789 CV     1
 OR { 2323}
   (  segid "    " and resid 11   and name HG2%)
   (( segid "    " and resid 12   and name HN  ))
 OR { 2323}
   (  segid "    " and resid 11   and name HG2%)
   (( segid "    " and resid 11   and name HN  ))
 ASSI { 2324}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 77   and name HZ3 ))
      3.100     1.200     1.200 peak  2324 spectrum    1 weight  0.10000E+01 volume  0.48341E-02 ppm1      1.267 ppm2      6.331 CV     1
 OR { 2324}
   (  segid "    " and resid 79   and name HG2%)
   (( segid "    " and resid 84   and name HZ  ))
 OR { 2324}
   (  segid "    " and resid 122  and name HB% )
   (( segid "    " and resid 121  and name HD1 ))
 ASSI { 2325}
   (  segid "    " and resid 11   and name HG2%)
   (( segid "    " and resid 11   and name HB  ))
      2.500     0.800     0.800 peak  2325 spectrum    1 weight  0.10000E+01 volume  0.66691E-02 ppm1      1.251 ppm2      3.939 CV     1
 OR { 2325}
   (  segid "    " and resid 40   and name HG1%)
   (( segid "    " and resid 40   and name HA  ))
 ASSI { 2328}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 114  and name HN  ))
      2.500     0.800     0.800 peak  2328 spectrum    1 weight  0.10000E+01 volume  0.97020E-02 ppm1      1.211 ppm2      8.786 CV     1
 OR { 2328}
   (  segid "    " and resid 11   and name HG2%)
   (( segid "    " and resid 12   and name HN  ))
 OR { 2328}
   (  segid "    " and resid 11   and name HG2%)
   (( segid "    " and resid 11   and name HN  ))
 ASSI { 2330}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name HB  ))
      1.900     0.500     0.500 peak  2330 spectrum    1 weight  0.10000E+01 volume  0.27575E-01 ppm1      1.187 ppm2      3.887 CV     1
 OR { 2330}
   (  segid "    " and resid 141  and name HG2%)
   (( segid "    " and resid 141  and name HB  ))
 OR { 2330}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 113  and name HB  ))
 ASSI { 2332}
   (  segid "    " and resid 141  and name HG2%)
   (( segid "    " and resid 141  and name HA  ))
      2.100     0.500     0.500 peak  2332 spectrum    1 weight  0.10000E+01 volume  0.18566E-01 ppm1      1.188 ppm2      5.086 CV     1
 OR { 2332}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name HA  ))
 OR { 2332}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 2334}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HB  ))
      2.000     0.500     0.500 peak  2334 spectrum    1 weight  0.10000E+01 volume  0.19211E-01 ppm1      1.198 ppm2      4.394 CV     1
 OR { 2334}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 29   and name HA  ))
 ASSI { 2339}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 116  and name HN  ))
      2.500     0.800     0.800 peak  2339 spectrum    1 weight  0.10000E+01 volume  0.10162E-01 ppm1      1.118 ppm2      8.667 CV     1
 OR { 2339}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 116  and name HN  ))
 ASSI { 2340}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 115  and name HN  ))
      3.100     1.200     1.200 peak  2340 spectrum    1 weight  0.10000E+01 volume  0.31585E-02 ppm1      1.171 ppm2      7.951 CV     1
 OR { 2340}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 2341}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 137  and name HB  ))
      2.000     0.500     0.500 peak  2341 spectrum    1 weight  0.10000E+01 volume  0.22365E-01 ppm1      1.117 ppm2      3.868 CV     1
 OR { 2341}
   (  segid "    " and resid 135  and name HG2%)
   (( segid "    " and resid 135  and name HB  ))
 ASSI { 2344}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 84   and name HN  ))
      3.100     1.200     1.200 peak  2344 spectrum    1 weight  0.10000E+01 volume  0.34745E-02 ppm1      0.852 ppm2      9.489 CV     1
 OR { 2344}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 80   and name HN  ))
 ASSI { 2368}
   (  segid "    " and resid 116  and name HD2%)
   (( segid "    " and resid 138  and name HB  ))
      4.100     2.100     1.900 peak  2368 spectrum    1 weight  0.10000E+01 volume  0.77135E-03 ppm1      0.500 ppm2      3.938 CV     1
 OR { 2368}
   (  segid "    " and resid 116  and name HD2%)
   (( segid "    " and resid 115  and name HB  ))
 OR { 2368}
   (  segid "    " and resid 116  and name HD2%)
   (( segid "    " and resid 117  and name HB  ))
 ASSI { 2369}
   (  segid "    " and resid 116  and name HD2%)
   (( segid "    " and resid 117  and name HN  ))
      3.300     1.400     1.400 peak  2369 spectrum    1 weight  0.10000E+01 volume  0.33726E-02 ppm1      0.494 ppm2      9.036 CV     1
 OR { 2369}
   (  segid "    " and resid 67   and name HG1%)
   (( segid "    " and resid 99   and name HN  ))
 ASSI { 2371}
   (  segid "    " and resid 116  and name HD2%)
   (( segid "    " and resid 45   and name HN  ))
      3.500     1.600     1.600 peak  2371 spectrum    1 weight  0.10000E+01 volume  0.20041E-02 ppm1      0.484 ppm2      7.688 CV     1
 OR { 2371}
   (  segid "    " and resid 67   and name HG1%)
   (( segid "    " and resid 98   and name HN  ))
 ASSI { 2372}
   (  segid "    " and resid 116  and name HD2%)
   (  segid "    " and resid 54   and name HD% )
      2.800     1.000     1.000 peak  2372 spectrum    1 weight  0.10000E+01 volume  0.16926E-02 ppm1      0.481 ppm2      7.258 CV     1
 OR { 2372}
   (  segid "    " and resid 67   and name HG1%)
   (  segid "    " and resid 54   and name HD% )
 OR { 2372}
   (  segid "    " and resid 67   and name HG1%)
   (  segid "    " and resid 54   and name HE% )
 OR { 2372}
   (  segid "    " and resid 67   and name HG1%)
   (  segid "    " and resid 66   and name HD% )
 ASSI { 2373}
   (  segid "    " and resid 67   and name HG1%)
   (( segid "    " and resid 81   and name HD22))
      4.100     2.100     1.900 peak  2373 spectrum    1 weight  0.10000E+01 volume  0.52494E-03 ppm1      0.490 ppm2      6.926 CV     1
 OR { 2373}
   (  segid "    " and resid 67   and name HG1%)
   (( segid "    " and resid 26   and name HN  ))
 ASSI { 2374}
   (  segid "    " and resid 67   and name HG1%)
   (  segid "    " and resid 99   and name HD% )
      4.900     3.000     1.100 peak  2374 spectrum    1 weight  0.10000E+01 volume  0.35815E-03 ppm1      0.487 ppm2      6.793 CV     1
 OR { 2374}
   (  segid "    " and resid 67   and name HG1%)
   (  segid "    " and resid 112  and name HD% )
 ASSI { 2376}
   (  segid "    " and resid 116  and name HD2%)
   (( segid "    " and resid 116  and name HA  ))
      2.400     0.700     0.700 peak  2376 spectrum    1 weight  0.10000E+01 volume  0.98411E-02 ppm1      0.483 ppm2      4.994 CV     1
 OR { 2376}
   (  segid "    " and resid 116  and name HD2%)
   (( segid "    " and resid 115  and name HA  ))
 ASSI { 2384}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 99   and name HA  ))
      4.000     2.000     2.000 peak  2384 spectrum    1 weight  0.10000E+01 volume  0.46801E-03 ppm1      0.426 ppm2      5.087 CV     1
 OR { 2384}
   (  segid "    " and resid 67   and name HG1%)
   (( segid "    " and resid 99   and name HA  ))
 ASSI { 2386}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 22   and name HA  ))
      4.700     2.700     1.300 peak  2386 spectrum    1 weight  0.10000E+01 volume  0.69960E-03 ppm1      0.425 ppm2      4.083 CV     1
 OR { 2386}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 24   and name HD1 ))
 OR { 2386}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 20   and name HA  ))
 OR { 2386}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 103  and name HA  ))
 OR { 2386}
   (  segid "    " and resid 67   and name HG1%)
   (( segid "    " and resid 103  and name HA  ))
 ASSI { 2387}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 25   and name HA  ))
      4.500     2.500     1.500 peak  2387 spectrum    1 weight  0.10000E+01 volume  0.62306E-03 ppm1      0.433 ppm2      3.859 CV     1
 OR { 2387}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 24   and name HD2 ))
 OR { 2387}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 17   and name HA2 ))
 ASSI { 2390}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 25   and name HN  ))
      3.700     1.700     1.700 peak  2390 spectrum    1 weight  0.10000E+01 volume  0.13765E-02 ppm1      0.416 ppm2      8.540 CV     1
 OR { 2390}
   (  segid "    " and resid 19   and name HD2%)
   (( segid "    " and resid 104  and name HN  ))
 ASSI { 2403}
   (  segid "    " and resid 13   and name HB% )
   (( segid "    " and resid 13   and name HN  ))
      2.200     0.600     0.600 peak  2403 spectrum    1 weight  0.10000E+01 volume  0.14300E-01 ppm1      1.366 ppm2      8.299 CV     1
 OR { 2403}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 47   and name HN  ))
 ASSI { 2405}
   (  segid "    " and resid 141  and name HG2%)
   (( segid "    " and resid 142  and name HN  ))
      2.600     0.900     0.900 peak  2405 spectrum    1 weight  0.10000E+01 volume  0.66678E-02 ppm1      1.175 ppm2      9.454 CV     1
 OR { 2405}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 138  and name HN  ))
 OR { 2405}
   (  segid "    " and resid 141  and name HG2%)
   (( segid "    " and resid 112  and name HN  ))
 ASSI { 2423}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 120  and name HN  ))
      4.100     2.100     1.900 peak  2423 spectrum    1 weight  0.10000E+01 volume  0.78968E-03 ppm1      1.066 ppm2      7.670 CV     1
 OR { 2423}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 7    and name HN  ))
 ASSI { 2426}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 137  and name HA  ))
      2.200     0.600     0.600 peak  2426 spectrum    1 weight  0.10000E+01 volume  0.12269E-01 ppm1      1.074 ppm2      4.916 CV     1
 OR { 2426}
   (  segid "    " and resid 135  and name HG2%)
   (( segid "    " and resid 117  and name HA  ))
 ASSI { 2433}
   (  segid "    " and resid 135  and name HG2%)
   (( segid "    " and resid 136  and name HN  ))
      3.000     1.100     1.100 peak  2433 spectrum    1 weight  0.10000E+01 volume  0.42850E-02 ppm1      1.105 ppm2      9.356 CV     1
 OR { 2433}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 137  and name HN  ))
 ASSI { 2434}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 118  and name HN  ))
      3.700     1.800     1.800 peak  2434 spectrum    1 weight  0.10000E+01 volume  0.12517E-02 ppm1      1.020 ppm2      9.006 CV     1
 OR { 2434}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 6    and name HN  ))
 OR { 2434}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 6    and name HN  ))
 OR { 2434}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 33   and name HN  ))
 ASSI { 2437}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 133  and name HA1 ))
      3.700     1.700     1.700 peak  2437 spectrum    1 weight  0.10000E+01 volume  0.17044E-02 ppm1      1.016 ppm2      5.258 CV     1
 OR { 2437}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 135  and name HA  ))
 ASSI { 2438}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 6    and name HA  ))
      3.200     1.300     1.300 peak  2438 spectrum    1 weight  0.10000E+01 volume  0.32414E-02 ppm1      1.019 ppm2      4.907 CV     1
 OR { 2438}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 117  and name HA  ))
 OR { 2438}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 30   and name HA  ))
 OR { 2438}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 30   and name HA  ))
 ASSI { 2439}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 118  and name HA1 ))
      2.900     1.100     1.100 peak  2439 spectrum    1 weight  0.10000E+01 volume  0.24042E-02 ppm1      1.010 ppm2      4.733 CV     1
 OR { 2439}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 134  and name HB  ))
 ASSI { 2447}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 8    and name HA2 ))
      4.400     2.400     1.600 peak  2447 spectrum    1 weight  0.10000E+01 volume  0.82551E-03 ppm1      1.001 ppm2      3.844 CV     1
 OR { 2447}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 133  and name HA2 ))
 OR { 2447}
   (  segid "    " and resid 7    and name HG2%)
   (( segid "    " and resid 135  and name HB  ))
 ASSI { 2448}
   (  segid "    " and resid 89   and name HG1%)
   (( segid "    " and resid 38   and name HA  ))
      2.800     1.000     1.000 peak  2448 spectrum    1 weight  0.10000E+01 volume  0.46566E-02 ppm1      0.829 ppm2      4.870 CV     1
 OR { 2448}
   (  segid "    " and resid 89   and name HG1%)
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 2449}
   (  segid "    " and resid 89   and name HG1%)
   (( segid "    " and resid 37   and name HA  ))
      3.200     1.300     1.300 peak  2449 spectrum    1 weight  0.10000E+01 volume  0.53984E-02 ppm1      0.822 ppm2      4.517 CV     1
 OR { 2449}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 125  and name HA  ))
 ASSI { 2464}
   (  segid "    " and resid 117  and name HG2%)
   (( segid "    " and resid 118  and name HN  ))
      2.500     0.800     0.800 peak  2464 spectrum    1 weight  0.10000E+01 volume  0.74464E-02 ppm1      1.446 ppm2      9.041 CV     1
 OR { 2464}
   (  segid "    " and resid 5    and name HG1%)
   (( segid "    " and resid 6    and name HN  ))
 OR { 2464}
   (  segid "    " and resid 117  and name HG2%)
   (( segid "    " and resid 117  and name HN  ))
 ASSI { 2487}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 83   and name HA  ))
      2.900     1.000     1.000 peak  2487 spectrum    1 weight  0.10000E+01 volume  0.46231E-02 ppm1      0.866 ppm2      4.658 CV     1
 OR { 2487}
   (  segid "    " and resid 89   and name HG1%)
   (( segid "    " and resid 39   and name HA  ))
 ASSI { 2495}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HN  ))
      3.600     1.600     1.600 peak  2495 spectrum    1 weight  0.10000E+01 volume  0.26248E-02 ppm1      0.828 ppm2      9.203 CV     1
 OR { 2495}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 2496}
   (  segid "    " and resid 89   and name HG1%)
   (( segid "    " and resid 89   and name HN  ))
      2.400     0.700     0.700 peak  2496 spectrum    1 weight  0.10000E+01 volume  0.12952E-01 ppm1      0.817 ppm2      8.169 CV     1
 OR { 2496}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 79   and name HN  ))
 ASSI { 2504}
   (  segid "    " and resid 28   and name HG1%)
   (( segid "    " and resid 95   and name HA  ))
      4.000     2.000     2.000 peak  2504 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      0.694 ppm2      5.125 CV     1
 OR { 2504}
   (  segid "    " and resid 28   and name HG1%)
   (( segid "    " and resid 27   and name HA  ))
 ASSI { 2528}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 54   and name HN  ))
      4.300     2.300     1.700 peak  2528 spectrum    1 weight  0.10000E+01 volume  0.10385E-02 ppm1      1.510 ppm2      8.371 CV     1
 OR { 2528}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 50   and name HN  ))
 OR { 2528}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 46   and name HN  ))
 ASSI { 2534}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 48   and name HA  ))
      4.200     2.200     1.800 peak  2534 spectrum    1 weight  0.10000E+01 volume  0.85416E-03 ppm1      1.516 ppm2      4.272 CV     1
 OR { 2534}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 46   and name HB  ))
 ASSI { 2538}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 54   and name HB2 ))
      3.500     1.600     1.600 peak  2538 spectrum    1 weight  0.10000E+01 volume  0.21248E-02 ppm1      1.515 ppm2      2.871 CV     1
 OR { 2538}
   (  segid "    " and resid 44   and name HB% )
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 2541}
   (  segid "    " and resid 76   and name HB% )
   (( segid "    " and resid 87   and name HN  ))
      3.900     1.900     1.900 peak  2541 spectrum    1 weight  0.10000E+01 volume  0.68102E-03 ppm1      1.341 ppm2      7.889 CV     1
 OR { 2541}
   (  segid "    " and resid 76   and name HB% )
   (( segid "    " and resid 75   and name HN  ))
 ASSI { 2551}
   (  segid "    " and resid 138  and name HG2%)
   (( segid "    " and resid 138  and name HN  ))
      3.400     1.400     1.400 peak  2551 spectrum    1 weight  0.10000E+01 volume  0.21171E-02 ppm1      0.788 ppm2      9.502 CV     1
 OR { 2551}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 80   and name HN  ))
 ASSI { 2582}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 19   and name HB2 ))
      3.400     1.500     1.500 peak  2582 spectrum    1 weight  0.10000E+01 volume  0.30848E-02 ppm1      1.526 ppm2      1.085 CV     1
 OR { 2582}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 25   and name HG12))
 ASSI { 2597}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 22   and name HN  ))
      3.400     1.500     1.500 peak  2597 spectrum    1 weight  0.10000E+01 volume  0.16134E-02 ppm1      1.532 ppm2      8.579 CV     1
 OR { 2597}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 25   and name HN  ))
 OR { 2597}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 2603}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 24   and name HD1 ))
      3.300     1.300     1.300 peak  2603 spectrum    1 weight  0.10000E+01 volume  0.61638E-02 ppm1      1.525 ppm2      4.070 CV     1
 OR { 2603}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
 ASSI { 2605}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 99   and name HB1 ))
      3.300     1.400     1.400 peak  2605 spectrum    1 weight  0.10000E+01 volume  0.53708E-02 ppm1      1.529 ppm2      2.487 CV     1
 OR { 2605}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 100  and name HB  ))
 OR { 2605}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 2619}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 48   and name HA  ))
      3.100     1.200     1.200 peak  2619 spectrum    1 weight  0.10000E+01 volume  0.29182E-02 ppm1      1.035 ppm2      4.280 CV     1
 OR { 2619}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 58   and name HA  ))
 OR { 2619}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 61   and name HA  ))
 ASSI { 2623}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 58   and name HN  ))
      3.400     1.500     1.500 peak  2623 spectrum    1 weight  0.10000E+01 volume  0.28478E-02 ppm1      1.016 ppm2      8.464 CV     1
 OR { 2623}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 61   and name HN  ))
 ASSI { 2636}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 99   and name HA  ))
      3.400     1.400     1.400 peak  2636 spectrum    1 weight  0.10000E+01 volume  0.14006E-02 ppm1      0.512 ppm2      4.994 CV     1
 OR { 2636}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 2639}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 98   and name HB  ))
      2.000     0.500     0.500 peak  2639 spectrum    1 weight  0.10000E+01 volume  0.18495E-01 ppm1      0.513 ppm2      1.531 CV     1
 OR { 2639}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HB  ))
 ASSI { 2652}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 97   and name HN  ))
      3.000     1.100     1.100 peak  2652 spectrum    1 weight  0.10000E+01 volume  0.52985E-02 ppm1      0.292 ppm2      9.220 CV     1
 OR { 2652}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HN  ))
 ASSI { 2657}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 70   and name HA  ))
      2.900     1.000     1.000 peak  2657 spectrum    1 weight  0.10000E+01 volume  0.24869E-02 ppm1      0.276 ppm2      4.922 CV     1
 OR { 2657}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 2665}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 97   and name HN  ))
      3.700     1.700     1.700 peak  2665 spectrum    1 weight  0.10000E+01 volume  0.89924E-03 ppm1     -0.139 ppm2      9.249 CV     1
 OR { 2665}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 96   and name HN  ))
 ASSI { 2666}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 99   and name HN  ))
      3.800     1.800     1.800 peak  2666 spectrum    1 weight  0.10000E+01 volume  0.12883E-02 ppm1     -0.138 ppm2      8.950 CV     1
 OR { 2666}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 28   and name HN  ))
 ASSI { 2669}
   (  segid "    " and resid 69   and name HG2%)
   (  segid "    " and resid 84   and name HD% )
      4.200     2.200     1.800 peak  2669 spectrum    1 weight  0.10000E+01 volume  0.11167E-02 ppm1     -0.136 ppm2      6.896 CV     1
 OR { 2669}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 26   and name HN  ))
 ASSI { 2672}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 27   and name HA  ))
      4.100     2.100     1.900 peak  2672 spectrum    1 weight  0.10000E+01 volume  0.10979E-02 ppm1     -0.139 ppm2      5.141 CV     1
 OR { 2672}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 2682}
   (  segid "    " and resid 69   and name HG2%)
   (  segid "    " and resid 99   and name HD% )
      4.300     2.300     1.700 peak  2682 spectrum    1 weight  0.10000E+01 volume  0.99138E-03 ppm1     -0.155 ppm2      6.782 CV     1
 OR { 2682}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 54   and name HZ  ))
 ASSI { 2691}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 99   and name HB1 ))
      3.300     1.300     1.300 peak  2691 spectrum    1 weight  0.10000E+01 volume  0.52015E-02 ppm1      1.500 ppm2      2.533 CV     1
 OR { 2691}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 21   and name HB1 ))
 OR { 2691}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 2693}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 26   and name HN  ))
      3.400     1.400     1.400 peak  2693 spectrum    1 weight  0.10000E+01 volume  0.37893E-02 ppm1      0.539 ppm2      6.859 CV     1
 OR { 2693}
   (  segid "    " and resid 98   and name HG2%)
   (  segid "    " and resid 99   and name HD% )
 OR { 2693}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 26   and name HN  ))
 ASSI { 2695}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 26   and name HA1 ))
      3.600     1.700     1.700 peak  2695 spectrum    1 weight  0.10000E+01 volume  0.19927E-02 ppm1      0.548 ppm2      4.226 CV     1
 OR { 2695}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 24   and name HA  ))
 OR { 2695}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 24   and name HA  ))
 ASSI { 2698}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
      3.100     1.200     1.200 peak  2698 spectrum    1 weight  0.10000E+01 volume  0.32832E-02 ppm1      0.536 ppm2      8.567 CV     1
 OR { 2698}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
 ASSI { 2731}
   (  segid "    " and resid 57   and name HD1%)
   (( segid "    " and resid 58   and name HN  ))
      2.500     0.800     0.800 peak  2731 spectrum    1 weight  0.10000E+01 volume  0.76276E-02 ppm1      0.981 ppm2      8.464 CV     1
 OR { 2731}
   (  segid "    " and resid 57   and name HD1%)
   (( segid "    " and resid 62   and name HN  ))
 ASSI { 2777}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 42   and name HN  ))
      4.800     2.900     1.200 peak  2777 spectrum    1 weight  0.10000E+01 volume  0.51660E-03 ppm1     -0.581 ppm2      9.207 CV     1
 OR { 2777}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 97   and name HN  ))
 ASSI { 2782}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HA  ))
      3.900     1.900     1.900 peak  2782 spectrum    1 weight  0.10000E+01 volume  0.17084E-02 ppm1     -0.580 ppm2      4.935 CV     1
 OR { 2782}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 116  and name HA  ))
 ASSI { 2814}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 112  and name HN  ))
      4.300     2.300     1.700 peak  2814 spectrum    1 weight  0.10000E+01 volume  0.72350E-03 ppm1      3.887 ppm2      9.493 CV     1
 OR { 2814}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 138  and name HN  ))
 ASSI { 2819}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 112  and name HA  ))
      3.700     1.700     1.700 peak  2819 spectrum    1 weight  0.10000E+01 volume  0.20449E-02 ppm1      3.885 ppm2      4.942 CV     1
 OR { 2819}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 139  and name HA  ))
 ASSI { 2821}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 114  and name HB1 ))
      4.200     2.200     1.800 peak  2821 spectrum    1 weight  0.10000E+01 volume  0.85928E-03 ppm1      3.887 ppm2      1.561 CV     1
 OR { 2821}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 139  and name HD1 ))
 OR { 2821}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 114  and name HB2 ))
 OR { 2821}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 139  and name HB2 ))
 ASSI { 2823}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 29   and name HA  ))
      3.800     1.800     1.800 peak  2823 spectrum    1 weight  0.10000E+01 volume  0.16887E-02 ppm1      3.767 ppm2      4.346 CV     1
 OR { 2823}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 97   and name HA1 ))
 ASSI { 2831}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.000     1.100     1.100 peak  2831 spectrum    1 weight  0.10000E+01 volume  0.28122E-02 ppm1      3.745 ppm2      2.157 CV     1
 OR { 2831}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 27   and name HG1 ))
 ASSI { 2848}
   (( segid "    " and resid 117  and name HB  ))
   (( segid "    " and resid 117  and name HN  ))
      2.500     0.800     0.800 peak  2848 spectrum    1 weight  0.10000E+01 volume  0.59252E-02 ppm1      3.910 ppm2      9.055 CV     1
 OR { 2848}
   (( segid "    " and resid 117  and name HB  ))
   (( segid "    " and resid 118  and name HN  ))
 ASSI { 2852}
   (( segid "    " and resid 117  and name HB  ))
   (( segid "    " and resid 117  and name HA  ))
      2.900     1.000     1.000 peak  2852 spectrum    1 weight  0.10000E+01 volume  0.40260E-02 ppm1      3.895 ppm2      4.957 CV     1
 OR { 2852}
   (( segid "    " and resid 117  and name HB  ))
   (( segid "    " and resid 116  and name HA  ))
 ASSI { 2857}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 72   and name HN  ))
      4.200     2.200     1.800 peak  2857 spectrum    1 weight  0.10000E+01 volume  0.60812E-03 ppm1      3.755 ppm2      8.756 CV     1
 OR { 2857}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 116  and name HN  ))
 ASSI { 2858}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 92   and name HH2 ))
      4.900     3.000     1.100 peak  2858 spectrum    1 weight  0.10000E+01 volume  0.27490E-03 ppm1      3.733 ppm2      6.816 CV     1
 OR { 2858}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 74   and name HD22))
 ASSI { 2874}
   (( segid "    " and resid 117  and name HB  ))
   (  segid "    " and resid 117  and name HG2%)
      2.300     0.700     0.700 peak  2874 spectrum    1 weight  0.10000E+01 volume  0.10617E-01 ppm1      3.910 ppm2      1.421 CV     1
 OR { 2874}
   (( segid "    " and resid 141  and name HB  ))
   (  segid "    " and resid 13   and name HB% )
 ASSI { 2875}
   (( segid "    " and resid 135  and name HB  ))
   (( segid "    " and resid 136  and name HN  ))
      3.900     1.900     1.900 peak  2875 spectrum    1 weight  0.10000E+01 volume  0.15042E-02 ppm1      3.892 ppm2      9.394 CV     1
 OR { 2875}
   (( segid "    " and resid 117  and name HB  ))
   (( segid "    " and resid 136  and name HN  ))
 ASSI { 2881}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 136  and name HA2 ))
      4.500     2.500     1.500 peak  2881 spectrum    1 weight  0.10000E+01 volume  0.71694E-03 ppm1      3.779 ppm2      3.445 CV     1
 OR { 2881}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 97   and name HA2 ))
 ASSI { 2882}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 139  and name HG1 ))
      4.300     2.300     1.700 peak  2882 spectrum    1 weight  0.10000E+01 volume  0.57468E-03 ppm1      3.783 ppm2      1.317 CV     1
 OR { 2882}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 114  and name HG  ))
 OR { 2882}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 139  and name HG2 ))
 ASSI { 2883}
   (( segid "    " and resid 137  and name HB  ))
   (  segid "    " and resid 137  and name HG2%)
      2.100     0.600     0.600 peak  2883 spectrum    1 weight  0.10000E+01 volume  0.15116E-01 ppm1      3.786 ppm2      1.047 CV     1
 OR { 2883}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI { 2901}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 16   and name HN  ))
      2.400     0.700     0.700 peak  2901 spectrum    1 weight  0.10000E+01 volume  0.75735E-02 ppm1      4.434 ppm2      8.564 CV     1
 OR { 2901}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI { 2903}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 17   and name HA2 ))
      3.500     1.500     1.500 peak  2903 spectrum    1 weight  0.10000E+01 volume  0.23467E-02 ppm1      4.426 ppm2      3.741 CV     1
 OR { 2903}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 16   and name HA  ))
 OR { 2903}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 17   and name HA1 ))
 ASSI { 2905}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 16   and name HB2 ))
      4.000     2.000     2.000 peak  2905 spectrum    1 weight  0.10000E+01 volume  0.11859E-02 ppm1      4.426 ppm2      1.765 CV     1
 OR { 2905}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 109  and name HG1 ))
 OR { 2905}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 16   and name HG1 ))
 ASSI { 2908}
   (( segid "    " and resid 11   and name HB  ))
   (( segid "    " and resid 11   and name HA  ))
      2.600     0.800     0.800 peak  2908 spectrum    1 weight  0.10000E+01 volume  0.44638E-02 ppm1      3.987 ppm2      5.257 CV     1
 OR { 2908}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 138  and name HA  ))
 ASSI { 2910}
   (( segid "    " and resid 11   and name HB  ))
   (( segid "    " and resid 139  and name HB1 ))
      4.000     2.000     2.000 peak  2910 spectrum    1 weight  0.10000E+01 volume  0.87806E-03 ppm1      3.991 ppm2      1.860 CV     1
 OR { 2910}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 139  and name HB1 ))
 OR { 2910}
   (( segid "    " and resid 11   and name HB  ))
   (( segid "    " and resid 10   and name HB1 ))
 OR { 2910}
   (( segid "    " and resid 11   and name HB  ))
   (( segid "    " and resid 12   and name HB  ))
 ASSI { 2911}
   (( segid "    " and resid 11   and name HB  ))
   (  segid "    " and resid 11   and name HG2%)
      2.100     0.500     0.500 peak  2911 spectrum    1 weight  0.10000E+01 volume  0.18316E-01 ppm1      3.989 ppm2      1.204 CV     1
 OR { 2911}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 114  and name HG  ))
 ASSI { 2912}
   (( segid "    " and resid 138  and name HB  ))
   (  segid "    " and resid 10   and name HD2%)
      3.600     1.600     1.600 peak  2912 spectrum    1 weight  0.10000E+01 volume  0.16607E-02 ppm1      3.989 ppm2      0.900 CV     1
 OR { 2912}
   (( segid "    " and resid 11   and name HB  ))
   (  segid "    " and resid 12   and name HG2%)
 OR { 2912}
   (( segid "    " and resid 11   and name HB  ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI { 2923}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 115  and name HA  ))
      2.900     1.100     1.100 peak  2923 spectrum    1 weight  0.10000E+01 volume  0.30675E-02 ppm1      3.863 ppm2      5.003 CV     1
 OR { 2923}
   (( segid "    " and resid 135  and name HB  ))
   (( segid "    " and resid 117  and name HA  ))
 OR { 2923}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 137  and name HA  ))
 OR { 2923}
   (( segid "    " and resid 135  and name HB  ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI { 2925}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 115  and name HG2%)
      2.100     0.500     0.500 peak  2925 spectrum    1 weight  0.10000E+01 volume  0.17781E-01 ppm1      3.863 ppm2      1.120 CV     1
 OR { 2925}
   (( segid "    " and resid 135  and name HB  ))
   (  segid "    " and resid 135  and name HG2%)
 ASSI { 2926}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 116  and name HD2%)
      4.200     2.200     1.800 peak  2926 spectrum    1 weight  0.10000E+01 volume  0.72866E-03 ppm1      3.866 ppm2      0.506 CV     1
 OR { 2926}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 116  and name HG  ))
 OR { 2926}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 2930}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 106  and name HD21))
      3.300     1.300     1.300 peak  2930 spectrum    1 weight  0.10000E+01 volume  0.16770E-02 ppm1      4.442 ppm2      7.548 CV     1
 OR { 2930}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI { 2934}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 23   and name HB% )
      3.800     1.800     1.800 peak  2934 spectrum    1 weight  0.10000E+01 volume  0.84710E-03 ppm1      4.441 ppm2      1.517 CV     1
 OR { 2934}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 22   and name HB% )
 ASSI { 2935}
   (( segid "    " and resid 15   and name HB  ))
   (  segid "    " and resid 15   and name HG2%)
      2.100     0.500     0.500 peak  2935 spectrum    1 weight  0.10000E+01 volume  0.16487E-01 ppm1      4.444 ppm2      1.116 CV     1
 OR { 2935}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 20   and name HG2%)
 ASSI { 2947}
   (( segid "    " and resid 79   and name HB  ))
   (( segid "    " and resid 85   and name HN  ))
      4.400     2.500     1.600 peak  2947 spectrum    1 weight  0.10000E+01 volume  0.51920E-03 ppm1      4.099 ppm2      9.189 CV     1
 OR { 2947}
   (( segid "    " and resid 79   and name HB  ))
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 2961}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 139  and name HA  ))
      3.600     1.700     1.700 peak  2961 spectrum    1 weight  0.10000E+01 volume  0.15242E-02 ppm1      3.968 ppm2      4.911 CV     1
 OR { 2961}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 2967}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 140  and name HB1 ))
      3.800     1.800     1.800 peak  2967 spectrum    1 weight  0.10000E+01 volume  0.99014E-03 ppm1      3.959 ppm2      1.715 CV     1
 OR { 2967}
   (( segid "    " and resid 138  and name HB  ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI { 2987}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 53   and name HN  ))
      4.900     3.000     1.100 peak  2987 spectrum    1 weight  0.10000E+01 volume  0.46776E-03 ppm1      7.284 ppm2      7.550 CV     1
 OR { 2987}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 52   and name HN  ))
 ASSI { 2996}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 55   and name HB1 ))
      2.800     1.000     1.000 peak  2996 spectrum    1 weight  0.10000E+01 volume  0.23570E-02 ppm1      7.263 ppm2      2.682 CV     1
 OR { 2996}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 101  and name HB1 ))
 ASSI { 2997}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 53   and name HB1 ))
      2.500     0.800     0.800 peak  2997 spectrum    1 weight  0.10000E+01 volume  0.52547E-02 ppm1      7.266 ppm2      2.215 CV     1
 OR { 2997}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 55   and name HB2 ))
 ASSI { 3000}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 64   and name HD2 ))
      3.600     1.600     1.600 peak  3000 spectrum    1 weight  0.10000E+01 volume  0.13040E-02 ppm1      7.268 ppm2      0.633 CV     1
 OR { 3000}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 67   and name HG2%)
 ASSI { 3001}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 67   and name HG1%)
      4.400     2.400     1.600 peak  3001 spectrum    1 weight  0.10000E+01 volume  0.75946E-03 ppm1      7.267 ppm2      0.463 CV     1
 OR { 3001}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 65   and name HD2%)
 ASSI { 3009}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 24   and name HB1 ))
      3.400     1.500     1.500 peak  3009 spectrum    1 weight  0.10000E+01 volume  0.11681E-02 ppm1      6.816 ppm2      1.937 CV     1
 OR { 3009}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 70   and name HB1 ))
 OR { 3009}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 3010}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 97   and name HN  ))
      4.700     2.800     1.300 peak  3010 spectrum    1 weight  0.10000E+01 volume  0.40899E-03 ppm1      6.797 ppm2      9.260 CV     1
 OR { 3010}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 140  and name HN  ))
 ASSI { 3012}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 70   and name HN  ))
      3.000     1.200     1.200 peak  3012 spectrum    1 weight  0.10000E+01 volume  0.23140E-02 ppm1      6.803 ppm2      8.557 CV     1
 OR { 3012}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 58   and name HN  ))
 OR { 3012}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 111  and name HN  ))
 ASSI { 3015}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 112  and name HA  ))
      2.900     1.000     1.000 peak  3015 spectrum    1 weight  0.10000E+01 volume  0.23719E-02 ppm1      6.804 ppm2      4.984 CV     1
 OR { 3015}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 99   and name HA  ))
 ASSI { 3016}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 72   and name HA  ))
      3.800     1.800     1.800 peak  3016 spectrum    1 weight  0.10000E+01 volume  0.12385E-02 ppm1      6.801 ppm2      4.688 CV     1
 OR { 3016}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 114  and name HA  ))
 OR { 3016}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 63   and name HA  ))
 ASSI { 3017}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 98   and name HA  ))
      3.400     1.400     1.400 peak  3017 spectrum    1 weight  0.10000E+01 volume  0.15953E-02 ppm1      6.796 ppm2      4.517 CV     1
 OR { 3017}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 23   and name HA  ))
 ASSI { 3018}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 58   and name HA  ))
      3.700     1.700     1.700 peak  3018 spectrum    1 weight  0.10000E+01 volume  0.70418E-03 ppm1      6.800 ppm2      4.323 CV     1
 OR { 3018}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 97   and name HA1 ))
 ASSI { 3019}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 24   and name HA  ))
      3.100     1.200     1.200 peak  3019 spectrum    1 weight  0.10000E+01 volume  0.29369E-02 ppm1      6.797 ppm2      4.166 CV     1
 OR { 3019}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 109  and name HA  ))
 ASSI { 3020}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 24   and name HD2 ))
      4.700     2.700     1.300 peak  3020 spectrum    1 weight  0.10000E+01 volume  0.58083E-03 ppm1      6.796 ppm2      3.833 CV     1
 OR { 3020}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 113  and name HB  ))
 ASSI { 3023}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 142  and name HB  ))
      4.000     2.000     2.000 peak  3023 spectrum    1 weight  0.10000E+01 volume  0.10498E-02 ppm1      6.802 ppm2      2.111 CV     1
 OR { 3023}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 109  and name HG2 ))
 OR { 3023}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 24   and name HG2 ))
 ASSI { 3024}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 140  and name HB1 ))
      3.700     1.700     1.700 peak  3024 spectrum    1 weight  0.10000E+01 volume  0.15958E-02 ppm1      6.802 ppm2      1.649 CV     1
 OR { 3024}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 16   and name HG2 ))
 OR { 3024}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 24   and name HB2 ))
 ASSI { 3025}
   (  segid "    " and resid 99   and name HD% )
   (  segid "    " and resid 22   and name HB% )
      2.800     1.000     1.000 peak  3025 spectrum    1 weight  0.10000E+01 volume  0.27959E-02 ppm1      6.801 ppm2      1.467 CV     1
 OR { 3025}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 3026}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 112  and name HN  ))
      3.000     1.100     1.100 peak  3026 spectrum    1 weight  0.10000E+01 volume  0.25889E-02 ppm1      6.765 ppm2      9.461 CV     1
 OR { 3026}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 68   and name HN  ))
 ASSI { 3027}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 113  and name HN  ))
      3.700     1.700     1.700 peak  3027 spectrum    1 weight  0.10000E+01 volume  0.84838E-03 ppm1      6.766 ppm2      8.717 CV     1
 OR { 3027}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 110  and name HN  ))
 ASSI { 3028}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 58   and name HN  ))
      3.200     1.300     1.300 peak  3028 spectrum    1 weight  0.10000E+01 volume  0.14913E-02 ppm1      6.769 ppm2      8.487 CV     1
 OR { 3028}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 111  and name HN  ))
 ASSI { 3031}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 57   and name HA  ))
      3.500     1.500     1.500 peak  3031 spectrum    1 weight  0.10000E+01 volume  0.63458E-03 ppm1      6.768 ppm2      5.371 CV     1
 OR { 3031}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 140  and name HA  ))
 ASSI { 3033}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 142  and name HB  ))
      4.200     2.200     1.800 peak  3033 spectrum    1 weight  0.10000E+01 volume  0.84619E-03 ppm1      6.763 ppm2      2.153 CV     1
 OR { 3033}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 109  and name HG2 ))
 ASSI { 3034}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 56   and name HB1 ))
      3.100     1.200     1.200 peak  3034 spectrum    1 weight  0.10000E+01 volume  0.14525E-02 ppm1      6.767 ppm2      1.743 CV     1
 OR { 3034}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 140  and name HB1 ))
 OR { 3034}
   (  segid "    " and resid 99   and name HD% )
   (( segid "    " and resid 24   and name HB2 ))
 ASSI { 3035}
   (  segid "    " and resid 112  and name HD% )
   (  segid "    " and resid 141  and name HG2%)
      4.400     2.400     1.600 peak  3035 spectrum    1 weight  0.10000E+01 volume  0.55920E-03 ppm1      6.770 ppm2      1.277 CV     1
 OR { 3035}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 114  and name HG  ))
 OR { 3035}
   (  segid "    " and resid 112  and name HD% )
   (( segid "    " and resid 139  and name HG1 ))
 ASSI { 3041}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 132  and name HB1 ))
      3.300     1.300     1.300 peak  3041 spectrum    1 weight  0.10000E+01 volume  0.19045E-02 ppm1      6.638 ppm2      4.000 CV     1
 OR { 3041}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 119  and name HA2 ))
 OR { 3041}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 40   and name HA  ))
 ASSI { 3044}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 57   and name HG11))
      3.600     1.700     1.700 peak  3044 spectrum    1 weight  0.10000E+01 volume  0.11401E-02 ppm1      6.632 ppm2      1.592 CV     1
 OR { 3044}
   (  segid "    " and resid 55   and name HD% )
   (  segid "    " and resid 44   and name HB% )
 OR { 3044}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 65   and name HB1 ))
 ASSI { 3045}
   (  segid "    " and resid 120  and name HD% )
   (  segid "    " and resid 122  and name HB% )
      3.200     1.300     1.300 peak  3045 spectrum    1 weight  0.10000E+01 volume  0.14958E-02 ppm1      6.643 ppm2      1.249 CV     1
 OR { 3045}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 65   and name HG  ))
 ASSI { 3046}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 121  and name HN  ))
      3.300     1.400     1.400 peak  3046 spectrum    1 weight  0.10000E+01 volume  0.11130E-02 ppm1      6.628 ppm2      9.059 CV     1
 OR { 3046}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 57   and name HN  ))
 ASSI { 3047}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 39   and name HN  ))
      3.800     1.800     1.800 peak  3047 spectrum    1 weight  0.10000E+01 volume  0.68986E-03 ppm1      6.619 ppm2      8.270 CV     1
 OR { 3047}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 3049}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 53   and name HA  ))
      3.300     1.400     1.400 peak  3049 spectrum    1 weight  0.10000E+01 volume  0.23781E-02 ppm1      6.624 ppm2      4.702 CV     1
 OR { 3049}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 4    and name HA  ))
 OR { 3049}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 65   and name HA  ))
 OR { 3049}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 39   and name HA  ))
 OR { 3049}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 129  and name HA  ))
 OR { 3049}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 63   and name HA  ))
 ASSI { 3050}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 52   and name HN  ))
      3.900     1.900     1.900 peak  3050 spectrum    1 weight  0.10000E+01 volume  0.46430E-03 ppm1      6.545 ppm2      7.508 CV     1
 OR { 3050}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 3053}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 44   and name HA  ))
      4.300     2.300     1.700 peak  3053 spectrum    1 weight  0.10000E+01 volume  0.10483E-02 ppm1      6.550 ppm2      5.274 CV     1
 OR { 3053}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 3060}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 55   and name HN  ))
      5.200     3.400     0.800 peak  3060 spectrum    1 weight  0.10000E+01 volume  0.36397E-03 ppm1      6.536 ppm2      8.030 CV     1
 OR { 3060}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 3064}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 53   and name HA  ))
      4.600     2.700     1.400 peak  3064 spectrum    1 weight  0.10000E+01 volume  0.29850E-03 ppm1      6.532 ppm2      4.744 CV     1
 OR { 3064}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 47   and name HA  ))
 OR { 3064}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 3066}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 46   and name HA  ))
      4.100     2.100     1.900 peak  3066 spectrum    1 weight  0.10000E+01 volume  0.86365E-03 ppm1      6.538 ppm2      4.041 CV     1
 OR { 3066}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 52   and name HA1 ))
 ASSI { 3074}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 121  and name HD1 ))
      4.100     2.100     1.900 peak  3074 spectrum    1 weight  0.10000E+01 volume  0.38247E-03 ppm1      6.017 ppm2      6.356 CV     1
 OR { 3074}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 77   and name HZ3 ))
 ASSI { 3075}
   (  segid "    " and resid 85   and name HD% )
   (  segid "    " and resid 85   and name HE% )
      2.400     0.700     0.700 peak  3075 spectrum    1 weight  0.10000E+01 volume  0.89775E-02 ppm1      6.021 ppm2      5.673 CV     1
 OR { 3075}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 3077}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 85   and name HB1 ))
      2.600     0.800     0.800 peak  3077 spectrum    1 weight  0.10000E+01 volume  0.40349E-02 ppm1      6.013 ppm2      2.741 CV     1
 OR { 3077}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 121  and name HB1 ))
 ASSI { 3078}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 85   and name HB2 ))
      2.500     0.800     0.800 peak  3078 spectrum    1 weight  0.10000E+01 volume  0.39641E-02 ppm1      6.016 ppm2      2.380 CV     1
 OR { 3078}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 39   and name HB2 ))
 ASSI { 3079}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 77   and name HB1 ))
      3.500     1.600     1.600 peak  3079 spectrum    1 weight  0.10000E+01 volume  0.12403E-02 ppm1      6.025 ppm2      2.033 CV     1
 OR { 3079}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 40   and name HB  ))
 ASSI { 3082}
   (  segid "    " and resid 85   and name HD% )
   (  segid "    " and resid 83   and name HG2%)
      3.600     1.600     1.600 peak  3082 spectrum    1 weight  0.10000E+01 volume  0.13208E-02 ppm1      6.013 ppm2      0.829 CV     1
 OR { 3082}
   (  segid "    " and resid 85   and name HD% )
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 3083}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 39   and name HA  ))
      3.900     1.900     1.900 peak  3083 spectrum    1 weight  0.10000E+01 volume  0.12425E-02 ppm1      6.010 ppm2      4.672 CV     1
 OR { 3083}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 77   and name HA  ))
 ASSI { 3084}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 87   and name HA  ))
      3.700     1.700     1.700 peak  3084 spectrum    1 weight  0.10000E+01 volume  0.99947E-03 ppm1      6.003 ppm2      3.966 CV     1
 OR { 3084}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 40   and name HA  ))
 OR { 3084}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 89   and name HA  ))
 ASSI { 3085}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 84   and name HB1 ))
      3.900     1.900     1.900 peak  3085 spectrum    1 weight  0.10000E+01 volume  0.34113E-03 ppm1      6.005 ppm2      3.139 CV     1
 OR { 3085}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 129  and name HB1 ))
 OR { 3085}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 126  and name HE1 ))
 OR { 3085}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 92   and name HB1 ))
 ASSI { 3086}
   (  segid "    " and resid 85   and name HD% )
   (( segid "    " and resid 86   and name HB1 ))
      4.700     2.800     1.300 peak  3086 spectrum    1 weight  0.10000E+01 volume  0.35992E-03 ppm1      6.004 ppm2      1.262 CV     1
 OR { 3086}
   (  segid "    " and resid 85   and name HD% )
   (  segid "    " and resid 40   and name HG1%)
 OR { 3086}
   (  segid "    " and resid 85   and name HD% )
   (  segid "    " and resid 40   and name HG2%)
 ASSI { 3089}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 57   and name HG12))
      5.100     3.200     0.900 peak  3089 spectrum    1 weight  0.10000E+01 volume  0.37398E-03 ppm1      6.666 ppm2      1.745 CV     1
 OR { 3089}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 56   and name HB1 ))
 ASSI { 3091}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 41   and name HN  ))
      5.100     3.200     0.900 peak  3091 spectrum    1 weight  0.10000E+01 volume  0.50987E-03 ppm1      6.656 ppm2      8.712 CV     1
 OR { 3091}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 67   and name HN  ))
 ASSI { 3092}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 65   and name HN  ))
      3.600     1.600     1.600 peak  3092 spectrum    1 weight  0.10000E+01 volume  0.12401E-02 ppm1      6.649 ppm2      8.478 CV     1
 OR { 3092}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 3095}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 54   and name HA  ))
      3.200     1.300     1.300 peak  3095 spectrum    1 weight  0.10000E+01 volume  0.19727E-02 ppm1      6.655 ppm2      5.312 CV     1
 OR { 3095}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 55   and name HA  ))
 ASSI { 3097}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 121  and name HA  ))
      3.800     1.800     1.800 peak  3097 spectrum    1 weight  0.10000E+01 volume  0.99679E-03 ppm1      6.648 ppm2      4.853 CV     1
 OR { 3097}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 3098}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 48   and name HA  ))
      3.600     1.600     1.600 peak  3098 spectrum    1 weight  0.10000E+01 volume  0.11969E-02 ppm1      6.650 ppm2      4.333 CV     1
 OR { 3098}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 122  and name HA  ))
 OR { 3098}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 119  and name HA1 ))
 ASSI { 3102}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 64   and name HB1 ))
      3.300     1.400     1.400 peak  3102 spectrum    1 weight  0.10000E+01 volume  0.25295E-02 ppm1      6.656 ppm2      1.012 CV     1
 OR { 3102}
   (  segid "    " and resid 55   and name HD% )
   (  segid "    " and resid 57   and name HD1%)
 OR { 3102}
   (  segid "    " and resid 55   and name HD% )
   (  segid "    " and resid 57   and name HG2%)
 ASSI { 3104}
   (  segid "    " and resid 55   and name HD% )
   (  segid "    " and resid 67   and name HG1%)
      4.800     2.900     1.200 peak  3104 spectrum    1 weight  0.10000E+01 volume  0.45814E-03 ppm1      6.650 ppm2      0.463 CV     1
 OR { 3104}
   (  segid "    " and resid 55   and name HD% )
   (  segid "    " and resid 65   and name HD2%)
 ASSI { 3107}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 66   and name HB1 ))
      4.600     2.700     1.400 peak  3107 spectrum    1 weight  0.10000E+01 volume  0.30408E-03 ppm1      7.315 ppm2      3.555 CV     1
 OR { 3107}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 48   and name HB1 ))
 ASSI { 3110}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 43   and name HB1 ))
      4.000     2.000     2.000 peak  3110 spectrum    1 weight  0.10000E+01 volume  0.80289E-03 ppm1      7.306 ppm2      0.804 CV     1
 OR { 3110}
   (  segid "    " and resid 54   and name HD% )
   (  segid "    " and resid 83   and name HG2%)
 OR { 3110}
   (  segid "    " and resid 54   and name HD% )
   (  segid "    " and resid 114  and name HD2%)
 ASSI { 3111}
   (  segid "    " and resid 54   and name HD% )
   (  segid "    " and resid 116  and name HD2%)
      3.600     1.600     1.600 peak  3111 spectrum    1 weight  0.10000E+01 volume  0.11128E-02 ppm1      7.306 ppm2      0.487 CV     1
 OR { 3111}
   (  segid "    " and resid 54   and name HD% )
   (  segid "    " and resid 67   and name HG1%)
 OR { 3111}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 3113}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 55   and name HN  ))
      4.100     2.100     1.900 peak  3113 spectrum    1 weight  0.10000E+01 volume  0.77329E-03 ppm1      7.299 ppm2      8.000 CV     1
 OR { 3113}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 3114}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 54   and name HA  ))
      3.600     1.600     1.600 peak  3114 spectrum    1 weight  0.10000E+01 volume  0.15302E-02 ppm1      7.299 ppm2      5.267 CV     1
 OR { 3114}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 44   and name HA  ))
 ASSI { 3115}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 80   and name HN  ))
      3.200     1.300     1.300 peak  3115 spectrum    1 weight  0.10000E+01 volume  0.15878E-02 ppm1      6.940 ppm2      9.466 CV     1
 OR { 3115}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 3116}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 85   and name HN  ))
      3.300     1.400     1.400 peak  3116 spectrum    1 weight  0.10000E+01 volume  0.22575E-02 ppm1      6.937 ppm2      9.172 CV     1
 OR { 3116}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 42   and name HN  ))
 ASSI { 3125}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 42   and name HG  ))
      3.900     1.900     1.900 peak  3125 spectrum    1 weight  0.10000E+01 volume  0.14138E-02 ppm1      6.944 ppm2      1.810 CV     1
 OR { 3125}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 71   and name HG2 ))
 OR { 3125}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 71   and name HG1 ))
 OR { 3125}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 3126}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 42   and name HB2 ))
      3.400     1.400     1.400 peak  3126 spectrum    1 weight  0.10000E+01 volume  0.29350E-02 ppm1      6.946 ppm2      1.220 CV     1
 OR { 3126}
   (  segid "    " and resid 84   and name HD% )
   (  segid "    " and resid 79   and name HG2%)
 ASSI { 3134}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 79   and name HA  ))
      3.200     1.300     1.300 peak  3134 spectrum    1 weight  0.10000E+01 volume  0.18314E-02 ppm1      6.935 ppm2      5.254 CV     1
 OR { 3134}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 3137}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 81   and name HA  ))
      3.800     1.800     1.800 peak  3137 spectrum    1 weight  0.10000E+01 volume  0.83575E-03 ppm1      6.932 ppm2      4.081 CV     1
 OR { 3137}
   (  segid "    " and resid 84   and name HD% )
   (( segid "    " and resid 79   and name HB  ))
 ASSI { 3141}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      2.700     0.900     0.900 peak  3141 spectrum    1 weight  0.10000E+01 volume  0.32209E-02 ppm1      3.504 ppm2      9.444 CV     1
 OR { 3141}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 68   and name HN  ))
 ASSI { 3143}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      5.000     3.100     1.000 peak  3143 spectrum    1 weight  0.10000E+01 volume  0.30198E-03 ppm1      3.497 ppm2      8.207 CV     1
 OR { 3143}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI { 3147}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 101  and name HA  ))
      4.000     2.000     2.000 peak  3147 spectrum    1 weight  0.10000E+01 volume  0.79938E-03 ppm1      3.511 ppm2      4.992 CV     1
 OR { 3147}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 99   and name HA  ))
 ASSI { 3152}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 82   and name HA2 ))
      3.800     1.800     1.800 peak  3152 spectrum    1 weight  0.10000E+01 volume  0.48906E-03 ppm1      7.318 ppm2      2.189 CV     1
 OR { 3152}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 53   and name HB1 ))
 ASSI { 3153}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 44   and name HN  ))
      3.800     1.800     1.800 peak  3153 spectrum    1 weight  0.10000E+01 volume  0.56383E-03 ppm1      7.296 ppm2      8.808 CV     1
 OR { 3153}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 67   and name HN  ))
 ASSI { 3156}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 42   and name HB2 ))
      3.800     1.800     1.800 peak  3156 spectrum    1 weight  0.10000E+01 volume  0.89618E-03 ppm1      7.298 ppm2      1.246 CV     1
 OR { 3156}
   (  segid "    " and resid 54   and name HD% )
   (( segid "    " and resid 43   and name HG1 ))
 ASSI { 3160}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 84   and name HN  ))
      4.300     2.300     1.700 peak  3160 spectrum    1 weight  0.10000E+01 volume  0.33078E-03 ppm1      7.220 ppm2      9.497 CV     1
 OR { 3160}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 80   and name HN  ))
 OR { 3160}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 68   and name HN  ))
 ASSI { 3161}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 44   and name HN  ))
      4.300     2.300     1.700 peak  3161 spectrum    1 weight  0.10000E+01 volume  0.45525E-03 ppm1      7.220 ppm2      8.779 CV     1
 OR { 3161}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 67   and name HN  ))
 OR { 3161}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 113  and name HN  ))
 ASSI { 3162}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 69   and name HN  ))
      4.400     2.500     1.600 peak  3162 spectrum    1 weight  0.10000E+01 volume  0.37832E-03 ppm1      7.224 ppm2      8.017 CV     1
 OR { 3162}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 55   and name HN  ))
 ASSI { 3163}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 54   and name HA  ))
      3.800     1.800     1.800 peak  3163 spectrum    1 weight  0.10000E+01 volume  0.85011E-03 ppm1      7.223 ppm2      5.265 CV     1
 OR { 3163}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 44   and name HA  ))
 OR { 3163}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 55   and name HA  ))
 OR { 3163}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 79   and name HA  ))
 ASSI { 3164}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 54   and name HB1 ))
      4.200     2.200     1.800 peak  3164 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      7.222 ppm2      3.045 CV     1
 OR { 3164}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 81   and name HB1 ))
 OR { 3164}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 84   and name HB1 ))
 ASSI { 3165}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 84   and name HB2 ))
      3.400     1.400     1.400 peak  3165 spectrum    1 weight  0.10000E+01 volume  0.14362E-02 ppm1      7.224 ppm2      2.691 CV     1
 OR { 3165}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 55   and name HB1 ))
 OR { 3165}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 48   and name HB2 ))
 OR { 3165}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 3166}
   (  segid "    " and resid 54   and name HE% )
   (  segid "    " and resid 44   and name HB% )
      3.300     1.300     1.300 peak  3166 spectrum    1 weight  0.10000E+01 volume  0.32376E-02 ppm1      7.222 ppm2      1.516 CV     1
 OR { 3166}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 3167}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 42   and name HB2 ))
      3.100     1.200     1.200 peak  3167 spectrum    1 weight  0.10000E+01 volume  0.17676E-02 ppm1      7.225 ppm2      1.221 CV     1
 OR { 3167}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 43   and name HG1 ))
 OR { 3167}
   (  segid "    " and resid 55   and name HE% )
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 3168}
   (  segid "    " and resid 54   and name HE% )
   (  segid "    " and resid 116  and name HD2%)
      4.000     2.000     2.000 peak  3168 spectrum    1 weight  0.10000E+01 volume  0.74530E-03 ppm1      7.227 ppm2      0.463 CV     1
 OR { 3168}
   (  segid "    " and resid 54   and name HE% )
   (  segid "    " and resid 67   and name HG1%)
 OR { 3168}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 3170}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 57   and name HN  ))
      5.000     3.100     1.000 peak  3170 spectrum    1 weight  0.10000E+01 volume  0.42991E-03 ppm1      7.194 ppm2      8.936 CV     1
 OR { 3170}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 56   and name HN  ))
 ASSI { 3172}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      2.400     0.700     0.700 peak  3172 spectrum    1 weight  0.10000E+01 volume  0.70228E-02 ppm1      4.046 ppm2      8.389 CV     1
 OR { 3172}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
 ASSI { 3180}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
      4.000     2.000     2.000 peak  3180 spectrum    1 weight  0.10000E+01 volume  0.12645E-02 ppm1      4.047 ppm2      2.882 CV     1
 OR { 3180}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HB1 ))
 OR { 3180}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
 OR { 3180}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 3184}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 50   and name HN  ))
      3.100     1.200     1.200 peak  3184 spectrum    1 weight  0.10000E+01 volume  0.19019E-02 ppm1      7.195 ppm2      8.390 CV     1
 OR { 3184}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 54   and name HN  ))
 ASSI { 3186}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 55   and name HZ  ))
      2.300     0.600     0.600 peak  3186 spectrum    1 weight  0.10000E+01 volume  0.83740E-02 ppm1      7.203 ppm2      6.950 CV     1
 OR { 3186}
   (  segid "    " and resid 54   and name HE% )
   (  segid "    " and resid 84   and name HD% )
 ASSI { 3189}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 68   and name HA  ))
      3.200     1.300     1.300 peak  3189 spectrum    1 weight  0.10000E+01 volume  0.14644E-02 ppm1      7.194 ppm2      5.112 CV     1
 OR { 3189}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 3190}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 83   and name HA  ))
      3.800     1.800     1.800 peak  3190 spectrum    1 weight  0.10000E+01 volume  0.89647E-03 ppm1      7.197 ppm2      4.712 CV     1
 OR { 3190}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 53   and name HA  ))
 OR { 3190}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 47   and name HA  ))
 OR { 3190}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 80   and name HA  ))
 OR { 3190}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 3191}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 48   and name HA  ))
      3.500     1.600     1.600 peak  3191 spectrum    1 weight  0.10000E+01 volume  0.11098E-02 ppm1      7.193 ppm2      4.349 CV     1
 OR { 3191}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 50   and name HA  ))
 OR { 3191}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 61   and name HA  ))
 ASSI { 3195}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 64   and name HB2 ))
      3.600     1.600     1.600 peak  3195 spectrum    1 weight  0.10000E+01 volume  0.14209E-02 ppm1      7.195 ppm2      0.683 CV     1
 OR { 3195}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 64   and name HD2 ))
 OR { 3195}
   (  segid "    " and resid 54   and name HE% )
   (( segid "    " and resid 69   and name HB  ))
 ASSI { 3196}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 64   and name HG2 ))
      4.100     2.100     1.900 peak  3196 spectrum    1 weight  0.10000E+01 volume  0.71066E-03 ppm1      7.200 ppm2     -0.161 CV     1
 OR { 3196}
   (  segid "    " and resid 54   and name HE% )
   (  segid "    " and resid 69   and name HG2%)
 ASSI { 3206}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
      4.500     2.500     1.500 peak  3206 spectrum    1 weight  0.10000E+01 volume  0.37503E-03 ppm1      4.207 ppm2      2.683 CV     1
 OR { 3206}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 88   and name HB1 ))
 OR { 3206}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 86   and name HE1 ))
 ASSI { 3209}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HN  ))
      2.800     1.000     1.000 peak  3209 spectrum    1 weight  0.10000E+01 volume  0.26403E-02 ppm1      3.930 ppm2      9.071 CV     1
 OR { 3209}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 121  and name HN  ))
 ASSI { 3211}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      4.500     2.600     1.500 peak  3211 spectrum    1 weight  0.10000E+01 volume  0.49228E-03 ppm1      3.935 ppm2      6.616 CV     1
 OR { 3211}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 77   and name HH2 ))
 ASSI { 3212}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 77   and name HZ3 ))
      4.800     2.900     1.200 peak  3212 spectrum    1 weight  0.10000E+01 volume  0.34747E-03 ppm1      3.932 ppm2      6.326 CV     1
 OR { 3212}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 121  and name HD1 ))
 ASSI { 3214}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
      3.700     1.700     1.700 peak  3214 spectrum    1 weight  0.10000E+01 volume  0.14450E-02 ppm1      3.933 ppm2      2.745 CV     1
 OR { 3214}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 121  and name HB1 ))
 OR { 3214}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 86   and name HE1 ))
 ASSI { 3216}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 32   and name HB% )
      4.300     2.400     1.700 peak  3216 spectrum    1 weight  0.10000E+01 volume  0.51119E-03 ppm1      3.926 ppm2      1.751 CV     1
 OR { 3216}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 42   and name HG  ))
 ASSI { 3217}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 38   and name HG1 ))
      3.200     1.300     1.300 peak  3217 spectrum    1 weight  0.10000E+01 volume  0.27136E-02 ppm1      3.929 ppm2      1.396 CV     1
 OR { 3217}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 86   and name HD1 ))
 ASSI { 3219}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 38   and name HG2 ))
      4.200     2.300     1.800 peak  3219 spectrum    1 weight  0.10000E+01 volume  0.42347E-03 ppm1      3.932 ppm2      0.869 CV     1
 OR { 3219}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 42   and name HD2%)
 OR { 3219}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 42   and name HD1%)
 ASSI { 3226}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 52   and name HN  ))
      3.400     1.400     1.400 peak  3226 spectrum    1 weight  0.10000E+01 volume  0.11838E-02 ppm1      6.933 ppm2      7.511 CV     1
 OR { 3226}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 3232}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 50   and name HN  ))
      4.400     2.400     1.600 peak  3232 spectrum    1 weight  0.10000E+01 volume  0.57072E-03 ppm1      6.912 ppm2      8.395 CV     1
 OR { 3232}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 54   and name HN  ))
 ASSI { 3234}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 44   and name HA  ))
      4.900     3.100     1.100 peak  3234 spectrum    1 weight  0.10000E+01 volume  0.44960E-03 ppm1      6.922 ppm2      5.292 CV     1
 OR { 3234}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 3235}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 81   and name HB2 ))
      4.400     2.400     1.600 peak  3235 spectrum    1 weight  0.10000E+01 volume  0.65939E-03 ppm1      6.924 ppm2      2.625 CV     1
 OR { 3235}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 84   and name HB2 ))
 OR { 3235}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 48   and name HB2 ))
 ASSI { 3248}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 70   and name HB1 ))
      4.200     2.200     1.800 peak  3248 spectrum    1 weight  0.10000E+01 volume  0.66893E-03 ppm1      6.228 ppm2      1.831 CV     1
 OR { 3248}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 70   and name HB2 ))
 OR { 3248}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 71   and name HG1 ))
 OR { 3248}
   (  segid "    " and resid 84   and name HE% )
   (( segid "    " and resid 71   and name HG2 ))
 ASSI { 3281}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 142  and name HN  ))
      4.200     2.200     1.800 peak  3281 spectrum    1 weight  0.10000E+01 volume  0.13615E-02 ppm1      4.214 ppm2      9.413 CV     1
 OR { 3281}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
 ASSI { 3285}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HG2 ))
      3.200     1.300     1.300 peak  3285 spectrum    1 weight  0.10000E+01 volume  0.60932E-02 ppm1      4.216 ppm2      2.145 CV     1
 OR { 3285}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 142  and name HB  ))
 ASSI { 3304}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 58   and name HN  ))
      2.400     0.700     0.700 peak  3304 spectrum    1 weight  0.10000E+01 volume  0.58335E-02 ppm1      3.494 ppm2      8.488 CV     1
 OR { 3304}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 61   and name HN  ))
 OR { 3304}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 58   and name HN  ))
 OR { 3304}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 62   and name HN  ))
 OR { 3304}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI { 3305}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
      3.300     1.300     1.300 peak  3305 spectrum    1 weight  0.10000E+01 volume  0.20172E-02 ppm1      3.497 ppm2      8.094 CV     1
 OR { 3305}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 59   and name HN  ))
 OR { 3305}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 59   and name HN  ))
 OR { 3305}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI { 3311}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 63   and name HB1 ))
      3.800     1.800     1.800 peak  3311 spectrum    1 weight  0.10000E+01 volume  0.20033E-02 ppm1      3.494 ppm2      2.921 CV     1
 OR { 3311}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 63   and name HB1 ))
 OR { 3311}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 59   and name HB1 ))
 OR { 3311}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 59   and name HB1 ))
 OR { 3311}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 61   and name HB2 ))
 ASSI { 3312}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 63   and name HB2 ))
      2.900     1.000     1.000 peak  3312 spectrum    1 weight  0.10000E+01 volume  0.32764E-02 ppm1      3.495 ppm2      2.629 CV     1
 OR { 3312}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 112  and name HB2 ))
 OR { 3312}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 63   and name HB2 ))
 ASSI { 3314}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 62   and name HG1 ))
      4.300     2.300     1.700 peak  3314 spectrum    1 weight  0.10000E+01 volume  0.55689E-03 ppm1      3.490 ppm2      1.635 CV     1
 OR { 3314}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 62   and name HG1 ))
 OR { 3314}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 57   and name HG11))
 OR { 3314}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 57   and name HG11))
 ASSI { 3321}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 47   and name HA  ))
      4.100     2.100     1.900 peak  3321 spectrum    1 weight  0.10000E+01 volume  0.57823E-03 ppm1      6.966 ppm2      4.673 CV     1
 OR { 3321}
   (( segid "    " and resid 55   and name HZ  ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 3328}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 80   and name HN  ))
      4.100     2.100     1.900 peak  3328 spectrum    1 weight  0.10000E+01 volume  0.52209E-03 ppm1      6.753 ppm2      9.480 CV     1
 OR { 3328}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 3330}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 82   and name HN  ))
      4.000     2.000     2.000 peak  3330 spectrum    1 weight  0.10000E+01 volume  0.57022E-03 ppm1      6.752 ppm2      5.607 CV     1
 OR { 3330}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 3331}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 83   and name HA  ))
      4.500     2.500     1.500 peak  3331 spectrum    1 weight  0.10000E+01 volume  0.33841E-03 ppm1      6.758 ppm2      4.615 CV     1
 OR { 3331}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI { 3332}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 84   and name HB1 ))
      4.200     2.200     1.800 peak  3332 spectrum    1 weight  0.10000E+01 volume  0.11186E-02 ppm1      6.753 ppm2      3.100 CV     1
 OR { 3332}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 54   and name HB1 ))
 OR { 3332}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 81   and name HB1 ))
 OR { 3332}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 82   and name HA1 ))
 ASSI { 3333}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.200     1.300     1.300 peak  3333 spectrum    1 weight  0.10000E+01 volume  0.18386E-02 ppm1      6.750 ppm2      2.676 CV     1
 OR { 3333}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 3335}
   (( segid "    " and resid 54   and name HZ  ))
   (  segid "    " and resid 44   and name HB% )
      4.700     2.800     1.300 peak  3335 spectrum    1 weight  0.10000E+01 volume  0.40364E-03 ppm1      6.755 ppm2      1.502 CV     1
 OR { 3335}
   (( segid "    " and resid 54   and name HZ  ))
   (  segid "    " and resid 41   and name HB% )
 ASSI { 3351}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      2.700     0.900     0.900 peak  3351 spectrum    1 weight  0.10000E+01 volume  0.31566E-02 ppm1      5.281 ppm2      8.412 CV     1
 OR { 3351}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HN  ))
 ASSI { 3352}
   (( segid "    " and resid 135  and name HA  ))
   (  segid "    " and resid 117  and name HG2%)
      3.200     1.300     1.300 peak  3352 spectrum    1 weight  0.10000E+01 volume  0.16890E-02 ppm1      5.274 ppm2      1.445 CV     1
 OR { 3352}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 10   and name HB2 ))
 ASSI { 3354}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 10   and name HD1%)
      3.700     1.700     1.700 peak  3354 spectrum    1 weight  0.10000E+01 volume  0.16162E-02 ppm1      5.280 ppm2      0.469 CV     1
 OR { 3354}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 3354}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI { 3358}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 141  and name HG2%)
      2.600     0.800     0.800 peak  3358 spectrum    1 weight  0.10000E+01 volume  0.58987E-02 ppm1      5.133 ppm2      1.146 CV     1
 OR { 3358}
   (( segid "    " and resid 142  and name HA  ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 3360}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 118  and name HN  ))
      2.200     0.600     0.600 peak  3360 spectrum    1 weight  0.10000E+01 volume  0.88112E-02 ppm1      4.938 ppm2      9.052 CV     1
 OR { 3360}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HN  ))
 ASSI { 3362}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 7    and name HB  ))
      4.000     2.000     2.000 peak  3362 spectrum    1 weight  0.10000E+01 volume  0.67884E-03 ppm1      4.943 ppm2      1.879 CV     1
 OR { 3362}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 6    and name HB2 ))
 OR { 3362}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 6    and name HB1 ))
 ASSI { 3367}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 136  and name HA2 ))
      3.900     1.900     1.900 peak  3367 spectrum    1 weight  0.10000E+01 volume  0.11127E-02 ppm1      4.924 ppm2      3.469 CV     1
 OR { 3367}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 93   and name HA2 ))
 OR { 3367}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 136  and name HA2 ))
 ASSI { 3368}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 137  and name HG2%)
      2.300     0.700     0.700 peak  3368 spectrum    1 weight  0.10000E+01 volume  0.83236E-02 ppm1      4.931 ppm2      1.058 CV     1
 OR { 3368}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 30   and name HG2%)
 OR { 3368}
   (( segid "    " and resid 117  and name HA  ))
   (  segid "    " and resid 135  and name HG2%)
 ASSI { 3369}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 116  and name HD2%)
      4.200     2.200     1.800 peak  3369 spectrum    1 weight  0.10000E+01 volume  0.73031E-03 ppm1      4.926 ppm2      0.533 CV     1
 OR { 3369}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 116  and name HG  ))
 OR { 3369}
   (( segid "    " and resid 117  and name HA  ))
   (  segid "    " and resid 116  and name HD2%)
 OR { 3369}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 3373}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 92   and name HZ2 ))
      4.600     2.600     1.400 peak  3373 spectrum    1 weight  0.10000E+01 volume  0.31547E-03 ppm1      4.794 ppm2      7.617 CV     1
 OR { 3373}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HD21))
 ASSI { 3374}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 92   and name HH2 ))
      3.800     1.800     1.800 peak  3374 spectrum    1 weight  0.10000E+01 volume  0.50066E-03 ppm1      4.795 ppm2      6.781 CV     1
 OR { 3374}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HD22))
 ASSI { 3384}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
      2.800     1.000     1.000 peak  3384 spectrum    1 weight  0.10000E+01 volume  0.22893E-02 ppm1      4.496 ppm2      7.630 CV     1
 OR { 3384}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HN  ))
 ASSI { 3427}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 43   and name HE2 ))
      4.600     2.600     1.400 peak  3427 spectrum    1 weight  0.10000E+01 volume  0.29426E-03 ppm1      7.133 ppm2      2.918 CV     1
 OR { 3427}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 129  and name HB2 ))
 OR { 3427}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 43   and name HE1 ))
 ASSI { 3429}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 52   and name HN  ))
      4.000     2.000     2.000 peak  3429 spectrum    1 weight  0.10000E+01 volume  0.12717E-02 ppm1      7.130 ppm2      7.506 CV     1
 OR { 3429}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 3437}
   (( segid "    " and resid 54   and name HZ  ))
   (  segid "    " and resid 116  and name HD2%)
      4.800     2.900     1.200 peak  3437 spectrum    1 weight  0.10000E+01 volume  0.33846E-03 ppm1      6.756 ppm2      0.488 CV     1
 OR { 3437}
   (( segid "    " and resid 54   and name HZ  ))
   (  segid "    " and resid 67   and name HG1%)
 OR { 3437}
   (( segid "    " and resid 54   and name HZ  ))
   (( segid "    " and resid 116  and name HG  ))
 OR { 3437}
   (( segid "    " and resid 54   and name HZ  ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 3441}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 117  and name HA  ))
      2.400     0.700     0.700 peak  3441 spectrum    1 weight  0.10000E+01 volume  0.55483E-02 ppm1      5.278 ppm2      4.906 CV     1
 OR { 3441}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 139  and name HA  ))
 ASSI { 3442}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 80   and name HA  ))
      3.000     1.200     1.200 peak  3442 spectrum    1 weight  0.10000E+01 volume  0.41583E-02 ppm1      5.274 ppm2      4.668 CV     1
 OR { 3442}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 10   and name HA  ))
 OR { 3442}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI { 3443}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB  ))
      2.900     1.000     1.000 peak  3443 spectrum    1 weight  0.10000E+01 volume  0.24346E-02 ppm1      5.281 ppm2      3.913 CV     1
 OR { 3443}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HB  ))
 ASSI { 3444}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 7    and name HB  ))
      2.600     0.900     0.900 peak  3444 spectrum    1 weight  0.10000E+01 volume  0.37415E-02 ppm1      5.275 ppm2      1.870 CV     1
 OR { 3444}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
 OR { 3444}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
 OR { 3444}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HB  ))
 ASSI { 3447}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 11   and name HG2%)
      2.600     0.900     0.900 peak  3447 spectrum    1 weight  0.10000E+01 volume  0.83736E-02 ppm1      5.257 ppm2      1.224 CV     1
 OR { 3447}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 79   and name HG2%)
 ASSI { 3455}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
      4.100     2.100     1.900 peak  3455 spectrum    1 weight  0.10000E+01 volume  0.10828E-02 ppm1      5.246 ppm2      2.669 CV     1
 OR { 3455}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 80   and name HB1 ))
 ASSI { 3457}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 142  and name HN  ))
      2.100     0.600     0.600 peak  3457 spectrum    1 weight  0.10000E+01 volume  0.10883E-01 ppm1      5.135 ppm2      9.415 CV     1
 OR { 3457}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
 ASSI { 3458}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 112  and name HD% )
      3.100     1.200     1.200 peak  3458 spectrum    1 weight  0.10000E+01 volume  0.92294E-03 ppm1      5.124 ppm2      6.797 CV     1
 OR { 3458}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 111  and name HD22))
 ASSI { 3460}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 111  and name HA  ))
      2.700     0.900     0.900 peak  3460 spectrum    1 weight  0.10000E+01 volume  0.37028E-02 ppm1      5.131 ppm2      5.564 CV     1
 OR { 3460}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI { 3471}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      2.300     0.700     0.700 peak  3471 spectrum    1 weight  0.10000E+01 volume  0.86976E-02 ppm1      5.026 ppm2      1.124 CV     1
 OR { 3471}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 137  and name HG2%)
 ASSI { 3484}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
      4.100     2.100     1.900 peak  3484 spectrum    1 weight  0.10000E+01 volume  0.56932E-03 ppm1      5.248 ppm2      3.066 CV     1
 OR { 3484}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 71   and name HD2 ))
 ASSI { 3485}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      4.300     2.300     1.700 peak  3485 spectrum    1 weight  0.10000E+01 volume  0.64808E-03 ppm1      5.133 ppm2      8.556 CV     1
 OR { 3485}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
 OR { 3485}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
 OR { 3485}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI { 3486}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 110  and name HN  ))
      3.300     1.300     1.300 peak  3486 spectrum    1 weight  0.10000E+01 volume  0.23558E-02 ppm1      5.112 ppm2      8.703 CV     1
 OR { 3486}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
 ASSI { 3488}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 139  and name HG2 ))
      3.600     1.700     1.700 peak  3488 spectrum    1 weight  0.10000E+01 volume  0.12034E-02 ppm1      5.113 ppm2      1.322 CV     1
 OR { 3488}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 13   and name HB% )
 OR { 3488}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 98   and name HG11))
 ASSI { 3495}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 6    and name HN  ))
      3.600     1.700     1.700 peak  3495 spectrum    1 weight  0.10000E+01 volume  0.10240E-02 ppm1      4.482 ppm2      8.964 CV     1
 OR { 3495}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
 ASSI { 3498}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 6    and name HA  ))
      3.200     1.300     1.300 peak  3498 spectrum    1 weight  0.10000E+01 volume  0.31694E-02 ppm1      4.489 ppm2      4.932 CV     1
 OR { 3498}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 30   and name HA  ))
 ASSI { 3523}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 5    and name HB  ))
      3.700     1.700     1.700 peak  3523 spectrum    1 weight  0.10000E+01 volume  0.82056E-03 ppm1      3.678 ppm2      2.297 CV     1
 OR { 3523}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 4    and name HG2 ))
 OR { 3523}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 4    and name HG1 ))
 ASSI { 3526}
   (( segid "    " and resid 92   and name HD1 ))
   (( segid "    " and resid 77   and name HD1 ))
      4.600     2.600     1.400 peak  3526 spectrum    1 weight  0.10000E+01 volume  0.71244E-03 ppm1      7.547 ppm2      6.810 CV     1
 OR { 3526}
   (( segid "    " and resid 92   and name HD1 ))
   (( segid "    " and resid 93   and name HN  ))
 ASSI { 3536}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
      3.700     1.700     1.700 peak  3536 spectrum    1 weight  0.10000E+01 volume  0.12084E-02 ppm1      5.814 ppm2      1.672 CV     1
 OR { 3536}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 139  and name HD1 ))
 OR { 3536}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 139  and name HB2 ))
 ASSI { 3540}
   (( segid "    " and resid 113  and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
      4.300     2.300     1.700 peak  3540 spectrum    1 weight  0.10000E+01 volume  0.18875E-02 ppm1      5.814 ppm2      0.617 CV     1
 OR { 3540}
   (( segid "    " and resid 113  and name HA  ))
   (  segid "    " and resid 140  and name HD2%)
 ASSI { 3544}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 96   and name HN  ))
      3.300     1.400     1.400 peak  3544 spectrum    1 weight  0.10000E+01 volume  0.14821E-02 ppm1      5.125 ppm2      9.236 CV     1
 OR { 3544}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 97   and name HN  ))
 ASSI { 3549}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 142  and name HB  ))
      2.800     1.000     1.000 peak  3549 spectrum    1 weight  0.10000E+01 volume  0.25849E-02 ppm1      5.126 ppm2      2.188 CV     1
 OR { 3549}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 109  and name HG2 ))
 OR { 3549}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 142  and name HB  ))
 OR { 3549}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HG1 ))
 ASSI { 3550}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HB1 ))
      2.300     0.600     0.600 peak  3550 spectrum    1 weight  0.10000E+01 volume  0.54261E-02 ppm1      5.131 ppm2      1.939 CV     1
 OR { 3550}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 109  and name HB2 ))
 ASSI { 3551}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HB2 ))
      2.700     0.900     0.900 peak  3551 spectrum    1 weight  0.10000E+01 volume  0.51565E-02 ppm1      5.136 ppm2      1.643 CV     1
 OR { 3551}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HB  ))
 ASSI { 3552}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 96   and name HG12))
      3.400     1.500     1.500 peak  3552 spectrum    1 weight  0.10000E+01 volume  0.32592E-02 ppm1      5.134 ppm2      1.062 CV     1
 OR { 3552}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
 OR { 3552}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 30   and name HG2%)
 ASSI { 3553}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
      2.600     0.800     0.800 peak  3553 spectrum    1 weight  0.10000E+01 volume  0.80409E-02 ppm1      5.123 ppm2      0.618 CV     1
 OR { 3553}
   (( segid "    " and resid 142  and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
 OR { 3553}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 28   and name HG2%)
 OR { 3553}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 28   and name HG1%)
 ASSI { 3555}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      4.300     2.300     1.700 peak  3555 spectrum    1 weight  0.10000E+01 volume  0.76904E-03 ppm1      5.109 ppm2      6.800 CV     1
 OR { 3555}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 112  and name HD% )
 ASSI { 3557}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      3.600     1.600     1.600 peak  3557 spectrum    1 weight  0.10000E+01 volume  0.15700E-02 ppm1      5.122 ppm2      3.706 CV     1
 OR { 3557}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HA  ))
 OR { 3557}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 109  and name HD2 ))
 OR { 3557}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 3568}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 55   and name HD% )
      4.400     2.400     1.600 peak  3568 spectrum    1 weight  0.10000E+01 volume  0.74604E-03 ppm1      4.868 ppm2      6.595 CV     1
 OR { 3568}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 3576}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 90   and name HN  ))
      2.000     0.500     0.500 peak  3576 spectrum    1 weight  0.10000E+01 volume  0.12873E-01 ppm1      4.061 ppm2      8.327 CV     1
 OR { 3576}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
 OR { 3576}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI { 3581}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 38   and name HA  ))
      3.700     1.700     1.700 peak  3581 spectrum    1 weight  0.10000E+01 volume  0.10547E-02 ppm1      4.015 ppm2      4.921 CV     1
 OR { 3581}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 3582}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 39   and name HA  ))
      2.400     0.700     0.700 peak  3582 spectrum    1 weight  0.10000E+01 volume  0.72301E-02 ppm1      4.012 ppm2      4.681 CV     1
 OR { 3582}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 90   and name HA1 ))
 ASSI { 3583}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 86   and name HE1 ))
      3.700     1.700     1.700 peak  3583 spectrum    1 weight  0.10000E+01 volume  0.79352E-03 ppm1      4.015 ppm2      2.656 CV     1
 OR { 3583}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI { 3590}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 65   and name HB1 ))
      4.500     2.500     1.500 peak  3590 spectrum    1 weight  0.10000E+01 volume  0.35868E-03 ppm1      4.881 ppm2      1.498 CV     1
 OR { 3590}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
 OR { 3590}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 114  and name HB1 ))
 OR { 3590}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 44   and name HB% )
 ASSI { 3598}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 67   and name HG1%)
      4.100     2.100     1.900 peak  3598 spectrum    1 weight  0.10000E+01 volume  0.12273E-02 ppm1      4.865 ppm2      0.486 CV     1
 OR { 3598}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 3602}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 77   and name HA  ))
      3.000     1.200     1.200 peak  3602 spectrum    1 weight  0.10000E+01 volume  0.20966E-02 ppm1      6.791 ppm2      4.661 CV     1
 OR { 3602}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 76   and name HA  ))
 ASSI { 3603}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 71   and name HD2 ))
      4.500     2.600     1.500 peak  3603 spectrum    1 weight  0.10000E+01 volume  0.45208E-03 ppm1      6.795 ppm2      3.115 CV     1
 OR { 3603}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI { 3610}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 75   and name HA  ))
      4.300     2.300     1.700 peak  3610 spectrum    1 weight  0.10000E+01 volume  0.56969E-03 ppm1      6.791 ppm2      3.869 CV     1
 OR { 3610}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 71   and name HD1 ))
 ASSI { 3613}
   (( segid "    " and resid 77   and name HD1 ))
   (  segid "    " and resid 76   and name HB% )
      4.400     2.400     1.600 peak  3613 spectrum    1 weight  0.10000E+01 volume  0.64267E-03 ppm1      6.783 ppm2      1.359 CV     1
 OR { 3613}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 86   and name HD1 ))
 ASSI { 3625}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 122  and name HA  ))
      3.800     1.800     1.800 peak  3625 spectrum    1 weight  0.10000E+01 volume  0.60296E-03 ppm1      6.373 ppm2      4.384 CV     1
 OR { 3625}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI { 3627}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 126  and name HE1 ))
      4.500     2.500     1.500 peak  3627 spectrum    1 weight  0.10000E+01 volume  0.49245E-03 ppm1      6.378 ppm2      3.097 CV     1
 OR { 3627}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 129  and name HB1 ))
 OR { 3627}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 123  and name HE1 ))
 ASSI { 3629}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 121  and name HB2 ))
      3.800     1.800     1.800 peak  3629 spectrum    1 weight  0.10000E+01 volume  0.11625E-02 ppm1      6.383 ppm2      2.495 CV     1
 OR { 3629}
   (( segid "    " and resid 121  and name HD1 ))
   (( segid "    " and resid 39   and name HB1 ))
 ASSI { 3637}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 97   and name HA1 ))
      3.200     1.300     1.300 peak  3637 spectrum    1 weight  0.10000E+01 volume  0.33463E-02 ppm1      5.169 ppm2      4.304 CV     1
 OR { 3637}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI { 3639}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
      2.400     0.800     0.800 peak  3639 spectrum    1 weight  0.10000E+01 volume  0.72482E-02 ppm1      5.163 ppm2      1.054 CV     1
 OR { 3639}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 30   and name HG2%)
 ASSI { 3641}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      2.900     1.000     1.000 peak  3641 spectrum    1 weight  0.10000E+01 volume  0.19010E-02 ppm1      5.169 ppm2      8.493 CV     1
 OR { 3641}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HN  ))
 ASSI { 3644}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 30   and name HB  ))
      3.700     1.700     1.700 peak  3644 spectrum    1 weight  0.10000E+01 volume  0.85602E-03 ppm1      5.166 ppm2      2.164 CV     1
 OR { 3644}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HG1 ))
 OR { 3644}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 3646}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      4.600     2.600     1.400 peak  3646 spectrum    1 weight  0.10000E+01 volume  0.27633E-03 ppm1      5.136 ppm2      8.731 CV     1
 OR { 3646}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
 OR { 3646}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 110  and name HN  ))
 ASSI { 3647}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      2.000     0.500     0.500 peak  3647 spectrum    1 weight  0.10000E+01 volume  0.12227E-01 ppm1      5.071 ppm2      8.567 CV     1
 OR { 3647}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI { 3648}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      2.800     1.000     1.000 peak  3648 spectrum    1 weight  0.10000E+01 volume  0.66691E-02 ppm1      5.077 ppm2      8.314 CV     1
 OR { 3648}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 143  and name HN  ))
 ASSI { 3652}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HA  ))
      3.900     1.900     1.900 peak  3652 spectrum    1 weight  0.10000E+01 volume  0.11054E-02 ppm1      5.069 ppm2      3.698 CV     1
 OR { 3652}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 3676}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 103  and name HN  ))
      3.400     1.400     1.400 peak  3676 spectrum    1 weight  0.10000E+01 volume  0.30459E-02 ppm1      4.068 ppm2      8.561 CV     1
 OR { 3676}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 104  and name HN  ))
 ASSI { 3679}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name HB2 ))
      3.400     1.500     1.500 peak  3679 spectrum    1 weight  0.10000E+01 volume  0.23155E-02 ppm1      4.062 ppm2      2.529 CV     1
 OR { 3679}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name HB1 ))
 OR { 3679}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 100  and name HB  ))
 ASSI { 3685}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HE  ))
      5.000     3.100     1.000 peak  3685 spectrum    1 weight  0.10000E+01 volume  0.51379E-03 ppm1      3.709 ppm2      7.274 CV     1
 OR { 3685}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
 ASSI { 3688}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      3.300     1.300     1.300 peak  3688 spectrum    1 weight  0.10000E+01 volume  0.12776E-02 ppm1      3.701 ppm2      8.270 CV     1
 OR { 3688}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 3696}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 19   and name HD2%)
      3.300     1.400     1.400 peak  3696 spectrum    1 weight  0.10000E+01 volume  0.21503E-02 ppm1      3.693 ppm2      0.421 CV     1
 OR { 3696}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 25   and name HD1%)
 OR { 3696}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 65   and name HD2%)
 ASSI { 3701}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 81   and name HD21))
      4.500     2.500     1.500 peak  3701 spectrum    1 weight  0.10000E+01 volume  0.45600E-03 ppm1      5.280 ppm2      7.717 CV     1
 OR { 3701}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
 ASSI { 3702}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HA  ))
      4.200     2.200     1.800 peak  3702 spectrum    1 weight  0.10000E+01 volume  0.64086E-03 ppm1      5.283 ppm2      4.846 CV     1
 OR { 3702}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 101  and name HA  ))
 ASSI { 3704}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.800     1.800     1.800 peak  3704 spectrum    1 weight  0.10000E+01 volume  0.16875E-02 ppm1      5.272 ppm2      2.621 CV     1
 OR { 3704}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 3707}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      3.200     1.300     1.300 peak  3707 spectrum    1 weight  0.10000E+01 volume  0.43350E-02 ppm1      5.285 ppm2      0.599 CV     1
 OR { 3707}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 3708}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name HN  ))
      2.200     0.600     0.600 peak  3708 spectrum    1 weight  0.10000E+01 volume  0.12213E-01 ppm1      5.018 ppm2      8.437 CV     1
 OR { 3708}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HN  ))
 ASSI { 3710}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 133  and name HA2 ))
      3.800     1.800     1.800 peak  3710 spectrum    1 weight  0.10000E+01 volume  0.15081E-02 ppm1      5.018 ppm2      3.860 CV     1
 OR { 3710}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name HB  ))
 ASSI { 3713}
   (( segid "    " and resid 134  and name HA  ))
   (  segid "    " and resid 135  and name HG2%)
      4.600     2.600     1.400 peak  3713 spectrum    1 weight  0.10000E+01 volume  0.55751E-03 ppm1      5.014 ppm2      1.064 CV     1
 OR { 3713}
   (( segid "    " and resid 134  and name HA  ))
   (  segid "    " and resid 7    and name HG2%)
 ASSI { 3716}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HG12))
      3.400     1.500     1.500 peak  3716 spectrum    1 weight  0.10000E+01 volume  0.15569E-02 ppm1      4.938 ppm2      0.092 CV     1
 OR { 3716}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 96   and name HD1%)
 ASSI { 3728}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 97   and name HN  ))
      4.000     2.000     2.000 peak  3728 spectrum    1 weight  0.10000E+01 volume  0.71723E-03 ppm1      4.944 ppm2      9.230 CV     1
 OR { 3728}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 97   and name HN  ))
 OR { 3728}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 96   and name HN  ))
 OR { 3728}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 77   and name HE1 ))
 ASSI { 3731}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 99   and name HD% )
      3.800     1.800     1.800 peak  3731 spectrum    1 weight  0.10000E+01 volume  0.80520E-03 ppm1      4.935 ppm2      6.791 CV     1
 OR { 3731}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 99   and name HD% )
 OR { 3731}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 77   and name HD1 ))
 ASSI { 3732}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB  ))
      2.700     0.900     0.900 peak  3732 spectrum    1 weight  0.10000E+01 volume  0.35246E-02 ppm1      4.934 ppm2      0.689 CV     1
 OR { 3732}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 98   and name HG12))
 ASSI { 3749}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HN  ))
      2.700     0.900     0.900 peak  3749 spectrum    1 weight  0.10000E+01 volume  0.36718E-02 ppm1      4.037 ppm2      8.213 CV     1
 OR { 3749}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI { 3779}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 104  and name HN  ))
      2.000     0.500     0.500 peak  3779 spectrum    1 weight  0.10000E+01 volume  0.11667E-01 ppm1      4.053 ppm2      8.560 CV     1
 OR { 3779}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 3780}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 102  and name HA2 ))
      4.600     2.600     1.400 peak  3780 spectrum    1 weight  0.10000E+01 volume  0.49294E-03 ppm1      4.047 ppm2      3.468 CV     1
 OR { 3780}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 93   and name HA2 ))
 ASSI { 3781}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 100  and name HB  ))
      3.300     1.400     1.400 peak  3781 spectrum    1 weight  0.10000E+01 volume  0.36685E-02 ppm1      4.047 ppm2      2.516 CV     1
 OR { 3781}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 104  and name HB1 ))
 ASSI { 3783}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      3.400     1.400     1.400 peak  3783 spectrum    1 weight  0.10000E+01 volume  0.24253E-02 ppm1      4.049 ppm2      1.125 CV     1
 OR { 3783}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 20   and name HG2%)
 ASSI { 3791}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 123  and name HB2 ))
      4.600     2.700     1.400 peak  3791 spectrum    1 weight  0.10000E+01 volume  0.75422E-03 ppm1      7.111 ppm2      1.749 CV     1
 OR { 3791}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 3791}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 123  and name HB1 ))
 OR { 3791}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 126  and name HB1 ))
 ASSI { 3795}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 129  and name HN  ))
      4.900     3.000     1.100 peak  3795 spectrum    1 weight  0.10000E+01 volume  0.38824E-03 ppm1      7.089 ppm2      8.364 CV     1
 OR { 3795}
   (( segid "    " and resid 121  and name HZ3 ))
   (( segid "    " and resid 126  and name HN  ))
 ASSI { 3797}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 120  and name HN  ))
      3.700     1.700     1.700 peak  3797 spectrum    1 weight  0.10000E+01 volume  0.13168E-02 ppm1      4.473 ppm2      7.627 CV     1
 OR { 3797}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
 ASSI { 3798}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HN  ))
      2.100     0.500     0.500 peak  3798 spectrum    1 weight  0.10000E+01 volume  0.10190E-01 ppm1      4.470 ppm2      9.245 CV     1
 OR { 3798}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HN  ))
 ASSI { 3803}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 69   and name HB  ))
      4.300     2.300     1.700 peak  3803 spectrum    1 weight  0.10000E+01 volume  0.54335E-03 ppm1      4.479 ppm2      0.646 CV     1
 OR { 3803}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 28   and name HG1%)
 ASSI { 3809}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 96   and name HN  ))
      4.500     2.600     1.500 peak  3809 spectrum    1 weight  0.10000E+01 volume  0.31476E-03 ppm1      6.784 ppm2      9.190 CV     1
 OR { 3809}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 97   and name HN  ))
 ASSI { 3814}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 96   and name HA  ))
      4.300     2.300     1.700 peak  3814 spectrum    1 weight  0.10000E+01 volume  0.43131E-03 ppm1      6.780 ppm2      4.558 CV     1
 OR { 3814}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI { 3817}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 30   and name HB  ))
      4.200     2.200     1.800 peak  3817 spectrum    1 weight  0.10000E+01 volume  0.88677E-03 ppm1      6.785 ppm2      2.158 CV     1
 OR { 3817}
   (( segid "    " and resid 92   and name HH2 ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 3825}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      2.800     1.000     1.000 peak  3825 spectrum    1 weight  0.10000E+01 volume  0.24426E-02 ppm1      5.285 ppm2      8.366 CV     1
 OR { 3825}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 3827}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 54   and name HD% )
      3.200     1.300     1.300 peak  3827 spectrum    1 weight  0.10000E+01 volume  0.31202E-02 ppm1      5.283 ppm2      7.276 CV     1
 OR { 3827}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 55   and name HE% )
 ASSI { 3828}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      4.300     2.300     1.700 peak  3828 spectrum    1 weight  0.10000E+01 volume  0.60573E-03 ppm1      5.277 ppm2      6.917 CV     1
 OR { 3828}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 49   and name HE% )
 OR { 3828}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 81   and name HD22))
 ASSI { 3831}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 53   and name HA  ))
      4.000     2.000     2.000 peak  3831 spectrum    1 weight  0.10000E+01 volume  0.72375E-03 ppm1      5.277 ppm2      4.740 CV     1
 OR { 3831}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 3833}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
      2.800     1.000     1.000 peak  3833 spectrum    1 weight  0.10000E+01 volume  0.38773E-02 ppm1      5.282 ppm2      2.733 CV     1
 OR { 3833}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI { 3835}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
      4.000     2.000     2.000 peak  3835 spectrum    1 weight  0.10000E+01 volume  0.74522E-03 ppm1      5.277 ppm2      2.224 CV     1
 OR { 3835}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 82   and name HA2 ))
 OR { 3835}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name HB2 ))
 ASSI { 3838}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 67   and name HG1%)
      4.100     2.100     1.900 peak  3838 spectrum    1 weight  0.10000E+01 volume  0.95452E-03 ppm1      5.279 ppm2      0.465 CV     1
 OR { 3838}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 116  and name HD2%)
 OR { 3838}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 116  and name HG  ))
 OR { 3838}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 3841}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
      3.400     1.500     1.500 peak  3841 spectrum    1 weight  0.10000E+01 volume  0.29178E-02 ppm1      4.487 ppm2      4.303 CV     1
 OR { 3841}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HA1 ))
 ASSI { 3856}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      2.500     0.800     0.800 peak  3856 spectrum    1 weight  0.10000E+01 volume  0.44192E-02 ppm1      3.906 ppm2      8.246 CV     1
 OR { 3856}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HN  ))
 ASSI { 3878}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
      4.600     2.700     1.400 peak  3878 spectrum    1 weight  0.10000E+01 volume  0.47284E-03 ppm1      2.697 ppm2      2.307 CV     1
 OR { 3878}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 3896}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 53   and name HA  ))
      3.900     1.900     1.900 peak  3896 spectrum    1 weight  0.10000E+01 volume  0.83323E-03 ppm1      5.101 ppm2      4.701 CV     1
 OR { 3896}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 3900}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name HG1 ))
      3.900     1.900     1.900 peak  3900 spectrum    1 weight  0.10000E+01 volume  0.15031E-02 ppm1      5.099 ppm2      2.276 CV     1
 OR { 3900}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name HB2 ))
 OR { 3900}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
 OR { 3900}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
 ASSI { 3903}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      4.400     2.400     1.600 peak  3903 spectrum    1 weight  0.10000E+01 volume  0.69609E-03 ppm1      5.090 ppm2      7.554 CV     1
 OR { 3903}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI { 3916}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 56   and name HB1 ))
      3.600     1.600     1.600 peak  3916 spectrum    1 weight  0.10000E+01 volume  0.21022E-02 ppm1      4.941 ppm2      1.745 CV     1
 OR { 3916}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 3917}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      5.000     3.100     1.000 peak  3917 spectrum    1 weight  0.10000E+01 volume  0.48634E-03 ppm1      4.942 ppm2      1.495 CV     1
 OR { 3917}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI { 3937}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      2.700     0.900     0.900 peak  3937 spectrum    1 weight  0.10000E+01 volume  0.55495E-02 ppm1      3.886 ppm2      7.500 CV     1
 OR { 3937}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 3940}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB1 ))
      2.400     0.700     0.700 peak  3940 spectrum    1 weight  0.10000E+01 volume  0.11486E-01 ppm1      3.888 ppm2      2.262 CV     1
 OR { 3940}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 103  and name HB1 ))
 ASSI { 3942}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 103  and name HN  ))
      2.400     0.700     0.700 peak  3942 spectrum    1 weight  0.10000E+01 volume  0.96793E-02 ppm1      3.850 ppm2      8.570 CV     1
 OR { 3942}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
 ASSI { 3947}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 85   and name HB1 ))
      5.100     3.200     0.900 peak  3947 spectrum    1 weight  0.10000E+01 volume  0.34886E-03 ppm1      6.362 ppm2      2.696 CV     1
 OR { 3947}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 3948}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 42   and name HN  ))
      4.300     2.300     1.700 peak  3948 spectrum    1 weight  0.10000E+01 volume  0.42578E-03 ppm1      6.342 ppm2      9.193 CV     1
 OR { 3948}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 3953}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 85   and name HA  ))
      3.600     1.600     1.600 peak  3953 spectrum    1 weight  0.10000E+01 volume  0.48985E-03 ppm1      6.349 ppm2      5.644 CV     1
 OR { 3953}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 41   and name HA  ))
 ASSI { 3955}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 43   and name HE1 ))
      5.100     3.200     0.900 peak  3955 spectrum    1 weight  0.10000E+01 volume  0.32063E-03 ppm1      6.350 ppm2      2.935 CV     1
 OR { 3955}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 92   and name HB2 ))
 OR { 3955}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 43   and name HE2 ))
 ASSI { 3956}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 86   and name HE2 ))
      4.600     2.700     1.400 peak  3956 spectrum    1 weight  0.10000E+01 volume  0.45071E-03 ppm1      6.350 ppm2      2.161 CV     1
 OR { 3956}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 83   and name HB  ))
 OR { 3956}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 30   and name HB  ))
 ASSI { 3960}
   (( segid "    " and resid 77   and name HZ3 ))
   (  segid "    " and resid 40   and name HG1%)
      3.000     1.100     1.100 peak  3960 spectrum    1 weight  0.10000E+01 volume  0.42140E-02 ppm1      6.349 ppm2      1.232 CV     1
 OR { 3960}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 42   and name HB2 ))
 OR { 3960}
   (( segid "    " and resid 77   and name HZ3 ))
   (  segid "    " and resid 40   and name HG2%)
 ASSI { 3962}
   (( segid "    " and resid 77   and name HZ3 ))
   (  segid "    " and resid 96   and name HG2%)
      4.300     2.400     1.700 peak  3962 spectrum    1 weight  0.10000E+01 volume  0.43300E-03 ppm1      6.343 ppm2      0.289 CV     1
 OR { 3962}
   (( segid "    " and resid 77   and name HZ3 ))
   (( segid "    " and resid 86   and name HD2 ))
 ASSI { 3987}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 63   and name HB2 ))
      3.800     1.800     1.800 peak  3987 spectrum    1 weight  0.10000E+01 volume  0.10046E-02 ppm1      5.397 ppm2      2.700 CV     1
 OR { 3987}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 112  and name HB1 ))
 OR { 3987}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI { 4001}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 24   and name HA  ))
      2.900     1.100     1.100 peak  4001 spectrum    1 weight  0.10000E+01 volume  0.69456E-02 ppm1      5.017 ppm2      4.093 CV     1
 OR { 4001}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI { 4004}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      3.900     1.900     1.900 peak  4004 spectrum    1 weight  0.10000E+01 volume  0.13040E-02 ppm1      5.007 ppm2      1.043 CV     1
 OR { 4004}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 25   and name HG12))
 ASSI { 4008}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      2.700     0.900     0.900 peak  4008 spectrum    1 weight  0.10000E+01 volume  0.51222E-02 ppm1      4.385 ppm2      8.102 CV     1
 OR { 4008}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI { 4010}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
      2.500     0.800     0.800 peak  4010 spectrum    1 weight  0.10000E+01 volume  0.85300E-02 ppm1      4.387 ppm2      2.709 CV     1
 OR { 4010}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
 ASSI { 4015}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB1 ))
      2.300     0.700     0.700 peak  4015 spectrum    1 weight  0.10000E+01 volume  0.11372E-01 ppm1      4.355 ppm2      2.320 CV     1
 OR { 4015}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 3    and name HB2 ))
 OR { 4015}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 4018}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 19   and name HD2%)
      4.200     2.200     1.800 peak  4018 spectrum    1 weight  0.10000E+01 volume  0.70344E-03 ppm1      4.347 ppm2      0.386 CV     1
 OR { 4018}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI { 4023}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 14   and name HB2 ))
      4.000     2.000     2.000 peak  4023 spectrum    1 weight  0.10000E+01 volume  0.11325E-02 ppm1      4.330 ppm2      1.288 CV     1
 OR { 4023}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 139  and name HG1 ))
 OR { 4023}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 114  and name HG  ))
 ASSI { 4030}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 90   and name HA2 ))
      2.500     0.800     0.800 peak  4030 spectrum    1 weight  0.10000E+01 volume  0.52758E-02 ppm1      4.280 ppm2      3.831 CV     1
 OR { 4030}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 91   and name HB1 ))
 ASSI { 4036}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 3    and name HN  ))
      2.100     0.600     0.600 peak  4036 spectrum    1 weight  0.10000E+01 volume  0.15026E-01 ppm1      4.235 ppm2      8.260 CV     1
 OR { 4036}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 2    and name HN  ))
 ASSI { 4039}
   (( segid "    " and resid 2    and name HA  ))
   (  segid "    " and resid 33   and name HD2%)
      4.200     2.200     1.800 peak  4039 spectrum    1 weight  0.10000E+01 volume  0.58645E-03 ppm1      4.237 ppm2      0.875 CV     1
 OR { 4039}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 38   and name HG2 ))
 ASSI { 4047}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 80   and name HN  ))
      2.700     0.900     0.900 peak  4047 spectrum    1 weight  0.10000E+01 volume  0.27221E-02 ppm1      5.601 ppm2      9.483 CV     1
 OR { 4047}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 4055}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 85   and name HB2 ))
      4.400     2.400     1.600 peak  4055 spectrum    1 weight  0.10000E+01 volume  0.82976E-03 ppm1      5.600 ppm2      2.357 CV     1
 OR { 4055}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI { 4057}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 42   and name HB2 ))
      3.900     1.900     1.900 peak  4057 spectrum    1 weight  0.10000E+01 volume  0.13388E-02 ppm1      5.600 ppm2      1.213 CV     1
 OR { 4057}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 79   and name HG2%)
 ASSI { 4060}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 83   and name HG2%)
      3.900     1.900     1.900 peak  4060 spectrum    1 weight  0.10000E+01 volume  0.62476E-03 ppm1      5.587 ppm2      0.808 CV     1
 OR { 4060}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 4067}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 54   and name HB1 ))
      4.700     2.700     1.300 peak  4067 spectrum    1 weight  0.10000E+01 volume  0.69308E-03 ppm1      5.286 ppm2      3.014 CV     1
 OR { 4067}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 4070}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      4.100     2.100     1.900 peak  4070 spectrum    1 weight  0.10000E+01 volume  0.72990E-03 ppm1      5.290 ppm2      1.492 CV     1
 OR { 4070}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 114  and name HB1 ))
 OR { 4070}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 65   and name HB1 ))
 OR { 4070}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 114  and name HB2 ))
 ASSI { 4071}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 64   and name HD1 ))
      5.000     3.100     1.000 peak  4071 spectrum    1 weight  0.10000E+01 volume  0.39697E-03 ppm1      5.295 ppm2      1.061 CV     1
 OR { 4071}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 64   and name HB1 ))
 OR { 4071}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI { 4072}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 114  and name HD2%)
      3.900     1.900     1.900 peak  4072 spectrum    1 weight  0.10000E+01 volume  0.12463E-02 ppm1      5.284 ppm2      0.828 CV     1
 OR { 4072}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
 OR { 4072}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 64   and name HG1 ))
 ASSI { 4074}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 67   and name HG1%)
      3.300     1.300     1.300 peak  4074 spectrum    1 weight  0.10000E+01 volume  0.41670E-02 ppm1      5.291 ppm2      0.474 CV     1
 OR { 4074}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 4074}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 4075}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 66   and name HD% )
      3.800     1.800     1.800 peak  4075 spectrum    1 weight  0.10000E+01 volume  0.12595E-02 ppm1      5.286 ppm2      7.252 CV     1
 OR { 4075}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 4087}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
      2.700     0.900     0.900 peak  4087 spectrum    1 weight  0.10000E+01 volume  0.31816E-02 ppm1      4.581 ppm2      8.695 CV     1
 OR { 4087}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
 ASSI { 4088}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 10   and name HD2%)
      3.400     1.400     1.400 peak  4088 spectrum    1 weight  0.10000E+01 volume  0.23273E-02 ppm1      4.583 ppm2      0.962 CV     1
 OR { 4088}
   (( segid "    " and resid 104  and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
ASSI { 4089}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 10   and name HD1%)
      4.000     2.000     2.000 peak  4089 spectrum    1 weight  0.10000E+01 volume  0.15943E-02 ppm1      4.577 ppm2      0.484 CV     1
 OR { 4089}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 4089}
   (( segid "    " and resid 104  and name HA  ))
   (  segid "    " and resid 65   and name HD2%)
 ASSI { 4090}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      2.900     1.100     1.100 peak  4090 spectrum    1 weight  0.10000E+01 volume  0.12523E-02 ppm1      4.569 ppm2      8.934 CV     1
 OR { 4090}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
 ASSI { 4091}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 115  and name HN  ))
      4.200     2.300     1.800 peak  4091 spectrum    1 weight  0.10000E+01 volume  0.63731E-03 ppm1      4.571 ppm2      7.951 CV     1
 OR { 4091}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 4092}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HB2 ))
      3.100     1.200     1.200 peak  4092 spectrum    1 weight  0.10000E+01 volume  0.17905E-02 ppm1      4.577 ppm2      1.451 CV     1
 OR { 4092}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HB2 ))
 OR { 4092}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 4095}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      2.700     0.900     0.900 peak  4095 spectrum    1 weight  0.10000E+01 volume  0.31952E-02 ppm1      4.407 ppm2      8.380 CV     1
 OR { 4095}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 3    and name HN  ))
 ASSI { 4096}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      3.800     1.800     1.800 peak  4096 spectrum    1 weight  0.10000E+01 volume  0.10202E-02 ppm1      4.400 ppm2      7.508 CV     1
 OR { 4096}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 4098}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 49   and name HE% )
      3.700     1.700     1.700 peak  4098 spectrum    1 weight  0.10000E+01 volume  0.13007E-02 ppm1      4.400 ppm2      6.940 CV     1
 OR { 4098}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 55   and name HZ  ))
 ASSI { 4116}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
      4.300     2.300     1.700 peak  4116 spectrum    1 weight  0.10000E+01 volume  0.96207E-03 ppm1      3.962 ppm2      1.270 CV     1
 OR { 4116}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 76   and name HB% )
 ASSI { 4118}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 92   and name HZ2 ))
      4.800     2.800     1.200 peak  4118 spectrum    1 weight  0.10000E+01 volume  0.39201E-03 ppm1      6.705 ppm2      7.627 CV     1
 OR { 4118}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 74   and name HD21))
 ASSI { 4124}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 72   and name HN  ))
      5.600     3.900     0.400 peak  4124 spectrum    1 weight  0.10000E+01 volume  0.30212E-03 ppm1      6.703 ppm2      8.716 CV     1
 OR { 4124}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 32   and name HN  ))
 ASSI { 4139}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 63   and name HB2 ))
      4.400     2.400     1.600 peak  4139 spectrum    1 weight  0.10000E+01 volume  0.85226E-03 ppm1      5.083 ppm2      2.689 CV     1
 OR { 4139}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI { 4140}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      3.700     1.700     1.700 peak  4140 spectrum    1 weight  0.10000E+01 volume  0.92905E-03 ppm1      5.086 ppm2      1.505 CV     1
 OR { 4140}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI { 4144}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 56   and name HB1 ))
      4.200     2.200     1.800 peak  4144 spectrum    1 weight  0.10000E+01 volume  0.79207E-03 ppm1      5.084 ppm2      1.761 CV     1
 OR { 4144}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 4146}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
      2.400     0.700     0.700 peak  4146 spectrum    1 weight  0.10000E+01 volume  0.71054E-02 ppm1      4.965 ppm2      8.936 CV     1
 OR { 4146}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 114  and name HN  ))
 ASSI { 4149}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG1 ))
      3.100     1.200     1.200 peak  4149 spectrum    1 weight  0.10000E+01 volume  0.16956E-02 ppm1      4.890 ppm2      1.253 CV     1
 OR { 4149}
   (( segid "    " and resid 6    and name HA  ))
   (  segid "    " and resid 134  and name HG2%)
 OR { 4149}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 122  and name HB% )
 ASSI { 4150}
   (( segid "    " and resid 6    and name HA  ))
   (  segid "    " and resid 7    and name HG1%)
      4.200     2.200     1.800 peak  4150 spectrum    1 weight  0.10000E+01 volume  0.98486E-03 ppm1      4.892 ppm2      0.922 CV     1
 OR { 4150}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 83   and name HG2%)
 OR { 4150}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 42   and name HD2%)
 OR { 4150}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 83   and name HG2%)
 ASSI { 4151}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HN  ))
      3.100     1.200     1.200 peak  4151 spectrum    1 weight  0.10000E+01 volume  0.14338E-02 ppm1      4.890 ppm2      9.013 CV     1
 OR { 4151}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HN  ))
 ASSI { 4152}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HN  ))
      2.300     0.700     0.700 peak  4152 spectrum    1 weight  0.10000E+01 volume  0.55251E-02 ppm1      4.896 ppm2      7.624 CV     1
 OR { 4152}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 122  and name HN  ))
 ASSI { 4155}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 49   and name HE% )
      3.500     1.500     1.500 peak  4155 spectrum    1 weight  0.10000E+01 volume  0.14061E-02 ppm1      4.854 ppm2      6.856 CV     1
 OR { 4155}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HE3 ))
 OR { 4155}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 43   and name HZ% )
 OR { 4155}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI { 4158}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HB1 ))
      3.500     1.600     1.600 peak  4158 spectrum    1 weight  0.10000E+01 volume  0.12675E-02 ppm1      4.855 ppm2      2.733 CV     1
 OR { 4158}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI { 4165}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 112  and name HB2 ))
      4.300     2.300     1.700 peak  4165 spectrum    1 weight  0.10000E+01 volume  0.42272E-03 ppm1      4.620 ppm2      2.677 CV     1
 OR { 4165}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 112  and name HB1 ))
 OR { 4165}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI { 4167}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 140  and name HD2%)
      3.900     1.900     1.900 peak  4167 spectrum    1 weight  0.10000E+01 volume  0.12576E-02 ppm1      4.573 ppm2      0.636 CV     1
 OR { 4167}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
 OR { 4167}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 28   and name HG2%)
 OR { 4167}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 65   and name HB2 ))
 OR { 4167}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 4175}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      1.900     0.500     0.500 peak  4175 spectrum    1 weight  0.10000E+01 volume  0.14252E-01 ppm1      4.292 ppm2      8.434 CV     1
 OR { 4175}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI { 4192}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 126  and name HE1 ))
      4.300     2.300     1.700 peak  4192 spectrum    1 weight  0.10000E+01 volume  0.75888E-03 ppm1      6.937 ppm2      3.116 CV     1
 OR { 4192}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 129  and name HB1 ))
 ASSI { 4193}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 126  and name HE2 ))
      5.300     3.500     0.700 peak  4193 spectrum    1 weight  0.10000E+01 volume  0.42037E-03 ppm1      6.935 ppm2      2.916 CV     1
 OR { 4193}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 43   and name HE2 ))
 OR { 4193}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 129  and name HB2 ))
 ASSI { 4197}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 126  and name HB1 ))
      5.300     3.500     0.700 peak  4197 spectrum    1 weight  0.10000E+01 volume  0.45237E-03 ppm1      6.934 ppm2      1.758 CV     1
 OR { 4197}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 4197}
   (( segid "    " and resid 121  and name HH2 ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI { 4201}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 92   and name HA  ))
      4.500     2.600     1.500 peak  4201 spectrum    1 weight  0.10000E+01 volume  0.47131E-03 ppm1      6.714 ppm2      4.597 CV     1
 OR { 4201}
   (( segid "    " and resid 92   and name HZ3 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI { 4205}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      4.600     2.600     1.400 peak  4205 spectrum    1 weight  0.10000E+01 volume  0.36325E-03 ppm1      5.738 ppm2      8.205 CV     1
 OR { 4205}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
 ASSI { 4208}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      3.400     1.400     1.400 peak  4208 spectrum    1 weight  0.10000E+01 volume  0.19331E-02 ppm1      5.745 ppm2      6.620 CV     1
 OR { 4208}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 77   and name HH2 ))
 ASSI { 4210}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 77   and name HA  ))
      4.600     2.600     1.400 peak  4210 spectrum    1 weight  0.10000E+01 volume  0.43544E-03 ppm1      5.747 ppm2      4.670 CV     1
 OR { 4210}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 129  and name HA  ))
 OR { 4210}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 39   and name HA  ))
 OR { 4210}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 39   and name HA  ))
 ASSI { 4215}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 40   and name HG1%)
      4.000     2.000     2.000 peak  4215 spectrum    1 weight  0.10000E+01 volume  0.10488E-02 ppm1      5.746 ppm2      1.245 CV     1
 OR { 4215}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 40   and name HG2%)
 OR { 4215}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 4216}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 5    and name HG2%)
      4.300     2.300     1.700 peak  4216 spectrum    1 weight  0.10000E+01 volume  0.37322E-03 ppm1      5.744 ppm2      1.071 CV     1
 OR { 4216}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 83   and name HG1%)
 ASSI { 4218}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 77   and name HB1 ))
      4.000     2.000     2.000 peak  4218 spectrum    1 weight  0.10000E+01 volume  0.51631E-03 ppm1      5.718 ppm2      1.996 CV     1
 OR { 4218}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 40   and name HB  ))
 ASSI { 4219}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name HN  ))
      2.700     0.900     0.900 peak  4219 spectrum    1 weight  0.10000E+01 volume  0.29786E-02 ppm1      5.699 ppm2      9.153 CV     1
 OR { 4219}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI { 4224}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name HB1 ))
      2.600     0.800     0.800 peak  4224 spectrum    1 weight  0.10000E+01 volume  0.37295E-02 ppm1      5.701 ppm2      2.747 CV     1
 OR { 4224}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI { 4226}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 41   and name HB% )
      3.100     1.200     1.200 peak  4226 spectrum    1 weight  0.10000E+01 volume  0.31341E-02 ppm1      5.702 ppm2      1.484 CV     1
 OR { 4226}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 41   and name HB% )
 ASSI { 4227}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 40   and name HG1%)
      3.800     1.800     1.800 peak  4227 spectrum    1 weight  0.10000E+01 volume  0.10075E-02 ppm1      5.690 ppm2      1.240 CV     1
 OR { 4227}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 4231}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 42   and name HD1%)
      3.600     1.600     1.600 peak  4231 spectrum    1 weight  0.10000E+01 volume  0.59256E-03 ppm1      5.683 ppm2      0.877 CV     1
 OR { 4231}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 42   and name HD2%)
 OR { 4231}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 83   and name HG2%)
 OR { 4231}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 4236}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 138  and name HA  ))
      3.800     1.800     1.800 peak  4236 spectrum    1 weight  0.10000E+01 volume  0.12619E-02 ppm1      4.959 ppm2      5.264 CV     1
 OR { 4236}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI { 4238}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HB2 ))
      2.400     0.700     0.700 peak  4238 spectrum    1 weight  0.10000E+01 volume  0.62319E-02 ppm1      4.956 ppm2      1.635 CV     1
 OR { 4238}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
 OR { 4238}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HD1 ))
 ASSI { 4239}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 113  and name HG2%)
      3.100     1.200     1.200 peak  4239 spectrum    1 weight  0.10000E+01 volume  0.35033E-02 ppm1      4.953 ppm2      1.190 CV     1
 OR { 4239}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 11   and name HG2%)
 ASSI { 4240}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 114  and name HD2%)
      3.400     1.500     1.500 peak  4240 spectrum    1 weight  0.10000E+01 volume  0.19445E-02 ppm1      4.951 ppm2      0.777 CV     1
 OR { 4240}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI { 4245}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
      3.400     1.400     1.400 peak  4245 spectrum    1 weight  0.10000E+01 volume  0.50797E-03 ppm1      4.763 ppm2      2.207 CV     1
 OR { 4245}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 5    and name HB  ))
 ASSI { 4248}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      3.200     1.200     1.200 peak  4248 spectrum    1 weight  0.10000E+01 volume  0.15509E-02 ppm1      4.556 ppm2      7.688 CV     1
 OR { 4248}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
 ASSI { 4253}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HD22))
      3.100     1.200     1.200 peak  4253 spectrum    1 weight  0.10000E+01 volume  0.32336E-02 ppm1      4.069 ppm2      6.914 CV     1
 OR { 4253}
   (( segid "    " and resid 81   and name HA  ))
   (  segid "    " and resid 84   and name HD% )
 ASSI { 4257}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      2.500     0.800     0.800 peak  4257 spectrum    1 weight  0.10000E+01 volume  0.36094E-02 ppm1      4.848 ppm2      8.784 CV     1
 OR { 4257}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
 ASSI { 4258}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      3.900     1.900     1.900 peak  4258 spectrum    1 weight  0.10000E+01 volume  0.67958E-03 ppm1      4.845 ppm2      9.445 CV     1
 OR { 4258}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 142  and name HN  ))
 ASSI { 4262}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HD21))
      4.700     2.700     1.300 peak  4262 spectrum    1 weight  0.10000E+01 volume  0.26531E-03 ppm1      4.631 ppm2      7.576 CV     1
 OR { 4262}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 92   and name HZ2 ))
 ASSI { 4276}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 123  and name HA  ))
      3.900     1.900     1.900 peak  4276 spectrum    1 weight  0.10000E+01 volume  0.96727E-03 ppm1      4.439 ppm2      3.954 CV     1
 OR { 4276}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 4278}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 125  and name HN  ))
      2.000     0.500     0.500 peak  4278 spectrum    1 weight  0.10000E+01 volume  0.12140E-01 ppm1      4.427 ppm2      8.025 CV     1
 OR { 4278}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HN  ))
 ASSI { 4280}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 123  and name HB2 ))
      3.800     1.800     1.800 peak  4280 spectrum    1 weight  0.10000E+01 volume  0.17101E-02 ppm1      4.433 ppm2      1.756 CV     1
 OR { 4280}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
 OR { 4280}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 126  and name HB1 ))
 ASSI { 4307}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 40   and name HN  ))
      4.100     2.100     1.900 peak  4307 spectrum    1 weight  0.10000E+01 volume  0.10127E-02 ppm1      6.620 ppm2      9.162 CV     1
 OR { 4307}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 77   and name HE1 ))
 OR { 4307}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI { 4312}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 85   and name HA  ))
      3.400     1.500     1.500 peak  4312 spectrum    1 weight  0.10000E+01 volume  0.18636E-02 ppm1      6.623 ppm2      5.650 CV     1
 OR { 4312}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 41   and name HA  ))
 ASSI { 4313}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 86   and name HE1 ))
      4.600     2.700     1.400 peak  4313 spectrum    1 weight  0.10000E+01 volume  0.53191E-03 ppm1      6.624 ppm2      2.704 CV     1
 OR { 4313}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 85   and name HB1 ))
 OR { 4313}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 4314}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 85   and name HB2 ))
      4.500     2.500     1.500 peak  4314 spectrum    1 weight  0.10000E+01 volume  0.54339E-03 ppm1      6.621 ppm2      2.330 CV     1
 OR { 4314}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI { 4316}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 71   and name HB1 ))
      3.900     1.900     1.900 peak  4316 spectrum    1 weight  0.10000E+01 volume  0.70695E-03 ppm1      6.621 ppm2      1.463 CV     1
 OR { 4316}
   (( segid "    " and resid 77   and name HH2 ))
   (  segid "    " and resid 41   and name HB% )
 ASSI { 4319}
   (( segid "    " and resid 77   and name HH2 ))
   (  segid "    " and resid 96   and name HG2%)
      4.900     3.000     1.100 peak  4319 spectrum    1 weight  0.10000E+01 volume  0.27795E-03 ppm1      6.623 ppm2      0.283 CV     1
 OR { 4319}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 86   and name HD2 ))
 ASSI { 4322}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 92   and name HB2 ))
      4.800     2.900     1.200 peak  4322 spectrum    1 weight  0.10000E+01 volume  0.36550E-03 ppm1      6.611 ppm2      3.042 CV     1
 OR { 4322}
   (( segid "    " and resid 77   and name HH2 ))
   (( segid "    " and resid 84   and name HB1 ))
 ASSI { 4326}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 25   and name HD1%)
      4.500     2.500     1.500 peak  4326 spectrum    1 weight  0.10000E+01 volume  0.53006E-03 ppm1      4.862 ppm2      0.430 CV     1
 OR { 4326}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 116  and name HD2%)
 OR { 4326}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 19   and name HD2%)
 ASSI { 4327}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HB1 ))
      5.300     3.600     0.700 peak  4327 spectrum    1 weight  0.10000E+01 volume  0.39554E-03 ppm1      4.851 ppm2      2.525 CV     1
 OR { 4327}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 18   and name HG1 ))
 OR { 4327}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 4328}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG1 ))
      2.700     0.900     0.900 peak  4328 spectrum    1 weight  0.10000E+01 volume  0.32157E-02 ppm1      4.855 ppm2      1.142 CV     1
 OR { 4328}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 4330}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      4.200     2.300     1.800 peak  4330 spectrum    1 weight  0.10000E+01 volume  0.34957E-03 ppm1      4.760 ppm2      8.421 CV     1
 OR { 4330}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 133  and name HN  ))
 ASSI { 4333}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HN  ))
      2.400     0.700     0.700 peak  4333 spectrum    1 weight  0.10000E+01 volume  0.40494E-02 ppm1      4.501 ppm2      7.980 CV     1
 OR { 4333}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI { 4334}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HB1 ))
      5.200     3.400     0.800 peak  4334 spectrum    1 weight  0.10000E+01 volume  0.43887E-03 ppm1      4.489 ppm2      1.780 CV     1
 OR { 4334}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 4334}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI { 4335}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HB1 ))
      5.200     3.400     0.800 peak  4335 spectrum    1 weight  0.10000E+01 volume  0.45385E-03 ppm1      4.493 ppm2      1.839 CV     1
 OR { 4335}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 123  and name HB2 ))
 OR { 4335}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI { 4337}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 127  and name HA  ))
      4.500     2.500     1.500 peak  4337 spectrum    1 weight  0.10000E+01 volume  0.15608E-02 ppm1      4.442 ppm2      4.011 CV     1
 OR { 4337}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 4345}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 118  and name HA1 ))
      3.900     1.900     1.900 peak  4345 spectrum    1 weight  0.10000E+01 volume  0.16748E-02 ppm1      5.342 ppm2      4.675 CV     1
 OR { 4345}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 4346}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 117  and name HB  ))
      4.700     2.800     1.300 peak  4346 spectrum    1 weight  0.10000E+01 volume  0.39211E-03 ppm1      5.338 ppm2      3.919 CV     1
 OR { 4346}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 40   and name HA  ))
 ASSI { 4348}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 41   and name HB% )
      3.800     1.800     1.800 peak  4348 spectrum    1 weight  0.10000E+01 volume  0.86097E-03 ppm1      5.333 ppm2      1.453 CV     1
 OR { 4348}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 117  and name HG2%)
 ASSI { 4356}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 137  and name HB  ))
      4.200     2.200     1.800 peak  4356 spectrum    1 weight  0.10000E+01 volume  0.52737E-03 ppm1      5.036 ppm2      3.800 CV     1
 OR { 4356}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 8    and name HA2 ))
 ASSI { 4357}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 10   and name HD2%)
      4.000     2.000     2.000 peak  4357 spectrum    1 weight  0.10000E+01 volume  0.79732E-03 ppm1      5.051 ppm2      1.008 CV     1
 OR { 4357}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 137  and name HG2%)
 ASSI { 4359}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 138  and name HG2%)
      4.600     2.700     1.400 peak  4359 spectrum    1 weight  0.10000E+01 volume  0.35377E-03 ppm1      5.011 ppm2      0.764 CV     1
 OR { 4359}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 28   and name HG1%)
 OR { 4359}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
 ASSI { 4362}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HB1 ))
      2.600     0.800     0.800 peak  4362 spectrum    1 weight  0.10000E+01 volume  0.49063E-02 ppm1      4.863 ppm2      1.837 CV     1
 OR { 4362}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
 OR { 4362}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 16   and name HG1 ))
 ASSI { 4363}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HB2 ))
      3.000     1.100     1.100 peak  4363 spectrum    1 weight  0.10000E+01 volume  0.23869E-02 ppm1      4.860 ppm2      1.305 CV     1
 OR { 4363}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HG1 ))
 ASSI { 4364}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      2.500     0.800     0.800 peak  4364 spectrum    1 weight  0.10000E+01 volume  0.54694E-02 ppm1      4.855 ppm2      8.586 CV     1
 OR { 4364}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI { 4366}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HB1 ))
      4.800     2.900     1.200 peak  4366 spectrum    1 weight  0.10000E+01 volume  0.75228E-03 ppm1      4.495 ppm2      1.725 CV     1
 OR { 4366}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 4366}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 123  and name HB2 ))
 OR { 4366}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI { 4369}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
      3.900     1.900     1.900 peak  4369 spectrum    1 weight  0.10000E+01 volume  0.67355E-03 ppm1      4.379 ppm2      2.206 CV     1
 OR { 4369}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 103  and name HB1 ))
 OR { 4369}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 24   and name HG1 ))
 ASSI { 4371}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.200     0.600     0.600 peak  4371 spectrum    1 weight  0.10000E+01 volume  0.87963E-02 ppm1      4.383 ppm2      7.567 CV     1
 OR { 4371}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI { 4377}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 18   and name HB1 ))
      3.800     1.800     1.800 peak  4377 spectrum    1 weight  0.10000E+01 volume  0.98263E-03 ppm1      4.377 ppm2      2.451 CV     1
 OR { 4377}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 100  and name HB  ))
 ASSI { 4385}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 55   and name HZ  ))
      3.200     1.300     1.300 peak  4385 spectrum    1 weight  0.10000E+01 volume  0.18587E-02 ppm1      4.310 ppm2      6.925 CV     1
 OR { 4385}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI { 4389}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 55   and name HB2 ))
      4.200     2.200     1.800 peak  4389 spectrum    1 weight  0.10000E+01 volume  0.71785E-03 ppm1      4.311 ppm2      2.207 CV     1
 OR { 4389}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 50   and name HB2 ))
 OR { 4389}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI { 4390}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 44   and name HB% )
      4.100     2.100     1.900 peak  4390 spectrum    1 weight  0.10000E+01 volume  0.11091E-02 ppm1      4.316 ppm2      1.516 CV     1
 OR { 4390}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 114  and name HB1 ))
 OR { 4390}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 114  and name HB2 ))
 ASSI { 4392}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      4.700     2.700     1.300 peak  4392 spectrum    1 weight  0.10000E+01 volume  0.45348E-03 ppm1      4.314 ppm2      0.620 CV     1
 OR { 4392}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 64   and name HD2 ))
 OR { 4392}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 4392}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI { 4394}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
      4.100     2.100     1.900 peak  4394 spectrum    1 weight  0.10000E+01 volume  0.76978E-03 ppm1      4.298 ppm2      2.864 CV     1
 OR { 4394}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 47   and name HB1 ))
 OR { 4394}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
 OR { 4394}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI { 4420}
   (( segid "    " and resid 121  and name HE3 ))
   (  segid "    " and resid 85   and name HE% )
      3.900     1.900     1.900 peak  4420 spectrum    1 weight  0.10000E+01 volume  0.40541E-03 ppm1      6.841 ppm2      5.690 CV     1
 OR { 4420}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 120  and name HA  ))
 ASSI { 4424}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 43   and name HE2 ))
      4.100     2.100     1.900 peak  4424 spectrum    1 weight  0.10000E+01 volume  0.77919E-03 ppm1      6.839 ppm2      2.944 CV     1
 OR { 4424}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 43   and name HE1 ))
 OR { 4424}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 129  and name HB2 ))
 ASSI { 4432}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 129  and name HN  ))
      4.100     2.100     1.900 peak  4432 spectrum    1 weight  0.10000E+01 volume  0.52894E-03 ppm1      6.837 ppm2      8.360 CV     1
 OR { 4432}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 126  and name HN  ))
 ASSI { 4434}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 127  and name HN  ))
      5.300     3.500     0.700 peak  4434 spectrum    1 weight  0.10000E+01 volume  0.31571E-03 ppm1      6.832 ppm2      8.013 CV     1
 OR { 4434}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 130  and name HN  ))
 ASSI { 4435}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 124  and name HA  ))
      4.500     2.500     1.500 peak  4435 spectrum    1 weight  0.10000E+01 volume  0.54455E-03 ppm1      6.833 ppm2      4.387 CV     1
 OR { 4435}
   (( segid "    " and resid 121  and name HE3 ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI { 4446}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 10   and name HG  ))
      4.400     2.400     1.600 peak  4446 spectrum    1 weight  0.10000E+01 volume  0.49344E-03 ppm1      5.045 ppm2      1.171 CV     1
 OR { 4446}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI { 4449}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      3.900     1.900     1.900 peak  4449 spectrum    1 weight  0.10000E+01 volume  0.11911E-02 ppm1      4.970 ppm2      8.862 CV     1
 OR { 4449}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI { 4455}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 117  and name HB  ))
      4.000     2.000     2.000 peak  4455 spectrum    1 weight  0.10000E+01 volume  0.12492E-02 ppm1      4.960 ppm2      3.902 CV     1
 OR { 4455}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI { 4458}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 100  and name HA  ))
      3.600     1.600     1.600 peak  4458 spectrum    1 weight  0.10000E+01 volume  0.39847E-02 ppm1      4.920 ppm2      3.475 CV     1
 OR { 4458}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 102  and name HA2 ))
 ASSI { 4461}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HB2 ))
      2.500     0.800     0.800 peak  4461 spectrum    1 weight  0.10000E+01 volume  0.53848E-02 ppm1      4.915 ppm2      2.214 CV     1
 OR { 4461}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 4462}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HD22))
      4.900     3.000     1.100 peak  4462 spectrum    1 weight  0.10000E+01 volume  0.42648E-03 ppm1      4.859 ppm2      6.793 CV     1
 OR { 4462}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 112  and name HD% )
 OR { 4462}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 92   and name HH2 ))
 ASSI { 4463}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 112  and name HE% )
      3.900     1.900     1.900 peak  4463 spectrum    1 weight  0.10000E+01 volume  0.13471E-02 ppm1      4.864 ppm2      6.397 CV     1
 OR { 4463}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 121  and name HD1 ))
 ASSI { 4466}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 16   and name HD2 ))
      2.900     1.000     1.000 peak  4466 spectrum    1 weight  0.10000E+01 volume  0.44898E-02 ppm1      4.868 ppm2      3.098 CV     1
 OR { 4466}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI { 4472}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HG2 ))
      3.400     1.500     1.500 peak  4472 spectrum    1 weight  0.10000E+01 volume  0.17160E-02 ppm1      4.858 ppm2      0.832 CV     1
 OR { 4472}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 89   and name HG1%)
 OR { 4472}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 107  and name HG2%)
 ASSI { 4473}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      3.100     1.200     1.200 peak  4473 spectrum    1 weight  0.10000E+01 volume  0.16614E-02 ppm1      4.811 ppm2      8.048 CV     1
 OR { 4473}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI { 4482}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 110  and name HN  ))
      4.100     2.100     1.900 peak  4482 spectrum    1 weight  0.10000E+01 volume  0.45810E-03 ppm1      5.596 ppm2      8.708 CV     1
 OR { 4482}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
 ASSI { 4483}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 142  and name HB  ))
      4.800     2.900     1.200 peak  4483 spectrum    1 weight  0.10000E+01 volume  0.35887E-03 ppm1      5.596 ppm2      2.133 CV     1
 OR { 4483}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 109  and name HG2 ))
 ASSI { 4484}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
      4.600     2.700     1.400 peak  4484 spectrum    1 weight  0.10000E+01 volume  0.74802E-03 ppm1      5.598 ppm2      1.707 CV     1
 OR { 4484}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI { 4488}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HD22))
      3.400     1.400     1.400 peak  4488 spectrum    1 weight  0.10000E+01 volume  0.22959E-02 ppm1      5.593 ppm2      6.757 CV     1
 OR { 4488}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 112  and name HD% )
 ASSI { 4492}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 110  and name HA1 ))
      3.900     1.900     1.900 peak  4492 spectrum    1 weight  0.10000E+01 volume  0.10578E-02 ppm1      5.584 ppm2      4.258 CV     1
 OR { 4492}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI { 4493}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 110  and name HA2 ))
      4.200     2.200     1.800 peak  4493 spectrum    1 weight  0.10000E+01 volume  0.75372E-03 ppm1      5.587 ppm2      3.873 CV     1
 OR { 4493}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 141  and name HB  ))
 ASSI { 4498}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      4.800     2.900     1.200 peak  4498 spectrum    1 weight  0.10000E+01 volume  0.35715E-03 ppm1      5.398 ppm2      9.458 CV     1
 OR { 4498}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
 ASSI { 4500}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      2.100     0.500     0.500 peak  4500 spectrum    1 weight  0.10000E+01 volume  0.10615E-01 ppm1      5.398 ppm2      8.875 CV     1
 OR { 4500}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 141  and name HN  ))
 ASSI { 4501}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 139  and name HA  ))
      4.300     2.300     1.700 peak  4501 spectrum    1 weight  0.10000E+01 volume  0.64205E-03 ppm1      5.390 ppm2      4.974 CV     1
 OR { 4501}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 116  and name HA  ))
 ASSI { 4504}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 112  and name HB1 ))
      5.000     3.100     1.000 peak  4504 spectrum    1 weight  0.10000E+01 volume  0.50723E-03 ppm1      5.391 ppm2      2.698 CV     1
 OR { 4504}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 4505}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 12   and name HB  ))
      3.500     1.500     1.500 peak  4505 spectrum    1 weight  0.10000E+01 volume  0.77205E-03 ppm1      5.388 ppm2      1.941 CV     1
 OR { 4505}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
 OR { 4505}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 14   and name HB1 ))
 ASSI { 4507}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB2 ))
      3.100     1.200     1.200 peak  4507 spectrum    1 weight  0.10000E+01 volume  0.23569E-02 ppm1      5.399 ppm2      1.294 CV     1
 OR { 4507}
   (( segid "    " and resid 140  and name HA  ))
   (  segid "    " and resid 13   and name HB% )
 ASSI { 4508}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 140  and name HB2 ))
      2.400     0.700     0.700 peak  4508 spectrum    1 weight  0.10000E+01 volume  0.46735E-02 ppm1      5.392 ppm2      0.824 CV     1
 OR { 4508}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 42   and name HD2%)
 ASSI { 4514}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 89   and name HG1%)
      3.200     1.200     1.200 peak  4514 spectrum    1 weight  0.10000E+01 volume  0.40242E-02 ppm1      4.932 ppm2      0.843 CV     1
 OR { 4514}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 89   and name HG2%)
 OR { 4514}
   (( segid "    " and resid 101  and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 4515}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB1 ))
      2.600     0.900     0.900 peak  4515 spectrum    1 weight  0.10000E+01 volume  0.58026E-02 ppm1      4.932 ppm2      2.655 CV     1
 OR { 4515}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HB1 ))
 ASSI { 4519}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB2 ))
      2.300     0.700     0.700 peak  4519 spectrum    1 weight  0.10000E+01 volume  0.77193E-02 ppm1      4.841 ppm2      2.819 CV     1
 OR { 4519}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
 ASSI { 4521}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 53   and name HB1 ))
      2.400     0.700     0.700 peak  4521 spectrum    1 weight  0.10000E+01 volume  0.65605E-02 ppm1      6.619 ppm2      2.257 CV     1
 OR { 4521}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 24   and name HG1 ))
 ASSI { 4522}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 24   and name HB1 ))
      2.500     0.800     0.800 peak  4522 spectrum    1 weight  0.10000E+01 volume  0.41728E-02 ppm1      6.617 ppm2      1.963 CV     1
 OR { 4522}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 4528}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 69   and name HA  ))
      4.100     2.100     1.900 peak  4528 spectrum    1 weight  0.10000E+01 volume  0.79306E-03 ppm1      5.158 ppm2      4.922 CV     1
 OR { 4528}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 4530}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 67   and name HB  ))
      3.400     1.500     1.500 peak  4530 spectrum    1 weight  0.10000E+01 volume  0.10971E-02 ppm1      5.158 ppm2      2.188 CV     1
 OR { 4530}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 101  and name HB2 ))
 ASSI { 4531}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 69   and name HB  ))
      3.800     1.800     1.800 peak  4531 spectrum    1 weight  0.10000E+01 volume  0.12671E-02 ppm1      5.157 ppm2      0.669 CV     1
 OR { 4531}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI { 4532}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 67   and name HG1%)
      4.000     2.000     2.000 peak  4532 spectrum    1 weight  0.10000E+01 volume  0.11349E-02 ppm1      5.157 ppm2      0.497 CV     1
 OR { 4532}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 98   and name HG2%)
 OR { 4532}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 116  and name HD2%)
 ASSI { 4535}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 84   and name HD% )
      4.000     2.000     2.000 peak  4535 spectrum    1 weight  0.10000E+01 volume  0.66484E-03 ppm1      5.147 ppm2      6.924 CV     1
 OR { 4535}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 81   and name HD22))
 ASSI { 4536}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 54   and name HB1 ))
      4.400     2.500     1.600 peak  4536 spectrum    1 weight  0.10000E+01 volume  0.66753E-03 ppm1      5.141 ppm2      3.093 CV     1
 OR { 4536}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 81   and name HB1 ))
 OR { 4536}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
 OR { 4536}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 71   and name HD2 ))
 ASSI { 4537}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 44   and name HB% )
      4.800     2.900     1.200 peak  4537 spectrum    1 weight  0.10000E+01 volume  0.45393E-03 ppm1      5.161 ppm2      1.478 CV     1
 OR { 4537}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 98   and name HB  ))
 OR { 4537}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 96   and name HB  ))
 OR { 4537}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 53   and name HD1 ))
 OR { 4537}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 22   and name HB% )
 OR { 4537}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 53   and name HD2 ))
 ASSI { 4567}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 98   and name HA  ))
      3.600     1.700     1.700 peak  4567 spectrum    1 weight  0.10000E+01 volume  0.20044E-02 ppm1      6.603 ppm2      4.536 CV     1
 OR { 4567}
   (  segid "    " and resid 99   and name HE% )
   (( segid "    " and resid 23   and name HA  ))
 ASSI { 4581}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 63   and name HB2 ))
      3.200     1.200     1.200 peak  4581 spectrum    1 weight  0.10000E+01 volume  0.23443E-02 ppm1      6.338 ppm2      2.645 CV     1
 OR { 4581}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 112  and name HB2 ))
 ASSI { 4588}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 58   and name HN  ))
      3.000     1.100     1.100 peak  4588 spectrum    1 weight  0.10000E+01 volume  0.18699E-02 ppm1      6.330 ppm2      8.489 CV     1
 OR { 4588}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 65   and name HN  ))
 OR { 4588}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 111  and name HN  ))
 ASSI { 4597}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 56   and name HB1 ))
      3.800     1.800     1.800 peak  4597 spectrum    1 weight  0.10000E+01 volume  0.83666E-03 ppm1      6.335 ppm2      1.735 CV     1
 OR { 4597}
   (  segid "    " and resid 112  and name HE% )
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 4602}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 77   and name HH2 ))
      3.700     1.800     1.800 peak  4602 spectrum    1 weight  0.10000E+01 volume  0.11272E-02 ppm1      5.640 ppm2      6.614 CV     1
 OR { 4602}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 120  and name HD% )
 ASSI { 4604}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 85   and name HB1 ))
      2.900     1.100     1.100 peak  4604 spectrum    1 weight  0.10000E+01 volume  0.13004E-02 ppm1      5.640 ppm2      2.757 CV     1
 OR { 4604}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 121  and name HB1 ))
 ASSI { 4607}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 40   and name HG1%)
      3.500     1.500     1.500 peak  4607 spectrum    1 weight  0.10000E+01 volume  0.14790E-02 ppm1      5.639 ppm2      1.232 CV     1
 OR { 4607}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 42   and name HB2 ))
 OR { 4607}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 40   and name HG2%)
 OR { 4607}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 40   and name HG2%)
 ASSI { 4608}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 121  and name HE3 ))
      4.800     2.900     1.200 peak  4608 spectrum    1 weight  0.10000E+01 volume  0.52337E-03 ppm1      5.632 ppm2      6.920 CV     1
 OR { 4608}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 84   and name HD% )
 ASSI { 4610}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 40   and name HA  ))
      4.300     2.300     1.700 peak  4610 spectrum    1 weight  0.10000E+01 volume  0.58438E-03 ppm1      5.621 ppm2      3.979 CV     1
 OR { 4610}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 91   and name HA  ))
 ASSI { 4611}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
      4.400     2.400     1.600 peak  4611 spectrum    1 weight  0.10000E+01 volume  0.39854E-03 ppm1      5.624 ppm2      3.112 CV     1
 OR { 4611}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 92   and name HB1 ))
 OR { 4611}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 129  and name HB1 ))
 ASSI { 4612}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 42   and name HD2%)
      3.900     1.900     1.900 peak  4612 spectrum    1 weight  0.10000E+01 volume  0.97441E-03 ppm1      5.635 ppm2      0.889 CV     1
 OR { 4612}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 42   and name HD1%)
 OR { 4612}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 33   and name HD2%)
 ASSI { 4624}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      3.100     1.200     1.200 peak  4624 spectrum    1 weight  0.10000E+01 volume  0.12895E-02 ppm1      4.543 ppm2      8.128 CV     1
 OR { 4624}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 89   and name HN  ))
 ASSI { 4633}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 124  and name HN  ))
      4.300     2.300     1.700 peak  4633 spectrum    1 weight  0.10000E+01 volume  0.11982E-02 ppm1      4.387 ppm2      8.026 CV     1
 OR { 4633}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI { 4639}
   (( segid "    " and resid 122  and name HA  ))
   (  segid "    " and resid 41   and name HB% )
      4.500     2.600     1.500 peak  4639 spectrum    1 weight  0.10000E+01 volume  0.76689E-03 ppm1      4.389 ppm2      1.424 CV     1
 OR { 4639}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 126  and name HG1 ))
 OR { 4639}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI { 4645}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 126  and name HE1 ))
      5.100     3.200     0.900 peak  4645 spectrum    1 weight  0.10000E+01 volume  0.26231E-03 ppm1      4.366 ppm2      3.096 CV     1
 OR { 4645}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HE1 ))
 OR { 4645}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HE2 ))
 ASSI { 4646}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 126  and name HE2 ))
      4.600     2.600     1.400 peak  4646 spectrum    1 weight  0.10000E+01 volume  0.41501E-03 ppm1      4.369 ppm2      2.934 CV     1
 OR { 4646}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 120  and name HB1 ))
 ASSI { 4647}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 121  and name HB1 ))
      3.800     1.800     1.800 peak  4647 spectrum    1 weight  0.10000E+01 volume  0.78464E-03 ppm1      4.372 ppm2      2.749 CV     1
 OR { 4647}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI { 4648}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 39   and name HB2 ))
      4.400     2.400     1.600 peak  4648 spectrum    1 weight  0.10000E+01 volume  0.53922E-03 ppm1      4.368 ppm2      2.344 CV     1
 OR { 4648}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 128  and name HA2 ))
 ASSI { 4654}
   (( segid "    " and resid 131  and name HD1 ))
   (( segid "    " and resid 131  and name HD2 ))
      1.400     0.200     0.800 peak  4654 spectrum    1 weight  0.10000E+01 volume  0.59252E-01 ppm1      3.845 ppm2      3.624 CV     1
 OR { 4654}
   (( segid "    " and resid 109  and name HD1 ))
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 4655}
   (( segid "    " and resid 109  and name HD1 ))
   (( segid "    " and resid 109  and name HB2 ))
      2.900     1.100     1.100 peak  4655 spectrum    1 weight  0.10000E+01 volume  0.81804E-02 ppm1      3.836 ppm2      1.982 CV     1
 OR { 4655}
   (( segid "    " and resid 131  and name HD1 ))
   (( segid "    " and resid 131  and name HB2 ))
 OR { 4655}
   (( segid "    " and resid 24   and name HD2 ))
   (( segid "    " and resid 24   and name HB1 ))
 ASSI { 4686}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      2.800     1.000     1.000 peak  4686 spectrum    1 weight  0.10000E+01 volume  0.18981E-02 ppm1      5.621 ppm2      8.731 CV     1
 OR { 4686}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI { 4687}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 83   and name HB  ))
      4.000     2.000     2.000 peak  4687 spectrum    1 weight  0.10000E+01 volume  0.71665E-03 ppm1      5.623 ppm2      2.264 CV     1
 OR { 4687}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 4    and name HG2 ))
 OR { 4687}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 4    and name HG1 ))
 ASSI { 4688}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name HN  ))
      2.200     0.600     0.600 peak  4688 spectrum    1 weight  0.10000E+01 volume  0.10942E-01 ppm1      5.617 ppm2      8.986 CV     1
 OR { 4688}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
 ASSI { 4689}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 5    and name HA  ))
      2.400     0.700     0.700 peak  4689 spectrum    1 weight  0.10000E+01 volume  0.61803E-02 ppm1      5.617 ppm2      4.636 CV     1
 OR { 4689}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name HA  ))
 ASSI { 4690}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 40   and name HB  ))
      4.000     2.000     2.000 peak  4690 spectrum    1 weight  0.10000E+01 volume  0.71450E-03 ppm1      5.617 ppm2      1.951 CV     1
 OR { 4690}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 31   and name HB2 ))
 OR { 4690}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
 OR { 4690}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 4699}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 14   and name HB1 ))
      4.000     2.000     2.000 peak  4699 spectrum    1 weight  0.10000E+01 volume  0.86518E-03 ppm1      5.505 ppm2      1.871 CV     1
 OR { 4699}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 12   and name HB  ))
 ASSI { 4704}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 140  and name HG  ))
      4.500     2.600     1.500 peak  4704 spectrum    1 weight  0.10000E+01 volume  0.54946E-03 ppm1      5.516 ppm2      0.367 CV     1
 OR { 4704}
   (( segid "    " and resid 13   and name HA  ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI { 4705}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 142  and name HA  ))
      3.200     1.300     1.300 peak  4705 spectrum    1 weight  0.10000E+01 volume  0.28773E-02 ppm1      5.510 ppm2      5.131 CV     1
 OR { 4705}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 141  and name HA  ))
 ASSI { 4707}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
      3.500     1.500     1.500 peak  4707 spectrum    1 weight  0.10000E+01 volume  0.10759E-02 ppm1      5.287 ppm2      0.798 CV     1
 OR { 4707}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 7    and name HG1%)
 ASSI { 4714}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.700     1.700     1.700 peak  4714 spectrum    1 weight  0.10000E+01 volume  0.78922E-03 ppm1      4.488 ppm2      2.756 CV     1
 OR { 4714}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 86   and name HE1 ))
 OR { 4714}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI { 4719}
   (( segid "    " and resid 24   and name HD1 ))
   (  segid "    " and resid 22   and name HB% )
      3.400     1.400     1.400 peak  4719 spectrum    1 weight  0.10000E+01 volume  0.36728E-02 ppm1      4.029 ppm2      1.500 CV     1
 OR { 4719}
   (( segid "    " and resid 24   and name HD1 ))
   (  segid "    " and resid 23   and name HB% )
 ASSI { 4725}
   (( segid "    " and resid 24   and name HD2 ))
   (( segid "    " and resid 24   and name HG2 ))
      2.500     0.800     0.800 peak  4725 spectrum    1 weight  0.10000E+01 volume  0.50644E-02 ppm1      3.818 ppm2      2.149 CV     1
 OR { 4725}
   (( segid "    " and resid 109  and name HD1 ))
   (( segid "    " and resid 109  and name HG2 ))
 OR { 4725}
   (( segid "    " and resid 24   and name HD2 ))
   (( segid "    " and resid 24   and name HG1 ))
 ASSI { 4741}
   (( segid "    " and resid 24   and name HD1 ))
   (( segid "    " and resid 25   and name HG12))
      5.000     3.100     1.000 peak  4741 spectrum    1 weight  0.10000E+01 volume  0.29321E-03 ppm1      4.020 ppm2      1.016 CV     1
 OR { 4741}
   (( segid "    " and resid 24   and name HD1 ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 4742}
   (( segid "    " and resid 24   and name HD1 ))
   (( segid "    " and resid 25   and name HN  ))
      5.400     3.600     0.600 peak  4742 spectrum    1 weight  0.10000E+01 volume  0.68685E-03 ppm1      3.997 ppm2      8.525 CV     1
 OR { 4742}
   (( segid "    " and resid 24   and name HD1 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 4744}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 77   and name HE1 ))
      4.400     2.500     1.600 peak  4744 spectrum    1 weight  0.10000E+01 volume  0.49208E-03 ppm1      3.899 ppm2      9.192 CV     1
 OR { 4744}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 97   and name HN  ))
 OR { 4744}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 85   and name HN  ))
 OR { 4744}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 4745}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 74   and name HN  ))
      4.900     3.100     1.100 peak  4745 spectrum    1 weight  0.10000E+01 volume  0.44576E-03 ppm1      3.907 ppm2      8.038 CV     1
 OR { 4745}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 73   and name HN  ))
 OR { 4745}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 4746}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 77   and name HD1 ))
      4.200     2.200     1.800 peak  4746 spectrum    1 weight  0.10000E+01 volume  0.86593E-03 ppm1      3.904 ppm2      6.805 CV     1
 OR { 4746}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 92   and name HH2 ))
 OR { 4746}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 74   and name HD22))
 ASSI { 4755}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 70   and name HN  ))
      4.500     2.500     1.500 peak  4755 spectrum    1 weight  0.10000E+01 volume  0.55049E-03 ppm1      3.884 ppm2      8.549 CV     1
 OR { 4755}
   (( segid "    " and resid 109  and name HD1 ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI { 4761}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 74   and name HN  ))
      5.000     3.100     1.000 peak  4761 spectrum    1 weight  0.10000E+01 volume  0.33846E-03 ppm1      3.098 ppm2      8.034 CV     1
 OR { 4761}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 73   and name HN  ))
 OR { 4761}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 4764}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 77   and name HE1 ))
      4.700     2.800     1.300 peak  4764 spectrum    1 weight  0.10000E+01 volume  0.43693E-03 ppm1      3.086 ppm2      9.234 CV     1
 OR { 4764}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 97   and name HN  ))
 OR { 4764}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 85   and name HN  ))
 OR { 4764}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 4766}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 77   and name HD1 ))
      4.600     2.700     1.400 peak  4766 spectrum    1 weight  0.10000E+01 volume  0.56023E-03 ppm1      3.084 ppm2      6.780 CV     1
 OR { 4766}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 92   and name HH2 ))
 OR { 4766}
   (( segid "    " and resid 71   and name HD2 ))
   (  segid "    " and resid 99   and name HD% )
 OR { 4766}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 74   and name HD22))
 ASSI { 4773}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 71   and name HG1 ))
      2.500     0.800     0.800 peak  4773 spectrum    1 weight  0.10000E+01 volume  0.45030E-02 ppm1      3.081 ppm2      1.831 CV     1
 OR { 4773}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 71   and name HG2 ))
 OR { 4773}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 4778}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 123  and name HB2 ))
      4.900     3.000     1.100 peak  4778 spectrum    1 weight  0.10000E+01 volume  0.29163E-03 ppm1      5.700 ppm2      1.765 CV     1
 OR { 4778}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 123  and name HB1 ))
 OR { 4778}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 126  and name HB1 ))
 ASSI { 4780}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 85   and name HN  ))
      4.700     2.700     1.300 peak  4780 spectrum    1 weight  0.10000E+01 volume  0.82138E-03 ppm1      5.686 ppm2      9.201 CV     1
 OR { 4780}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 4786}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 87   and name HA  ))
      3.600     1.600     1.600 peak  4786 spectrum    1 weight  0.10000E+01 volume  0.93883E-03 ppm1      5.680 ppm2      3.948 CV     1
 OR { 4786}
   (  segid "    " and resid 85   and name HE% )
   (( segid "    " and resid 123  and name HA  ))
 ASSI { 4797}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 26   and name HA1 ))
      3.400     1.400     1.400 peak  4797 spectrum    1 weight  0.10000E+01 volume  0.25465E-02 ppm1      3.579 ppm2      4.151 CV     1
 OR { 4797}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 24   and name HA  ))
 ASSI { 4802}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 24   and name HB2 ))
      3.400     1.400     1.400 peak  4802 spectrum    1 weight  0.10000E+01 volume  0.14183E-02 ppm1      3.569 ppm2      1.661 CV     1
 OR { 4802}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 4803}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 25   and name HG11))
      4.900     3.000     1.100 peak  4803 spectrum    1 weight  0.10000E+01 volume  0.27671E-03 ppm1      3.559 ppm2      1.416 CV     1
 OR { 4803}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 98   and name HG11))
 ASSI { 4805}
   (( segid "    " and resid 27   and name HD1 ))
   (  segid "    " and resid 98   and name HD1%)
      3.600     1.600     1.600 peak  4805 spectrum    1 weight  0.10000E+01 volume  0.15318E-02 ppm1      3.572 ppm2      0.481 CV     1
 OR { 4805}
   (( segid "    " and resid 27   and name HD1 ))
   (  segid "    " and resid 10   and name HD1%)
 OR { 4805}
   (( segid "    " and resid 27   and name HD1 ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 4806}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 97   and name HA1 ))
      2.900     1.000     1.000 peak  4806 spectrum    1 weight  0.10000E+01 volume  0.44766E-02 ppm1      3.569 ppm2      4.296 CV     1
 OR { 4806}
   (( segid "    " and resid 27   and name HD1 ))
   (( segid "    " and resid 26   and name HA1 ))
 ASSI { 4807}
   (( segid "    " and resid 27   and name HD2 ))
   (  segid "    " and resid 10   and name HD1%)
      4.100     2.100     1.900 peak  4807 spectrum    1 weight  0.10000E+01 volume  0.78353E-03 ppm1      3.491 ppm2      0.467 CV     1
 OR { 4807}
   (( segid "    " and resid 27   and name HD2 ))
   (  segid "    " and resid 98   and name HD1%)
 OR { 4807}
   (( segid "    " and resid 27   and name HD2 ))
   (  segid "    " and resid 25   and name HD1%)
 OR { 4807}
   (( segid "    " and resid 27   and name HD2 ))
   (  segid "    " and resid 98   and name HG2%)
 ASSI { 4811}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 27   and name HB2 ))
      3.900     1.900     1.900 peak  4811 spectrum    1 weight  0.10000E+01 volume  0.12057E-02 ppm1      3.476 ppm2      1.639 CV     1
 OR { 4811}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 24   and name HB2 ))
 ASSI { 4815}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 25   and name HG11))
      5.200     3.300     0.800 peak  4815 spectrum    1 weight  0.10000E+01 volume  0.29840E-03 ppm1      3.462 ppm2      1.419 CV     1
 OR { 4815}
   (( segid "    " and resid 27   and name HD2 ))
   (( segid "    " and resid 98   and name HG11))
 ASSI { 4828}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 74   and name HN  ))
      3.900     1.900     1.900 peak  4828 spectrum    1 weight  0.10000E+01 volume  0.97264E-03 ppm1      7.644 ppm2      8.073 CV     1
 OR { 4828}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI { 4830}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 74   and name HA  ))
      3.800     1.800     1.800 peak  4830 spectrum    1 weight  0.10000E+01 volume  0.13438E-02 ppm1      7.637 ppm2      4.692 CV     1
 OR { 4830}
   (( segid "    " and resid 92   and name HZ2 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI { 4840}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 127  and name HA  ))
      4.000     2.000     2.000 peak  4840 spectrum    1 weight  0.10000E+01 volume  0.12828E-02 ppm1      7.238 ppm2      4.021 CV     1
 OR { 4840}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 4846}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 124  and name HB1 ))
      5.100     3.200     0.900 peak  4846 spectrum    1 weight  0.10000E+01 volume  0.44869E-03 ppm1      7.222 ppm2      2.667 CV     1
 OR { 4846}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 125  and name HB2 ))
 ASSI { 4849}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 123  and name HB2 ))
      4.300     2.400     1.700 peak  4849 spectrum    1 weight  0.10000E+01 volume  0.51784E-03 ppm1      7.230 ppm2      1.741 CV     1
 OR { 4849}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 123  and name HB1 ))
 OR { 4849}
   (( segid "    " and resid 121  and name HZ2 ))
   (( segid "    " and resid 126  and name HB1 ))
 ASSI { 4856}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 131  and name HB1 ))
      4.500     2.600     1.500 peak  4856 spectrum    1 weight  0.10000E+01 volume  0.82407E-03 ppm1      4.290 ppm2      2.236 CV     1
 OR { 4856}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 5    and name HB  ))
 ASSI { 4858}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 118  and name HA1 ))
      4.000     2.000     2.000 peak  4858 spectrum    1 weight  0.10000E+01 volume  0.10339E-02 ppm1      4.279 ppm2      4.661 CV     1
 OR { 4858}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 129  and name HA  ))
 ASSI { 4859}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 119  and name HA2 ))
      2.000     0.500     0.500 peak  4859 spectrum    1 weight  0.10000E+01 volume  0.57613E-02 ppm1      4.275 ppm2      4.025 CV     1
 OR { 4859}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 131  and name HA  ))
 ASSI { 4868}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 118  and name HA1 ))
      3.600     1.700     1.700 peak  4868 spectrum    1 weight  0.10000E+01 volume  0.11733E-02 ppm1      4.033 ppm2      4.682 CV     1
 OR { 4868}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 4    and name HA  ))
 ASSI { 4874}
   (( segid "    " and resid 119  and name HA2 ))
   (  segid "    " and resid 40   and name HG1%)
      4.000     2.000     2.000 peak  4874 spectrum    1 weight  0.10000E+01 volume  0.51833E-03 ppm1      4.018 ppm2      1.226 CV     1
 OR { 4874}
   (( segid "    " and resid 119  and name HA2 ))
   (  segid "    " and resid 40   and name HG2%)
 OR { 4874}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 43   and name HG1 ))
 ASSI { 4878}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 116  and name HA  ))
      2.900     1.000     1.000 peak  4878 spectrum    1 weight  0.10000E+01 volume  0.18350E-02 ppm1      1.746 ppm2      4.975 CV     1
 OR { 4878}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 115  and name HA  ))
 ASSI { 4880}
   (( segid "    " and resid 116  and name HB1 ))
   (  segid "    " and resid 44   and name HB% )
      4.600     2.600     1.400 peak  4880 spectrum    1 weight  0.10000E+01 volume  0.40260E-03 ppm1      1.742 ppm2      1.523 CV     1
 OR { 4880}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 114  and name HB2 ))
 ASSI { 4893}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 138  and name HA  ))
      4.200     2.200     1.800 peak  4893 spectrum    1 weight  0.10000E+01 volume  0.32964E-03 ppm1      1.513 ppm2      5.293 CV     1
 OR { 4893}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 44   and name HA  ))
 OR { 4893}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 138  and name HA  ))
 OR { 4893}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 44   and name HA  ))
 ASSI { 4894}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 137  and name HA  ))
      4.700     2.800     1.300 peak  4894 spectrum    1 weight  0.10000E+01 volume  0.46991E-03 ppm1      1.516 ppm2      4.941 CV     1
 OR { 4894}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 139  and name HA  ))
 OR { 4894}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 139  and name HA  ))
 OR { 4894}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 112  and name HA  ))
 OR { 4894}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 4897}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 48   and name HB2 ))
      4.200     2.200     1.800 peak  4897 spectrum    1 weight  0.10000E+01 volume  0.46884E-03 ppm1      1.513 ppm2      2.696 CV     1
 OR { 4897}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 48   and name HB2 ))
 OR { 4897}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI { 4898}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 56   and name HB1 ))
      3.300     1.300     1.300 peak  4898 spectrum    1 weight  0.10000E+01 volume  0.42933E-02 ppm1      1.514 ppm2      1.710 CV     1
 OR { 4898}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 140  and name HB1 ))
 OR { 4898}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 56   and name HB1 ))
 OR { 4898}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 4909}
   (( segid "    " and resid 42   and name HB2 ))
   (  segid "    " and resid 41   and name HB% )
      4.200     2.200     1.800 peak  4909 spectrum    1 weight  0.10000E+01 volume  0.87761E-03 ppm1      1.288 ppm2      1.539 CV     1
 OR { 4909}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 96   and name HB  ))
 ASSI { 4913}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HA  ))
      3.200     1.200     1.200 peak  4913 spectrum    1 weight  0.10000E+01 volume  0.20607E-02 ppm1      1.026 ppm2      4.977 CV     1
 OR { 4913}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 115  and name HA  ))
 ASSI { 4918}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 136  and name HN  ))
      4.000     2.000     2.000 peak  4918 spectrum    1 weight  0.10000E+01 volume  0.38419E-03 ppm1      1.016 ppm2      9.413 CV     1
 OR { 4918}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 137  and name HN  ))
 ASSI { 4920}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 43   and name HN  ))
      4.900     3.000     1.100 peak  4920 spectrum    1 weight  0.10000E+01 volume  0.31915E-03 ppm1      1.017 ppm2      8.843 CV     1
 OR { 4920}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 44   and name HN  ))
 OR { 4920}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 114  and name HN  ))
 ASSI { 4928}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 116  and name HA  ))
      4.300     2.300     1.700 peak  4928 spectrum    1 weight  0.10000E+01 volume  0.51305E-03 ppm1      1.804 ppm2      4.983 CV     1
 OR { 4928}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 117  and name HA  ))
 OR { 4928}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 69   and name HA  ))
 OR { 4928}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 4929}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 41   and name HB% )
      5.100     3.300     0.900 peak  4929 spectrum    1 weight  0.10000E+01 volume  0.25072E-03 ppm1      1.810 ppm2      1.481 CV     1
 OR { 4929}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 44   and name HB% )
 OR { 4929}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 96   and name HB  ))
 ASSI { 4930}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 84   and name HD% )
      4.800     2.800     1.200 peak  4930 spectrum    1 weight  0.10000E+01 volume  0.85994E-03 ppm1      1.798 ppm2      6.898 CV     1
 OR { 4930}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI { 4931}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 41   and name HA  ))
      4.900     3.000     1.100 peak  4931 spectrum    1 weight  0.10000E+01 volume  0.64441E-03 ppm1      1.797 ppm2      5.609 CV     1
 OR { 4931}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 4932}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 118  and name HA1 ))
      4.600     2.700     1.400 peak  4932 spectrum    1 weight  0.10000E+01 volume  0.54731E-03 ppm1      1.794 ppm2      4.687 CV     1
 OR { 4932}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 4945}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
      4.200     2.200     1.800 peak  4945 spectrum    1 weight  0.10000E+01 volume  0.39783E-03 ppm1      1.282 ppm2      4.910 CV     1
 OR { 4945}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 116  and name HA  ))
 OR { 4945}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 4956}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 5    and name HB  ))
      3.400     1.500     1.500 peak  4956 spectrum    1 weight  0.10000E+01 volume  0.10023E-02 ppm1      5.214 ppm2      2.275 CV     1
 OR { 4956}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 4    and name HG1 ))
 ASSI { 4963}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 134  and name HN  ))
      2.400     0.700     0.700 peak  4963 spectrum    1 weight  0.10000E+01 volume  0.52341E-02 ppm1      5.210 ppm2      8.364 CV     1
 OR { 4963}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 133  and name HN  ))
 ASSI { 4966}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 4    and name HA  ))
      3.700     1.700     1.700 peak  4966 spectrum    1 weight  0.10000E+01 volume  0.14006E-02 ppm1      5.211 ppm2      4.687 CV     1
 OR { 4966}
   (( segid "    " and resid 133  and name HA1 ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI { 4969}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 3    and name HN  ))
      3.800     1.800     1.800 peak  4969 spectrum    1 weight  0.10000E+01 volume  0.83789E-03 ppm1      4.277 ppm2      8.259 CV     1
 OR { 4969}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 2    and name HN  ))
 OR { 4969}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI { 4971}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 118  and name HA1 ))
      3.900     1.900     1.900 peak  4971 spectrum    1 weight  0.10000E+01 volume  0.16358E-02 ppm1      4.272 ppm2      4.700 CV     1
 OR { 4971}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 33   and name HA  ))
 ASSI { 4973}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 119  and name HN  ))
      2.800     1.000     1.000 peak  4973 spectrum    1 weight  0.10000E+01 volume  0.39609E-02 ppm1      4.278 ppm2      8.805 CV     1
 OR { 4973}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 34   and name HN  ))
 ASSI { 4975}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 3    and name HB2 ))
      4.100     2.100     1.900 peak  4975 spectrum    1 weight  0.10000E+01 volume  0.79463E-03 ppm1      4.272 ppm2      2.310 CV     1
 OR { 4975}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 131  and name HB1 ))
 ASSI { 4977}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 119  and name HA2 ))
      3.900     1.900     1.900 peak  4977 spectrum    1 weight  0.10000E+01 volume  0.10938E-02 ppm1      4.177 ppm2      3.993 CV     1
 OR { 4977}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 131  and name HA  ))
 OR { 4977}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 117  and name HB  ))
 ASSI { 4979}
   (( segid "    " and resid 52   and name HA1 ))
   (( segid "    " and resid 52   and name HN  ))
      2.600     0.900     0.900 peak  4979 spectrum    1 weight  0.10000E+01 volume  0.76573E-02 ppm1      4.057 ppm2      7.520 CV     1
 OR { 4979}
   (( segid "    " and resid 52   and name HA1 ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 4985}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 133  and name HN  ))
      2.400     0.700     0.700 peak  4985 spectrum    1 weight  0.10000E+01 volume  0.88904E-02 ppm1      3.776 ppm2      8.375 CV     1
 OR { 4985}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 134  and name HN  ))
 ASSI { 4988}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 28   and name HN  ))
      3.600     1.600     1.600 peak  4988 spectrum    1 weight  0.10000E+01 volume  0.85895E-03 ppm1      3.785 ppm2      8.954 CV     1
 OR { 4988}
   (( segid "    " and resid 34   and name HA2 ))
   (( segid "    " and resid 4    and name HN  ))
 OR { 4988}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 99   and name HN  ))
 ASSI { 4994}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 134  and name HA  ))
      3.800     1.800     1.800 peak  4994 spectrum    1 weight  0.10000E+01 volume  0.13303E-02 ppm1      3.778 ppm2      4.970 CV     1
 OR { 4994}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 6    and name HA  ))
 OR { 4994}
   (( segid "    " and resid 34   and name HA2 ))
   (( segid "    " and resid 3    and name HA  ))
 ASSI { 4995}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 4    and name HA  ))
      3.100     1.200     1.200 peak  4995 spectrum    1 weight  0.10000E+01 volume  0.46512E-02 ppm1      3.782 ppm2      4.691 CV     1
 OR { 4995}
   (( segid "    " and resid 34   and name HA2 ))
   (( segid "    " and resid 33   and name HA  ))
 ASSI { 4996}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 4    and name HG1 ))
      2.900     1.100     1.100 peak  4996 spectrum    1 weight  0.10000E+01 volume  0.55578E-02 ppm1      3.764 ppm2      2.307 CV     1
 OR { 4996}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 4    and name HG2 ))
 OR { 4996}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 5    and name HB  ))
 OR { 4996}
   (( segid "    " and resid 34   and name HA2 ))
   (( segid "    " and resid 3    and name HB2 ))
 OR { 4996}
   (( segid "    " and resid 52   and name HA2 ))
   (( segid "    " and resid 51   and name HB1 ))
 OR { 4996}
   (( segid "    " and resid 17   and name HA1 ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 4997}
   (( segid "    " and resid 17   and name HA2 ))
   (  segid "    " and resid 15   and name HG2%)
      3.100     1.200     1.200 peak  4997 spectrum    1 weight  0.10000E+01 volume  0.45686E-02 ppm1      3.776 ppm2      1.157 CV     1
 OR { 4997}
   (( segid "    " and resid 52   and name HA2 ))
   (  segid "    " and resid 83   and name HG1%)
 OR { 4997}
   (( segid "    " and resid 17   and name HA1 ))
   (  segid "    " and resid 105  and name HG2%)
 OR { 4997}
   (( segid "    " and resid 17   and name HA2 ))
   (  segid "    " and resid 105  and name HG2%)
 OR { 4997}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 10   and name HG  ))
 OR { 4997}
   (( segid "    " and resid 17   and name HA1 ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 4998}
   (( segid "    " and resid 26   and name HA2 ))
   (  segid "    " and resid 12   and name HG2%)
      3.300     1.400     1.400 peak  4998 spectrum    1 weight  0.10000E+01 volume  0.12679E-02 ppm1      3.779 ppm2      0.889 CV     1
 OR { 4998}
   (( segid "    " and resid 17   and name HA1 ))
   (  segid "    " and resid 100  and name HG1%)
 OR { 4998}
   (( segid "    " and resid 17   and name HA1 ))
   (  segid "    " and resid 100  and name HG2%)
 OR { 4998}
   (( segid "    " and resid 26   and name HA2 ))
   (  segid "    " and resid 10   and name HD2%)
 OR { 4998}
   (( segid "    " and resid 17   and name HA2 ))
   (  segid "    " and resid 100  and name HG1%)
 OR { 4998}
   (( segid "    " and resid 17   and name HA2 ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 4999}
   (( segid "    " and resid 17   and name HA2 ))
   (( segid "    " and resid 16   and name HN  ))
      4.600     2.700     1.400 peak  4999 spectrum    1 weight  0.10000E+01 volume  0.59099E-03 ppm1      3.770 ppm2      8.560 CV     1
 OR { 4999}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 25   and name HN  ))
 OR { 4999}
   (( segid "    " and resid 17   and name HA1 ))
   (( segid "    " and resid 16   and name HN  ))
 OR { 4999}
   (( segid "    " and resid 17   and name HA2 ))
   (( segid "    " and resid 104  and name HN  ))
 ASSI { 5000}
   (( segid "    " and resid 52   and name HA2 ))
   (( segid "    " and resid 52   and name HN  ))
      2.500     0.800     0.800 peak  5000 spectrum    1 weight  0.10000E+01 volume  0.49220E-02 ppm1      3.765 ppm2      7.515 CV     1
 OR { 5000}
   (( segid "    " and resid 52   and name HA2 ))
   (( segid "    " and resid 53   and name HN  ))
 OR { 5000}
   (( segid "    " and resid 17   and name HA2 ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI { 5002}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 4    and name HB1 ))
      3.100     1.200     1.200 peak  5002 spectrum    1 weight  0.10000E+01 volume  0.29948E-02 ppm1      3.768 ppm2      1.953 CV     1
 OR { 5002}
   (( segid "    " and resid 133  and name HA2 ))
   (( segid "    " and resid 4    and name HB2 ))
 OR { 5002}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 12   and name HB  ))
 OR { 5002}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 27   and name HG2 ))
 OR { 5002}
   (( segid "    " and resid 52   and name HA2 ))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 5002}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 27   and name HB1 ))
 ASSI { 5003}
   (( segid "    " and resid 17   and name HA1 ))
   (( segid "    " and resid 16   and name HB2 ))
      2.800     1.000     1.000 peak  5003 spectrum    1 weight  0.10000E+01 volume  0.77271E-02 ppm1      3.760 ppm2      1.714 CV     1
 OR { 5003}
   (( segid "    " and resid 17   and name HA2 ))
   (( segid "    " and resid 16   and name HB2 ))
 OR { 5003}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 27   and name HB2 ))
 OR { 5003}
   (( segid "    " and resid 34   and name HA2 ))
   (( segid "    " and resid 33   and name HB1 ))
 OR { 5003}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 24   and name HB2 ))
 ASSI { 5007}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 24   and name HB2 ))
      4.600     2.600     1.400 peak  5007 spectrum    1 weight  0.10000E+01 volume  0.59413E-03 ppm1      4.237 ppm2      1.642 CV     1
 OR { 5007}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 5011}
   (( segid "    " and resid 26   and name HA1 ))
   (  segid "    " and resid 98   and name HD1%)
      2.600     0.800     0.800 peak  5011 spectrum    1 weight  0.10000E+01 volume  0.39624E-02 ppm1      4.225 ppm2      0.472 CV     1
 OR { 5011}
   (( segid "    " and resid 26   and name HA1 ))
   (  segid "    " and resid 10   and name HD1%)
 ASSI { 5012}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 133  and name HA1 ))
      3.700     1.700     1.700 peak  5012 spectrum    1 weight  0.10000E+01 volume  0.10876E-02 ppm1      4.193 ppm2      5.276 CV     1
 OR { 5012}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 138  and name HA  ))
 OR { 5012}
   (( segid "    " and resid 8    and name HA1 ))
   (( segid "    " and resid 135  and name HA  ))
 OR { 5012}
   (( segid "    " and resid 8    and name HA1 ))
   (( segid "    " and resid 138  and name HA  ))
 ASSI { 5013}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 5    and name HB  ))
      3.700     1.700     1.700 peak  5013 spectrum    1 weight  0.10000E+01 volume  0.21581E-02 ppm1      4.183 ppm2      2.231 CV     1
 OR { 5013}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 27   and name HG1 ))
 ASSI { 5014}
   (( segid "    " and resid 26   and name HA1 ))
   (  segid "    " and resid 12   and name HG2%)
      3.000     1.100     1.100 peak  5014 spectrum    1 weight  0.10000E+01 volume  0.35335E-02 ppm1      4.201 ppm2      0.912 CV     1
 OR { 5014}
   (( segid "    " and resid 8    and name HA1 ))
   (  segid "    " and resid 7    and name HG1%)
 OR { 5014}
   (( segid "    " and resid 118  and name HA2 ))
   (  segid "    " and resid 42   and name HD2%)
 ASSI { 5017}
   (( segid "    " and resid 118  and name HA2 ))
   (  segid "    " and resid 5    and name HG1%)
      3.800     1.800     1.800 peak  5017 spectrum    1 weight  0.10000E+01 volume  0.11397E-02 ppm1      4.179 ppm2      1.402 CV     1
 OR { 5017}
   (( segid "    " and resid 118  and name HA2 ))
   (  segid "    " and resid 117  and name HG2%)
 ASSI { 5018}
   (( segid "    " and resid 118  and name HA2 ))
   (  segid "    " and resid 7    and name HG2%)
      3.500     1.500     1.500 peak  5018 spectrum    1 weight  0.10000E+01 volume  0.22361E-02 ppm1      4.174 ppm2      1.046 CV     1
 OR { 5018}
   (( segid "    " and resid 118  and name HA2 ))
   (  segid "    " and resid 5    and name HG2%)
 ASSI { 5022}
   (( segid "    " and resid 52   and name HA2 ))
   (  segid "    " and resid 49   and name HE% )
      3.000     1.100     1.100 peak  5022 spectrum    1 weight  0.10000E+01 volume  0.24300E-02 ppm1      3.740 ppm2      6.862 CV     1
 OR { 5022}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 26   and name HN  ))
 ASSI { 5025}
   (( segid "    " and resid 26   and name HA2 ))
   (  segid "    " and resid 10   and name HD1%)
      3.400     1.500     1.500 peak  5025 spectrum    1 weight  0.10000E+01 volume  0.28515E-02 ppm1      3.740 ppm2      0.466 CV     1
 OR { 5025}
   (( segid "    " and resid 26   and name HA2 ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI { 5027}
   (( segid "    " and resid 52   and name HA2 ))
   (( segid "    " and resid 82   and name HA2 ))
      3.700     1.700     1.700 peak  5027 spectrum    1 weight  0.10000E+01 volume  0.13746E-02 ppm1      3.741 ppm2      2.202 CV     1
 OR { 5027}
   (( segid "    " and resid 26   and name HA2 ))
   (( segid "    " and resid 27   and name HG1 ))
 OR { 5027}
   (( segid "    " and resid 52   and name HA2 ))
   (( segid "    " and resid 51   and name HB1 ))
 ASSI { 5032}
   (( segid "    " and resid 94   and name HA1 ))
   (( segid "    " and resid 93   and name HA1 ))
      4.500     2.500     1.500 peak  5032 spectrum    1 weight  0.10000E+01 volume  0.58327E-03 ppm1      3.641 ppm2      4.373 CV     1
 OR { 5032}
   (( segid "    " and resid 94   and name HA1 ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI { 5035}
   (( segid "    " and resid 94   and name HA1 ))
   (( segid "    " and resid 92   and name HZ2 ))
      3.700     1.700     1.700 peak  5035 spectrum    1 weight  0.10000E+01 volume  0.10027E-02 ppm1      3.651 ppm2      7.637 CV     1
 OR { 5035}
   (( segid "    " and resid 94   and name HA1 ))
   (( segid "    " and resid 74   and name HD21))
 ASSI { 5038}
   (( segid "    " and resid 94   and name HA1 ))
   (  segid "    " and resid 95   and name HG2%)
      4.300     2.400     1.700 peak  5038 spectrum    1 weight  0.10000E+01 volume  0.57596E-03 ppm1      3.635 ppm2      1.079 CV     1
 OR { 5038}
   (( segid "    " and resid 94   and name HA1 ))
   (  segid "    " and resid 30   and name HG2%)
 ASSI { 5040}
   (( segid "    " and resid 128  and name HA1 ))
   (( segid "    " and resid 126  and name HE2 ))
      4.200     2.200     1.800 peak  5040 spectrum    1 weight  0.10000E+01 volume  0.59945E-03 ppm1      3.337 ppm2      2.945 CV     1
 OR { 5040}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 106  and name HB1 ))
 ASSI { 5043}
   (( segid "    " and resid 128  and name HA1 ))
   (( segid "    " and resid 128  and name HN  ))
      2.400     0.700     0.700 peak  5043 spectrum    1 weight  0.10000E+01 volume  0.30603E-02 ppm1      3.325 ppm2      7.362 CV     1
 OR { 5043}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 16   and name HE  ))
 ASSI { 5048}
   (( segid "    " and resid 94   and name HA2 ))
   (( segid "    " and resid 92   and name HZ2 ))
      4.700     2.800     1.300 peak  5048 spectrum    1 weight  0.10000E+01 volume  0.52729E-03 ppm1      3.232 ppm2      7.617 CV     1
 OR { 5048}
   (( segid "    " and resid 94   and name HA2 ))
   (( segid "    " and resid 74   and name HD21))
 ASSI { 5060}
   (( segid "    " and resid 128  and name HA2 ))
   (( segid "    " and resid 121  and name HE3 ))
      4.500     2.600     1.500 peak  5060 spectrum    1 weight  0.10000E+01 volume  0.41917E-03 ppm1      2.376 ppm2      6.898 CV     1
 OR { 5060}
   (( segid "    " and resid 128  and name HA2 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI { 5069}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 141  and name HN  ))
      4.500     2.600     1.500 peak  5069 spectrum    1 weight  0.10000E+01 volume  0.74526E-03 ppm1      1.698 ppm2      8.904 CV     1
 OR { 5069}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 114  and name HN  ))
 ASSI { 5071}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 139  and name HA  ))
      3.900     1.900     1.900 peak  5071 spectrum    1 weight  0.10000E+01 volume  0.14181E-02 ppm1      1.706 ppm2      4.917 CV     1
 OR { 5071}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 112  and name HA  ))
 ASSI { 5074}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 114  and name HG  ))
      3.400     1.400     1.400 peak  5074 spectrum    1 weight  0.10000E+01 volume  0.22520E-02 ppm1      1.705 ppm2      1.289 CV     1
 OR { 5074}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 139  and name HG1 ))
 OR { 5074}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 139  and name HG2 ))
 ASSI { 5075}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 140  and name HB2 ))
      1.900     0.400     0.400 peak  5075 spectrum    1 weight  0.10000E+01 volume  0.66298E-02 ppm1      1.705 ppm2      0.763 CV     1
 OR { 5075}
   (( segid "    " and resid 140  and name HB1 ))
   (  segid "    " and resid 114  and name HD2%)
 ASSI { 5085}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 114  and name HG  ))
      3.600     1.600     1.600 peak  5085 spectrum    1 weight  0.10000E+01 volume  0.19165E-02 ppm1      0.783 ppm2      1.290 CV     1
 OR { 5085}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 139  and name HG2 ))
 OR { 5085}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 139  and name HG1 ))
 ASSI { 5090}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 31   and name HN  ))
      4.400     2.500     1.600 peak  5090 spectrum    1 weight  0.10000E+01 volume  0.12673E-02 ppm1      4.342 ppm2      8.955 CV     1
 OR { 5090}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 28   and name HN  ))
 ASSI { 5092}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 98   and name HB  ))
      4.200     2.200     1.800 peak  5092 spectrum    1 weight  0.10000E+01 volume  0.11047E-02 ppm1      4.334 ppm2      1.513 CV     1
 OR { 5092}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 96   and name HB  ))
 ASSI { 5097}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 24   and name HB1 ))
      3.900     1.900     1.900 peak  5097 spectrum    1 weight  0.10000E+01 volume  0.37570E-03 ppm1      4.328 ppm2      1.922 CV     1
 OR { 5097}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 27   and name HB1 ))
 OR { 5097}
   (( segid "    " and resid 110  and name HA1 ))
   (( segid "    " and resid 109  and name HB2 ))
 ASSI { 5099}
   (( segid "    " and resid 97   and name HA1 ))
   (  segid "    " and resid 98   and name HD1%)
      4.300     2.300     1.700 peak  5099 spectrum    1 weight  0.10000E+01 volume  0.77577E-03 ppm1      4.328 ppm2      0.459 CV     1
 OR { 5099}
   (( segid "    " and resid 97   and name HA1 ))
   (  segid "    " and resid 25   and name HD1%)
 OR { 5099}
   (( segid "    " and resid 97   and name HA1 ))
   (  segid "    " and resid 10   and name HD1%)
 ASSI { 5104}
   (( segid "    " and resid 110  and name HA1 ))
   (( segid "    " and resid 111  and name HB1 ))
      4.600     2.600     1.400 peak  5104 spectrum    1 weight  0.10000E+01 volume  0.44485E-03 ppm1      4.282 ppm2      2.759 CV     1
 OR { 5104}
   (( segid "    " and resid 34   and name HA1 ))
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 5106}
   (( segid "    " and resid 8    and name HA1 ))
   (( segid "    " and resid 8    and name HN  ))
      2.500     0.800     0.800 peak  5106 spectrum    1 weight  0.10000E+01 volume  0.39351E-02 ppm1      4.187 ppm2      8.785 CV     1
 OR { 5106}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 119  and name HN  ))
 ASSI { 5107}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 134  and name HN  ))
      4.400     2.400     1.600 peak  5107 spectrum    1 weight  0.10000E+01 volume  0.78448E-03 ppm1      4.190 ppm2      8.336 CV     1
 OR { 5107}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 133  and name HN  ))
 ASSI { 5109}
   (( segid "    " and resid 118  and name HA2 ))
   (  segid "    " and resid 40   and name HG1%)
      3.900     1.900     1.900 peak  5109 spectrum    1 weight  0.10000E+01 volume  0.57369E-03 ppm1      4.189 ppm2      1.233 CV     1
 OR { 5109}
   (( segid "    " and resid 118  and name HA2 ))
   (  segid "    " and resid 134  and name HG2%)
 OR { 5109}
   (( segid "    " and resid 8    and name HA1 ))
   (  segid "    " and resid 29   and name HG2%)
 OR { 5109}
   (( segid "    " and resid 118  and name HA2 ))
   (  segid "    " and resid 40   and name HG2%)
 OR { 5109}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 114  and name HG  ))
 OR { 5109}
   (( segid "    " and resid 118  and name HA2 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 5109}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 96   and name HG11))
 ASSI { 5115}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 142  and name HN  ))
      4.000     2.000     2.000 peak  5115 spectrum    1 weight  0.10000E+01 volume  0.62145E-03 ppm1      3.885 ppm2      9.414 CV     1
 OR { 5115}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 137  and name HN  ))
 OR { 5115}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 136  and name HN  ))
 ASSI { 5116}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 110  and name HN  ))
      2.600     0.900     0.900 peak  5116 spectrum    1 weight  0.10000E+01 volume  0.50999E-02 ppm1      3.880 ppm2      8.727 CV     1
 OR { 5116}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 8    and name HN  ))
 ASSI { 5119}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 8    and name HA1 ))
      1.700     0.400     0.500 peak  5119 spectrum    1 weight  0.10000E+01 volume  0.21911E-01 ppm1      3.880 ppm2      4.268 CV     1
 OR { 5119}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 110  and name HA1 ))
 ASSI { 5120}
   (( segid "    " and resid 8    and name HA2 ))
   (  segid "    " and resid 28   and name HG1%)
      4.000     2.000     2.000 peak  5120 spectrum    1 weight  0.10000E+01 volume  0.10976E-02 ppm1      3.881 ppm2      0.680 CV     1
 OR { 5120}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 5121}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 141  and name HG2%)
      3.700     1.800     1.800 peak  5121 spectrum    1 weight  0.10000E+01 volume  0.10828E-02 ppm1      3.875 ppm2      1.160 CV     1
 OR { 5121}
   (( segid "    " and resid 90   and name HA2 ))
   (  segid "    " and resid 40   and name HG2%)
 OR { 5121}
   (( segid "    " and resid 8    and name HA2 ))
   (  segid "    " and resid 135  and name HG2%)
 OR { 5121}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 5125}
   (( segid "    " and resid 90   and name HA2 ))
   (( segid "    " and resid 91   and name HN  ))
      2.300     0.700     0.700 peak  5125 spectrum    1 weight  0.10000E+01 volume  0.82576E-02 ppm1      3.856 ppm2      8.210 CV     1
 OR { 5125}
   (( segid "    " and resid 90   and name HA2 ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI { 5133}
   (( segid "    " and resid 97   and name HA2 ))
   (( segid "    " and resid 24   and name HB2 ))
      4.600     2.700     1.400 peak  5133 spectrum    1 weight  0.10000E+01 volume  0.58063E-03 ppm1      3.353 ppm2      1.631 CV     1
 OR { 5133}
   (( segid "    " and resid 97   and name HA2 ))
   (( segid "    " and resid 27   and name HB2 ))
 OR { 5133}
   (( segid "    " and resid 128  and name HA1 ))
   (( segid "    " and resid 126  and name HD2 ))
 ASSI { 5134}
   (( segid "    " and resid 97   and name HA2 ))
   (( segid "    " and resid 98   and name HB  ))
      4.000     2.000     2.000 peak  5134 spectrum    1 weight  0.10000E+01 volume  0.83562E-03 ppm1      3.358 ppm2      1.515 CV     1
 OR { 5134}
   (( segid "    " and resid 97   and name HA2 ))
   (( segid "    " and resid 96   and name HB  ))
 ASSI { 5142}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 106  and name HA  ))
      3.900     1.900     1.900 peak  5142 spectrum    1 weight  0.10000E+01 volume  0.69345E-03 ppm1      3.285 ppm2      4.841 CV     1
 OR { 5142}
   (( segid "    " and resid 128  and name HA1 ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 5144}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 16   and name HA  ))
      3.500     1.500     1.500 peak  5144 spectrum    1 weight  0.10000E+01 volume  0.32345E-02 ppm1      3.304 ppm2      3.667 CV     1
 OR { 5144}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 5152}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 80   and name HB1 ))
      4.200     2.200     1.800 peak  5152 spectrum    1 weight  0.10000E+01 volume  0.71649E-03 ppm1      3.152 ppm2      2.629 CV     1
 OR { 5152}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 112  and name HB2 ))
 ASSI { 5154}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name HE  ))
      2.800     1.000     1.000 peak  5154 spectrum    1 weight  0.10000E+01 volume  0.24294E-02 ppm1      3.142 ppm2      7.249 CV     1
 OR { 5154}
   (( segid "    " and resid 82   and name HA1 ))
   (  segid "    " and resid 54   and name HE% )
 OR { 5154}
   (( segid "    " and resid 82   and name HA1 ))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 5155}
   (( segid "    " and resid 82   and name HA1 ))
   (  segid "    " and resid 83   and name HG2%)
      4.300     2.300     1.700 peak  5155 spectrum    1 weight  0.10000E+01 volume  0.68255E-03 ppm1      3.136 ppm2      0.832 CV     1
 OR { 5155}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 107  and name HG2%)
 OR { 5155}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 100  and name HG2%)
 OR { 5155}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 19   and name HG  ))
 OR { 5155}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI { 5157}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 83   and name HA  ))
      4.000     2.000     2.000 peak  5157 spectrum    1 weight  0.10000E+01 volume  0.71698E-03 ppm1      3.120 ppm2      4.626 CV     1
 OR { 5157}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI { 5158}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name HA  ))
      3.400     1.400     1.400 peak  5158 spectrum    1 weight  0.10000E+01 volume  0.27444E-02 ppm1      3.122 ppm2      3.667 CV     1
 OR { 5158}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 5161}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 15   and name HG2%)
      4.600     2.600     1.400 peak  5161 spectrum    1 weight  0.10000E+01 volume  0.58306E-03 ppm1      3.119 ppm2      1.228 CV     1
 OR { 5161}
   (( segid "    " and resid 82   and name HA1 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 5161}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 65   and name HG  ))
 ASSI { 5164}
   (( segid "    " and resid 128  and name HA2 ))
   (( segid "    " and resid 127  and name HN  ))
      4.800     2.900     1.200 peak  5164 spectrum    1 weight  0.10000E+01 volume  0.32163E-03 ppm1      2.378 ppm2      7.976 CV     1
 OR { 5164}
   (( segid "    " and resid 128  and name HA2 ))
   (( segid "    " and resid 130  and name HN  ))
 ASSI { 5178}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 43   and name HG1 ))
      4.100     2.100     1.900 peak  5178 spectrum    1 weight  0.10000E+01 volume  0.42314E-03 ppm1      2.157 ppm2      1.245 CV     1
 OR { 5178}
   (( segid "    " and resid 82   and name HA2 ))
   (( segid "    " and resid 42   and name HB2 ))
 ASSI { 5185}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 93   and name HN  ))
      2.900     1.100     1.100 peak  5185 spectrum    1 weight  0.10000E+01 volume  0.19345E-02 ppm1      4.367 ppm2      6.830 CV     1
 OR { 5185}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 26   and name HN  ))
 ASSI { 5187}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 97   and name HA2 ))
      1.700     0.400     0.500 peak  5187 spectrum    1 weight  0.10000E+01 volume  0.11654E-01 ppm1      4.365 ppm2      3.425 CV     1
 OR { 5187}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 93   and name HA2 ))
 ASSI { 5189}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 24   and name HB1 ))
      3.700     1.700     1.700 peak  5189 spectrum    1 weight  0.10000E+01 volume  0.39063E-03 ppm1      4.368 ppm2      1.932 CV     1
 OR { 5189}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 27   and name HB1 ))
 OR { 5189}
   (( segid "    " and resid 93   and name HA1 ))
   (( segid "    " and resid 31   and name HB2 ))
 ASSI { 5193}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 24   and name HB2 ))
      3.300     1.400     1.400 peak  5193 spectrum    1 weight  0.10000E+01 volume  0.68660E-03 ppm1      4.322 ppm2      1.663 CV     1
 OR { 5193}
   (( segid "    " and resid 97   and name HA1 ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 5201}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 98   and name HG12))
      4.300     2.300     1.700 peak  5201 spectrum    1 weight  0.10000E+01 volume  0.57786E-03 ppm1      4.196 ppm2      0.661 CV     1
 OR { 5201}
   (( segid "    " and resid 26   and name HA1 ))
   (  segid "    " and resid 28   and name HG2%)
 OR { 5201}
   (( segid "    " and resid 8    and name HA1 ))
   (  segid "    " and resid 28   and name HG1%)
 ASSI { 5205}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 9    and name HB2 ))
      4.300     2.400     1.700 peak  5205 spectrum    1 weight  0.10000E+01 volume  0.65250E-03 ppm1      3.890 ppm2      2.542 CV     1
 OR { 5205}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 111  and name HB2 ))
 ASSI { 5206}
   (( segid "    " and resid 8    and name HA2 ))
   (  segid "    " and resid 7    and name HG2%)
      4.200     2.200     1.800 peak  5206 spectrum    1 weight  0.10000E+01 volume  0.72813E-03 ppm1      3.886 ppm2      1.011 CV     1
 OR { 5206}
   (( segid "    " and resid 8    and name HA2 ))
   (  segid "    " and resid 10   and name HD2%)
 ASSI { 5210}
   (( segid "    " and resid 136  and name HA2 ))
   (( segid "    " and resid 137  and name HN  ))
      2.300     0.700     0.700 peak  5210 spectrum    1 weight  0.10000E+01 volume  0.57316E-02 ppm1      3.451 ppm2      9.394 CV     1
 OR { 5210}
   (( segid "    " and resid 136  and name HA2 ))
   (( segid "    " and resid 136  and name HN  ))
 ASSI { 5217}
   (( segid "    " and resid 136  and name HA2 ))
   (( segid "    " and resid 9    and name HA  ))
      3.900     1.900     1.900 peak  5217 spectrum    1 weight  0.10000E+01 volume  0.90155E-03 ppm1      3.442 ppm2      4.972 CV     1
 OR { 5217}
   (( segid "    " and resid 136  and name HA2 ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 5223}
   (( segid "    " and resid 93   and name HA2 ))
   (  segid "    " and resid 30   and name HG2%)
      3.200     1.300     1.300 peak  5223 spectrum    1 weight  0.10000E+01 volume  0.38123E-02 ppm1      3.448 ppm2      1.013 CV     1
 OR { 5223}
   (( segid "    " and resid 136  and name HA2 ))
   (  segid "    " and resid 137  and name HG2%)
 OR { 5223}
   (( segid "    " and resid 136  and name HA2 ))
   (  segid "    " and resid 10   and name HD2%)
 ASSI { 5225}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 37   and name HA  ))
      4.500     2.500     1.500 peak  5225 spectrum    1 weight  0.10000E+01 volume  0.40507E-03 ppm1      3.292 ppm2      4.510 CV     1
 OR { 5225}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 92   and name HA  ))
 OR { 5225}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI { 5231}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 11   and name HN  ))
      4.400     2.400     1.600 peak  5231 spectrum    1 weight  0.10000E+01 volume  0.76260E-03 ppm1      1.816 ppm2      8.683 CV     1
 OR { 5231}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 113  and name HN  ))
 ASSI { 5233}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 56   and name HA  ))
      2.700     0.900     0.900 peak  5233 spectrum    1 weight  0.10000E+01 volume  0.18556E-02 ppm1      1.819 ppm2      4.586 CV     1
 OR { 5233}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HA  ))
 ASSI { 5234}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 56   and name HB2 ))
      1.800     0.400     0.400 peak  5234 spectrum    1 weight  0.10000E+01 volume  0.84033E-02 ppm1      1.819 ppm2      1.453 CV     1
 OR { 5234}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HB2 ))
 ASSI { 5237}
   (( segid "    " and resid 10   and name HB1 ))
   (  segid "    " and resid 138  and name HG2%)
      3.400     1.500     1.500 peak  5237 spectrum    1 weight  0.10000E+01 volume  0.22770E-02 ppm1      1.821 ppm2      0.748 CV     1
 OR { 5237}
   (( segid "    " and resid 10   and name HB1 ))
   (  segid "    " and resid 28   and name HG1%)
 ASSI { 5239}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 138  and name HA  ))
      3.500     1.600     1.600 peak  5239 spectrum    1 weight  0.10000E+01 volume  0.20705E-02 ppm1      1.819 ppm2      5.278 CV     1
 OR { 5239}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 11   and name HA  ))
 OR { 5239}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI { 5242}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      3.200     1.300     1.300 peak  5242 spectrum    1 weight  0.10000E+01 volume  0.10956E-02 ppm1      1.515 ppm2      8.916 CV     1
 OR { 5242}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 56   and name HN  ))
 OR { 5242}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 57   and name HN  ))
 ASSI { 5250}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 11   and name HN  ))
      3.900     1.900     1.900 peak  5250 spectrum    1 weight  0.10000E+01 volume  0.99167E-03 ppm1      1.459 ppm2      8.695 CV     1
 OR { 5250}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 113  and name HN  ))
 ASSI { 5252}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 138  and name HA  ))
      3.600     1.600     1.600 peak  5252 spectrum    1 weight  0.10000E+01 volume  0.13438E-02 ppm1      1.459 ppm2      5.266 CV     1
 OR { 5252}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 11   and name HA  ))
 OR { 5252}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI { 5258}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 16   and name HG2 ))
      3.800     1.800     1.800 peak  5258 spectrum    1 weight  0.10000E+01 volume  0.64998E-03 ppm1      0.692 ppm2      1.777 CV     1
 OR { 5258}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 56   and name HB1 ))
 OR { 5258}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 16   and name HG1 ))
 ASSI { 5264}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 55   and name HB1 ))
      4.800     2.900     1.200 peak  5264 spectrum    1 weight  0.10000E+01 volume  0.31443E-03 ppm1      0.687 ppm2      2.687 CV     1
 OR { 5264}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 101  and name HB1 ))
 ASSI { 5266}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 100  and name HG2%)
      3.800     1.800     1.800 peak  5266 spectrum    1 weight  0.10000E+01 volume  0.13997E-02 ppm1      0.675 ppm2      0.892 CV     1
 OR { 5266}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 107  and name HG2%)
 ASSI { 5284}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 138  and name HA  ))
      4.600     2.700     1.400 peak  5284 spectrum    1 weight  0.10000E+01 volume  0.49736E-03 ppm1      2.507 ppm2      5.269 CV     1
 OR { 5284}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI { 5285}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 57   and name HN  ))
      3.300     1.400     1.400 peak  5285 spectrum    1 weight  0.10000E+01 volume  0.18002E-02 ppm1      1.788 ppm2      8.946 CV     1
 OR { 5285}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 56   and name HN  ))
 ASSI { 5286}
   (( segid "    " and resid 56   and name HB1 ))
   (  segid "    " and resid 140  and name HD2%)
      2.700     0.900     0.900 peak  5286 spectrum    1 weight  0.10000E+01 volume  0.32070E-02 ppm1      1.784 ppm2      0.613 CV     1
 OR { 5286}
   (( segid "    " and resid 56   and name HB1 ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 5286}
   (( segid "    " and resid 56   and name HB1 ))
   (  segid "    " and resid 67   and name HG2%)
 OR { 5286}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 65   and name HB2 ))
 ASSI { 5288}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 112  and name HA  ))
      4.300     2.300     1.700 peak  5288 spectrum    1 weight  0.10000E+01 volume  0.79104E-03 ppm1      1.779 ppm2      4.920 CV     1
 OR { 5288}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 5309}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HA  ))
      2.800     1.000     1.000 peak  5309 spectrum    1 weight  0.10000E+01 volume  0.31133E-02 ppm1      1.484 ppm2      4.585 CV     1
 OR { 5309}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HA  ))
 ASSI { 5311}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 9    and name HA  ))
      5.000     3.100     1.000 peak  5311 spectrum    1 weight  0.10000E+01 volume  0.41286E-03 ppm1      1.472 ppm2      5.002 CV     1
 OR { 5311}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 112  and name HA  ))
 ASSI { 5312}
   (( segid "    " and resid 56   and name HB2 ))
   (  segid "    " and resid 140  and name HD2%)
      2.900     1.000     1.000 peak  5312 spectrum    1 weight  0.10000E+01 volume  0.44601E-02 ppm1      1.476 ppm2      0.651 CV     1
 OR { 5312}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 65   and name HB2 ))
 OR { 5312}
   (( segid "    " and resid 10   and name HB2 ))
   (  segid "    " and resid 28   and name HG2%)
 OR { 5312}
   (( segid "    " and resid 56   and name HB2 ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI { 5314}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 102  and name HN  ))
      2.900     1.000     1.000 peak  5314 spectrum    1 weight  0.10000E+01 volume  0.55392E-02 ppm1      4.252 ppm2      8.546 CV     1
 OR { 5314}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 5318}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 21   and name HB2 ))
      4.100     2.100     1.900 peak  5318 spectrum    1 weight  0.10000E+01 volume  0.10139E-02 ppm1      4.240 ppm2      2.511 CV     1
 OR { 5318}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 100  and name HB  ))
 ASSI { 5323}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 47   and name HB1 ))
      3.500     1.500     1.500 peak  5323 spectrum    1 weight  0.10000E+01 volume  0.12188E-02 ppm1      3.589 ppm2      2.932 CV     1
 OR { 5323}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 45   and name HB2 ))
 OR { 5323}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI { 5324}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 114  and name HB1 ))
      3.100     1.200     1.200 peak  5324 spectrum    1 weight  0.10000E+01 volume  0.24954E-02 ppm1      3.584 ppm2      1.510 CV     1
 OR { 5324}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 114  and name HB2 ))
 OR { 5324}
   (( segid "    " and resid 48   and name HB1 ))
   (  segid "    " and resid 44   and name HB% )
 ASSI { 5326}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 54   and name HA  ))
      4.400     2.400     1.600 peak  5326 spectrum    1 weight  0.10000E+01 volume  0.94432E-03 ppm1      3.578 ppm2      5.298 CV     1
 OR { 5326}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI { 5330}
   (( segid "    " and resid 102  and name HA2 ))
   (( segid "    " and resid 102  and name HN  ))
      2.400     0.700     0.700 peak  5330 spectrum    1 weight  0.10000E+01 volume  0.59128E-02 ppm1      3.463 ppm2      8.544 CV     1
 OR { 5330}
   (( segid "    " and resid 102  and name HA2 ))
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 5333}
   (( segid "    " and resid 102  and name HA2 ))
   (( segid "    " and resid 21   and name HB2 ))
      3.200     1.300     1.300 peak  5333 spectrum    1 weight  0.10000E+01 volume  0.15826E-02 ppm1      3.467 ppm2      2.512 CV     1
 OR { 5333}
   (( segid "    " and resid 102  and name HA2 ))
   (( segid "    " and resid 100  and name HB  ))
 ASSI { 5334}
   (( segid "    " and resid 93   and name HA2 ))
   (( segid "    " and resid 30   and name HB  ))
      3.400     1.500     1.500 peak  5334 spectrum    1 weight  0.10000E+01 volume  0.16167E-02 ppm1      3.462 ppm2      2.165 CV     1
 OR { 5334}
   (( segid "    " and resid 102  and name HA2 ))
   (( segid "    " and resid 103  and name HB1 ))
 ASSI { 5367}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 114  and name HA  ))
      4.200     2.200     1.800 peak  5367 spectrum    1 weight  0.10000E+01 volume  0.60048E-03 ppm1      2.814 ppm2      4.684 CV     1
 OR { 5367}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
 OR { 5367}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 80   and name HA  ))
 OR { 5367}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 65   and name HA  ))
 ASSI { 5369}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 81   and name HN  ))
      3.900     1.900     1.900 peak  5369 spectrum    1 weight  0.10000E+01 volume  0.95006E-03 ppm1      2.700 ppm2      9.244 CV     1
 OR { 5369}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 77   and name HE1 ))
 ASSI { 5370}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 121  and name HZ3 ))
      4.600     2.700     1.400 peak  5370 spectrum    1 weight  0.10000E+01 volume  0.74695E-03 ppm1      2.706 ppm2      7.088 CV     1
 OR { 5370}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 49   and name HZ  ))
 ASSI { 5374}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 114  and name HN  ))
      4.400     2.400     1.600 peak  5374 spectrum    1 weight  0.10000E+01 volume  0.34299E-03 ppm1      2.664 ppm2      8.799 CV     1
 OR { 5374}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
 OR { 5374}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 32   and name HN  ))
 OR { 5374}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI { 5375}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 55   and name HN  ))
      2.600     0.800     0.800 peak  5375 spectrum    1 weight  0.10000E+01 volume  0.34457E-02 ppm1      2.670 ppm2      8.150 CV     1
 OR { 5375}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 89   and name HN  ))
 ASSI { 5376}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 88   and name HN  ))
      3.500     1.500     1.500 peak  5376 spectrum    1 weight  0.10000E+01 volume  0.23430E-02 ppm1      2.664 ppm2      7.325 CV     1
 OR { 5376}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 5378}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
      3.000     1.100     1.100 peak  5378 spectrum    1 weight  0.10000E+01 volume  0.17697E-02 ppm1      2.673 ppm2      3.986 CV     1
 OR { 5378}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 89   and name HA  ))
 OR { 5378}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI { 5379}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 88   and name HB2 ))
      1.600     0.300     0.600 peak  5379 spectrum    1 weight  0.10000E+01 volume  0.27468E-01 ppm1      2.674 ppm2      2.231 CV     1
 OR { 5379}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 86   and name HE2 ))
 ASSI { 5380}
   (( segid "    " and resid 80   and name HB1 ))
   (  segid "    " and resid 83   and name HG2%)
      2.800     1.000     1.000 peak  5380 spectrum    1 weight  0.10000E+01 volume  0.36668E-02 ppm1      2.671 ppm2      0.831 CV     1
 OR { 5380}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 89   and name HG2%)
 OR { 5380}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 89   and name HG1%)
 ASSI { 5381}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 115  and name HN  ))
      4.200     2.200     1.800 peak  5381 spectrum    1 weight  0.10000E+01 volume  0.93321E-03 ppm1      2.660 ppm2      7.984 CV     1
 OR { 5381}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
 ASSI { 5383}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 114  and name HB1 ))
      3.200     1.300     1.300 peak  5383 spectrum    1 weight  0.10000E+01 volume  0.28706E-02 ppm1      2.653 ppm2      1.549 CV     1
 OR { 5383}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 38   and name HB1 ))
 OR { 5383}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 114  and name HB2 ))
 OR { 5383}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 5384}
   (( segid "    " and resid 48   and name HB2 ))
   (  segid "    " and resid 116  and name HD2%)
      4.100     2.100     1.900 peak  5384 spectrum    1 weight  0.10000E+01 volume  0.64111E-03 ppm1      2.658 ppm2      0.539 CV     1
 OR { 5384}
   (( segid "    " and resid 48   and name HB2 ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 5384}
   (( segid "    " and resid 48   and name HB2 ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI { 5391}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 121  and name HZ3 ))
      5.200     3.400     0.800 peak  5391 spectrum    1 weight  0.10000E+01 volume  0.39377E-03 ppm1      2.354 ppm2      7.084 CV     1
 OR { 5391}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 121  and name HZ3 ))
 ASSI { 5392}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 121  and name HE3 ))
      5.300     3.500     0.700 peak  5392 spectrum    1 weight  0.10000E+01 volume  0.33536E-03 ppm1      2.342 ppm2      6.899 CV     1
 OR { 5392}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 43   and name HZ% )
 OR { 5392}
   (( segid "    " and resid 80   and name HB2 ))
   (  segid "    " and resid 84   and name HD% )
 OR { 5392}
   (( segid "    " and resid 80   and name HB2 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI { 5396}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HB1 ))
      1.700     0.400     0.500 peak  5396 spectrum    1 weight  0.10000E+01 volume  0.13622E-01 ppm1      2.349 ppm2      2.692 CV     1
 OR { 5396}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HB1 ))
 ASSI { 5407}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 58   and name HN  ))
      3.800     1.800     1.800 peak  5407 spectrum    1 weight  0.10000E+01 volume  0.16427E-02 ppm1      2.039 ppm2      8.486 CV     1
 OR { 5407}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 62   and name HN  ))
 ASSI { 5412}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 114  and name HA  ))
      4.200     2.300     1.800 peak  5412 spectrum    1 weight  0.10000E+01 volume  0.49129E-03 ppm1      2.039 ppm2      4.679 CV     1
 OR { 5412}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 47   and name HA  ))
 OR { 5412}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI { 5423}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 137  and name HB  ))
      3.000     1.100     1.100 peak  5423 spectrum    1 weight  0.10000E+01 volume  0.25946E-02 ppm1      2.997 ppm2      3.854 CV     1
 OR { 5423}
   (( segid "    " and resid 126  and name HE2 ))
   (( segid "    " and resid 123  and name HA  ))
 OR { 5423}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 8    and name HA2 ))
 ASSI { 5426}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 85   and name HN  ))
      3.500     1.500     1.500 peak  5426 spectrum    1 weight  0.10000E+01 volume  0.10180E-02 ppm1      2.759 ppm2      9.130 CV     1
 OR { 5426}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI { 5430}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
      2.600     0.800     0.800 peak  5430 spectrum    1 weight  0.10000E+01 volume  0.30258E-02 ppm1      2.756 ppm2      5.680 CV     1
 OR { 5430}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 41   and name HA  ))
 ASSI { 5431}
   (( segid "    " and resid 14   and name HE2 ))
   (( segid "    " and resid 14   and name HA  ))
      3.200     1.200     1.200 peak  5431 spectrum    1 weight  0.10000E+01 volume  0.37751E-02 ppm1      2.754 ppm2      4.845 CV     1
 OR { 5431}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 5433}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 39   and name HN  ))
      4.200     2.200     1.800 peak  5433 spectrum    1 weight  0.10000E+01 volume  0.96859E-03 ppm1      2.752 ppm2      8.221 CV     1
 OR { 5433}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 90   and name HN  ))
 OR { 5433}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 123  and name HN  ))
 ASSI { 5434}
   (( segid "    " and resid 14   and name HE2 ))
   (( segid "    " and resid 25   and name HA  ))
      3.400     1.500     1.500 peak  5434 spectrum    1 weight  0.10000E+01 volume  0.16299E-02 ppm1      2.720 ppm2      3.921 CV     1
 OR { 5434}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 90   and name HA2 ))
 OR { 5434}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 71   and name HD1 ))
 OR { 5434}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 90   and name HA2 ))
 OR { 5434}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 51   and name HA  ))
 ASSI { 5436}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 44   and name HB% )
      3.300     1.400     1.400 peak  5436 spectrum    1 weight  0.10000E+01 volume  0.38089E-02 ppm1      2.708 ppm2      1.496 CV     1
 OR { 5436}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI { 5437}
   (( segid "    " and resid 80   and name HB1 ))
   (  segid "    " and resid 83   and name HG1%)
      3.100     1.200     1.200 peak  5437 spectrum    1 weight  0.10000E+01 volume  0.43701E-02 ppm1      2.718 ppm2      1.094 CV     1
 OR { 5437}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 83   and name HG1%)
 ASSI { 5438}
   (( segid "    " and resid 80   and name HB1 ))
   (  segid "    " and resid 83   and name HG2%)
      2.600     0.900     0.900 peak  5438 spectrum    1 weight  0.10000E+01 volume  0.49348E-02 ppm1      2.715 ppm2      0.858 CV     1
 OR { 5438}
   (( segid "    " and resid 14   and name HE2 ))
   (  segid "    " and resid 12   and name HG1%)
 OR { 5438}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 89   and name HG2%)
 ASSI { 5439}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 80   and name HA  ))
      2.600     0.800     0.800 peak  5439 spectrum    1 weight  0.10000E+01 volume  0.80892E-02 ppm1      2.689 ppm2      4.666 CV     1
 OR { 5439}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 39   and name HA  ))
 OR { 5439}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 114  and name HA  ))
 OR { 5439}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 5441}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 92   and name HD1 ))
      3.600     1.600     1.600 peak  5441 spectrum    1 weight  0.10000E+01 volume  0.18380E-02 ppm1      2.682 ppm2      7.549 CV     1
 OR { 5441}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 92   and name HN  ))
 OR { 5441}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 53   and name HN  ))
 OR { 5441}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI { 5442}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 90   and name HA2 ))
      3.500     1.500     1.500 peak  5442 spectrum    1 weight  0.10000E+01 volume  0.13501E-02 ppm1      2.683 ppm2      3.798 CV     1
 OR { 5442}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 91   and name HB1 ))
 OR { 5442}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 91   and name HB2 ))
 OR { 5442}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 34   and name HA2 ))
 OR { 5442}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI { 5443}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 86   and name HD1 ))
      2.800     1.000     1.000 peak  5443 spectrum    1 weight  0.10000E+01 volume  0.23095E-02 ppm1      2.685 ppm2      1.340 CV     1
 OR { 5443}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 42   and name HB2 ))
 OR { 5443}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 5446}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HN  ))
      3.900     1.900     1.900 peak  5446 spectrum    1 weight  0.10000E+01 volume  0.98824E-03 ppm1      2.376 ppm2      9.137 CV     1
 OR { 5446}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 40   and name HN  ))
 ASSI { 5449}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 41   and name HA  ))
      2.700     0.900     0.900 peak  5449 spectrum    1 weight  0.10000E+01 volume  0.37152E-02 ppm1      2.381 ppm2      5.690 CV     1
 OR { 5449}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
 OR { 5449}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 82   and name HN  ))
 ASSI { 5452}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 121  and name HE3 ))
      5.500     3.800     0.500 peak  5452 spectrum    1 weight  0.10000E+01 volume  0.32053E-03 ppm1      2.364 ppm2      6.832 CV     1
 OR { 5452}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 43   and name HZ% )
 OR { 5452}
   (( segid "    " and resid 80   and name HB2 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI { 5453}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 40   and name HG1%)
      4.800     2.900     1.200 peak  5453 spectrum    1 weight  0.10000E+01 volume  0.30537E-03 ppm1      2.357 ppm2      1.297 CV     1
 OR { 5453}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 40   and name HG2%)
 OR { 5453}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 86   and name HD1 ))
 OR { 5453}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 5464}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 90   and name HA2 ))
      3.800     1.800     1.800 peak  5464 spectrum    1 weight  0.10000E+01 volume  0.11326E-02 ppm1      2.182 ppm2      3.796 CV     1
 OR { 5464}
   (( segid "    " and resid 86   and name HE2 ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI { 5473}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 42   and name HN  ))
      3.400     1.400     1.400 peak  5473 spectrum    1 weight  0.10000E+01 volume  0.12678E-02 ppm1      3.080 ppm2      9.149 CV     1
 OR { 5473}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 5475}
   (( segid "    " and resid 126  and name HE1 ))
   (( segid "    " and resid 121  and name HZ2 ))
      3.900     1.900     1.900 peak  5475 spectrum    1 weight  0.10000E+01 volume  0.11233E-02 ppm1      3.080 ppm2      7.278 CV     1
 OR { 5475}
   (( segid "    " and resid 84   and name HB1 ))
   (  segid "    " and resid 54   and name HE% )
 ASSI { 5480}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 42   and name HG  ))
      2.300     0.600     0.600 peak  5480 spectrum    1 weight  0.10000E+01 volume  0.12322E-01 ppm1      3.065 ppm2      1.729 CV     1
 OR { 5480}
   (( segid "    " and resid 126  and name HE1 ))
   (( segid "    " and resid 123  and name HB1 ))
 OR { 5480}
   (( segid "    " and resid 126  and name HE1 ))
   (( segid "    " and resid 123  and name HB2 ))
 OR { 5480}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 42   and name HB1 ))
 OR { 5480}
   (( segid "    " and resid 126  and name HE1 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 5480}
   (( segid "    " and resid 123  and name HE2 ))
   (( segid "    " and resid 123  and name HB2 ))
 OR { 5480}
   (( segid "    " and resid 126  and name HE1 ))
   (( segid "    " and resid 126  and name HB1 ))
 ASSI { 5481}
   (( segid "    " and resid 14   and name HE1 ))
   (  segid "    " and resid 12   and name HG1%)
      3.200     1.300     1.300 peak  5481 spectrum    1 weight  0.10000E+01 volume  0.28860E-02 ppm1      3.048 ppm2      0.850 CV     1
 OR { 5481}
   (( segid "    " and resid 84   and name HB1 ))
   (  segid "    " and resid 42   and name HD2%)
 ASSI { 5484}
   (( segid "    " and resid 54   and name HB1 ))
   (  segid "    " and resid 116  and name HD2%)
      2.900     1.100     1.100 peak  5484 spectrum    1 weight  0.10000E+01 volume  0.34670E-02 ppm1      3.021 ppm2      0.440 CV     1
 OR { 5484}
   (( segid "    " and resid 14   and name HE1 ))
   (  segid "    " and resid 25   and name HD1%)
 OR { 5484}
   (( segid "    " and resid 14   and name HE1 ))
   (  segid "    " and resid 19   and name HD2%)
 ASSI { 5488}
   (( segid "    " and resid 43   and name HE1 ))
   (( segid "    " and resid 41   and name HN  ))
      4.000     2.000     2.000 peak  5488 spectrum    1 weight  0.10000E+01 volume  0.10608E-02 ppm1      2.920 ppm2      8.791 CV     1
 OR { 5488}
   (( segid "    " and resid 43   and name HE2 ))
   (( segid "    " and resid 44   and name HN  ))
 OR { 5488}
   (( segid "    " and resid 43   and name HE1 ))
   (( segid "    " and resid 44   and name HN  ))
 OR { 5488}
   (( segid "    " and resid 43   and name HE2 ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI { 5498}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 81   and name HD21))
      3.500     1.500     1.500 peak  5498 spectrum    1 weight  0.10000E+01 volume  0.16892E-02 ppm1      2.818 ppm2      7.683 CV     1
 OR { 5498}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI { 5504}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 113  and name HN  ))
      3.500     1.600     1.600 peak  5504 spectrum    1 weight  0.10000E+01 volume  0.58203E-03 ppm1      2.748 ppm2      8.720 CV     1
 OR { 5504}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI { 5506}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 62   and name HN  ))
      3.800     1.800     1.800 peak  5506 spectrum    1 weight  0.10000E+01 volume  0.17099E-02 ppm1      2.636 ppm2      8.475 CV     1
 OR { 5506}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 58   and name HN  ))
 ASSI { 5507}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      3.900     1.900     1.900 peak  5507 spectrum    1 weight  0.10000E+01 volume  0.15754E-02 ppm1      2.747 ppm2      7.996 CV     1
 OR { 5507}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 125  and name HN  ))
 OR { 5507}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 130  and name HN  ))
 OR { 5507}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 5512}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 48   and name HB1 ))
      4.300     2.300     1.700 peak  5512 spectrum    1 weight  0.10000E+01 volume  0.79665E-03 ppm1      2.716 ppm2      3.544 CV     1
 OR { 5512}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 58   and name HB2 ))
 OR { 5512}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 58   and name HB1 ))
 ASSI { 5513}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 56   and name HB1 ))
      2.500     0.800     0.800 peak  5513 spectrum    1 weight  0.10000E+01 volume  0.38952E-02 ppm1      2.718 ppm2      1.787 CV     1
 OR { 5513}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 42   and name HG  ))
 OR { 5513}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 42   and name HB1 ))
 ASSI { 5514}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 40   and name HN  ))
      3.100     1.200     1.200 peak  5514 spectrum    1 weight  0.10000E+01 volume  0.12934E-02 ppm1      2.678 ppm2      9.156 CV     1
 OR { 5514}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI { 5515}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 54   and name HE% )
      3.200     1.300     1.300 peak  5515 spectrum    1 weight  0.10000E+01 volume  0.16960E-02 ppm1      2.677 ppm2      7.259 CV     1
 OR { 5515}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 54   and name HD% )
 OR { 5515}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 88   and name HN  ))
 ASSI { 5518}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 44   and name HA  ))
      4.100     2.100     1.900 peak  5518 spectrum    1 weight  0.10000E+01 volume  0.13286E-02 ppm1      2.675 ppm2      5.260 CV     1
 OR { 5518}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 54   and name HA  ))
 OR { 5518}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
 ASSI { 5520}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 86   and name HG2 ))
      3.000     1.100     1.100 peak  5520 spectrum    1 weight  0.10000E+01 volume  0.17020E-02 ppm1      2.676 ppm2     -0.587 CV     1
 OR { 5520}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 69   and name HD1%)
 ASSI { 5522}
   (( segid "    " and resid 14   and name HE2 ))
   (( segid "    " and resid 13   and name HN  ))
      3.300     1.300     1.300 peak  5522 spectrum    1 weight  0.10000E+01 volume  0.13923E-02 ppm1      2.751 ppm2      8.357 CV     1
 OR { 5522}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 123  and name HN  ))
 OR { 5522}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 129  and name HN  ))
 ASSI { 5523}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 84   and name HD% )
      2.400     0.700     0.700 peak  5523 spectrum    1 weight  0.10000E+01 volume  0.41620E-02 ppm1      2.681 ppm2      6.907 CV     1
 OR { 5523}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI { 5524}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 54   and name HZ  ))
      3.200     1.300     1.300 peak  5524 spectrum    1 weight  0.10000E+01 volume  0.24340E-02 ppm1      2.668 ppm2      6.744 CV     1
 OR { 5524}
   (( segid "    " and resid 63   and name HB2 ))
   (  segid "    " and resid 112  and name HD% )
 OR { 5524}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 93   and name HN  ))
 OR { 5524}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 43   and name HZ% )
 ASSI { 5525}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 110  and name HN  ))
      4.300     2.300     1.700 peak  5525 spectrum    1 weight  0.10000E+01 volume  0.43317E-03 ppm1      2.665 ppm2      8.734 CV     1
 OR { 5525}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 41   and name HN  ))
 OR { 5525}
   (( segid "    " and resid 86   and name HE1 ))
   (( segid "    " and resid 32   and name HN  ))
 ASSI { 5533}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HN  ))
      2.700     0.900     0.900 peak  5533 spectrum    1 weight  0.10000E+01 volume  0.39067E-02 ppm1      2.566 ppm2      9.401 CV     1
 OR { 5533}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 100  and name HN  ))
 OR { 5533}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 100  and name HN  ))
 ASSI { 5536}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 98   and name HG2%)
      3.800     1.800     1.800 peak  5536 spectrum    1 weight  0.10000E+01 volume  0.96112E-03 ppm1      2.558 ppm2      0.490 CV     1
 OR { 5536}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 67   and name HG1%)
 OR { 5536}
   (( segid "    " and resid 99   and name HB2 ))
   (  segid "    " and resid 67   and name HG1%)
 OR { 5536}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 116  and name HD2%)
 OR { 5536}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 67   and name HG1%)
 OR { 5536}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 5538}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 82   and name HA1 ))
      3.900     1.900     1.900 peak  5538 spectrum    1 weight  0.10000E+01 volume  0.18079E-02 ppm1      2.545 ppm2      3.106 CV     1
 OR { 5538}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 54   and name HB1 ))
 OR { 5538}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 71   and name HD2 ))
 ASSI { 5539}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 100  and name HG1%)
      4.000     2.000     2.000 peak  5539 spectrum    1 weight  0.10000E+01 volume  0.11736E-02 ppm1      2.554 ppm2      0.882 CV     1
 OR { 5539}
   (( segid "    " and resid 99   and name HB2 ))
   (  segid "    " and resid 100  and name HG1%)
 OR { 5539}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 100  and name HG1%)
 OR { 5539}
   (( segid "    " and resid 21   and name HB1 ))
   (  segid "    " and resid 100  and name HG1%)
 OR { 5539}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 5540}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 54   and name HE% )
      4.000     2.000     2.000 peak  5540 spectrum    1 weight  0.10000E+01 volume  0.97734E-03 ppm1      2.538 ppm2      7.234 CV     1
 OR { 5540}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 54   and name HD% )
 OR { 5540}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 54   and name HD% )
 ASSI { 5541}
   (( segid "    " and resid 64   and name HE1 ))
   (  segid "    " and resid 66   and name HE% )
      2.900     1.000     1.000 peak  5541 spectrum    1 weight  0.10000E+01 volume  0.35703E-02 ppm1      2.442 ppm2      6.630 CV     1
 OR { 5541}
   (( segid "    " and resid 64   and name HE1 ))
   (  segid "    " and resid 55   and name HD% )
 ASSI { 5542}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 22   and name HB% )
      2.900     1.000     1.000 peak  5542 spectrum    1 weight  0.10000E+01 volume  0.19897E-02 ppm1      2.539 ppm2      1.510 CV     1
 OR { 5542}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 44   and name HB% )
 OR { 5542}
   (( segid "    " and resid 21   and name HB1 ))
   (  segid "    " and resid 22   and name HB% )
 OR { 5542}
   (( segid "    " and resid 99   and name HB2 ))
   (  segid "    " and resid 22   and name HB% )
 ASSI { 5543}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      3.700     1.700     1.700 peak  5543 spectrum    1 weight  0.10000E+01 volume  0.16573E-02 ppm1      2.520 ppm2      8.388 CV     1
 OR { 5543}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 5546}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 22   and name HN  ))
      4.100     2.100     1.900 peak  5546 spectrum    1 weight  0.10000E+01 volume  0.86526E-03 ppm1      2.517 ppm2      8.572 CV     1
 OR { 5546}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
 OR { 5546}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
 OR { 5546}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
 OR { 5546}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 5550}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 52   and name HN  ))
      3.600     1.600     1.600 peak  5550 spectrum    1 weight  0.10000E+01 volume  0.28266E-02 ppm1      2.489 ppm2      7.586 CV     1
 OR { 5550}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 5551}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 99   and name HA  ))
      2.400     0.700     0.700 peak  5551 spectrum    1 weight  0.10000E+01 volume  0.47668E-02 ppm1      2.505 ppm2      5.125 CV     1
 OR { 5551}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HA  ))
 OR { 5551}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 99   and name HA  ))
 OR { 5551}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 5552}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 67   and name HG1%)
      4.200     2.200     1.800 peak  5552 spectrum    1 weight  0.10000E+01 volume  0.12008E-02 ppm1      2.489 ppm2      0.498 CV     1
 OR { 5552}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 98   and name HG2%)
 OR { 5552}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 116  and name HD2%)
 OR { 5552}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 116  and name HG  ))
 ASSI { 5557}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 49   and name HD% )
      3.400     1.400     1.400 peak  5557 spectrum    1 weight  0.10000E+01 volume  0.76941E-03 ppm1      2.526 ppm2      6.568 CV     1
 OR { 5557}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 99   and name HE% )
 ASSI { 5562}
   (( segid "    " and resid 64   and name HE2 ))
   (  segid "    " and resid 66   and name HE% )
      3.600     1.600     1.600 peak  5562 spectrum    1 weight  0.10000E+01 volume  0.90939E-03 ppm1      2.361 ppm2      6.634 CV     1
 OR { 5562}
   (( segid "    " and resid 64   and name HE2 ))
   (  segid "    " and resid 55   and name HD% )
 ASSI { 5566}
   (( segid "    " and resid 64   and name HE2 ))
   (( segid "    " and resid 64   and name HB1 ))
      3.400     1.500     1.500 peak  5566 spectrum    1 weight  0.10000E+01 volume  0.32767E-02 ppm1      2.346 ppm2      1.026 CV     1
 OR { 5566}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 86   and name HG1 ))
 ASSI { 5580}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HD1 ))
      6.000     4.500     0.000 peak  5580 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.042 ppm2      6.801 CV     1
 OR { 5580}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 93   and name HN  ))
 ASSI { 5582}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HD2 ))
      6.000     4.500     0.000 peak  5582 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.468 ppm2      3.086 CV     1
 OR { 5582}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI { 5583}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 92   and name HB1 ))
      6.000     4.500     0.000 peak  5583 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.043 ppm2      3.086 CV     1
 OR { 5583}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 71   and name HD2 ))
 OR { 5583}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 84   and name HB1 ))
 ASSI { 5584}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
      6.000     4.500     0.000 peak  5584 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.040 ppm2      2.699 CV     1
 OR { 5584}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 86   and name HE1 ))
 OR { 5584}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 5585}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 25   and name HN  ))
      6.000     4.500     0.000 peak  5585 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.672 ppm2      8.567 CV     1
 OR { 5585}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 5586}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 49   and name HZ  ))
      6.000     4.500     0.000 peak  5586 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.542 ppm2      7.144 CV     1
 OR { 5586}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 54   and name HE% )
 ASSI { 5587}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 81   and name HB1 ))
      6.000     4.500     0.000 peak  5587 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.927 ppm2      3.056 CV     1
 OR { 5587}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 54   and name HB1 ))
 ASSI { 5588}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 43   and name HE2 ))
      6.000     4.500     0.000 peak  5588 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.938 ppm2      2.952 CV     1
 OR { 5588}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 43   and name HE1 ))
 OR { 5588}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 54   and name HB1 ))
 ASSI { 5589}
   (( segid "    " and resid 136  and name HA1 ))
   (( segid "    " and resid 136  and name HN  ))
      6.000     4.500     0.000 peak  5589 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.526 ppm2      9.372 CV     1
 OR { 5589}
   (( segid "    " and resid 136  and name HA1 ))
   (( segid "    " and resid 137  and name HN  ))
 ASSI { 5591}
   (( segid "    " and resid 14   and name HE2 ))
   (( segid "    " and resid 14   and name HB2 ))
      6.000     4.500     0.000 peak  5591 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.756 ppm2      1.323 CV     1
 OR { 5591}
   (( segid "    " and resid 85   and name HB1 ))
   (  segid "    " and resid 40   and name HG1%)
 ASSI { 5604}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 120  and name HB2 ))
      3.100     1.200     1.200 peak  5604 spectrum    1 weight  0.10000E+01 volume  0.24795E-02 ppm1      0.867 ppm2      2.749 CV     1
 OR { 5604}
   (  segid "    " and resid 42   and name HD2%)
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 5605}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 120  and name HB1 ))
      3.300     1.300     1.300 peak  5605 spectrum    1 weight  0.10000E+01 volume  0.10967E-02 ppm1      0.867 ppm2      2.941 CV     1
 OR { 5605}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 3    and name HB1 ))
 ASSI { 5606}
   (( segid "    " and resid 98   and name HG11))
   (( segid "    " and resid 97   and name HA1 ))
      3.800     1.800     1.800 peak  5606 spectrum    1 weight  0.10000E+01 volume  0.71525E-03 ppm1      1.353 ppm2      4.325 CV     1
 OR { 5606}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI { 5607}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 83   and name HN  ))
      6.000     4.500     0.000 peak  5607 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.091 ppm2      7.439 CV     1
 OR { 5607}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 128  and name HN  ))



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    GLU   1           H        GLU   1 -20.707  -2.176  -4.840
    2    HA   GLU   1           HA       GLU   1 -21.484   0.018  -6.656
    3   1HB   GLU   1          HB2       GLU   1 -20.176   0.116  -3.936
    4   2HB   GLU   1          HB1       GLU   1 -20.115   1.446  -5.085
    5   1HG   GLU   1          HG2       GLU   1 -22.578   1.535  -5.059
    6   2HG   GLU   1          HG1       GLU   1 -22.582   0.275  -3.827
    7    H    GLU   2           HN       GLU   2 -19.840   0.762  -7.922
    8    HA   GLU   2           HA       GLU   2 -17.449  -0.933  -7.967
    9   1HB   GLU   2          HB2       GLU   2 -18.863  -0.741 -10.040
   10   2HB   GLU   2          HB1       GLU   2 -18.423   0.959 -10.100
   11   1HG   GLU   2          HG2       GLU   2 -17.078  -0.431 -11.606
   12   2HG   GLU   2          HG1       GLU   2 -16.109   0.417 -10.404
   13    H    CYS   3           HN       CYS   3 -15.913  -0.090  -6.772
   14    HA   CYS   3           HA       CYS   3 -15.753   2.763  -6.352
   15   1HB   CYS   3          HB2       CYS   3 -14.308   0.405  -5.173
   16   2HB   CYS   3          HB1       CYS   3 -13.785   2.057  -4.860
   17    H    GLN   4           HN       GLN   4 -14.934   3.820  -8.036
   18    HA   GLN   4           HA       GLN   4 -12.540   2.872  -9.368
   19   1HB   GLN   4          HB2       GLN   4 -14.186   5.392  -9.666
   20   2HB   GLN   4          HB1       GLN   4 -12.745   5.051 -10.614
   21   1HG   GLN   4          HG2       GLN   4 -15.229   3.353 -10.578
   22   2HG   GLN   4          HG1       GLN   4 -14.825   4.544 -11.814
   23   1HE2  GLN   4          HE21      GLN   4 -14.112   1.415 -10.504
   24   2HE2  GLN   4          HE22      GLN   4 -13.107   0.870 -11.806
   25    H    VAL   5           HN       VAL   5 -10.663   3.109  -8.369
   26    HA   VAL   5           HA       VAL   5 -10.344   5.392  -6.556
   27    HB   VAL   5           HB       VAL   5 -10.216   3.292  -5.365
   28   1HG1  VAL   5          HG11      VAL   5  -7.968   2.562  -7.230
   29   2HG1  VAL   5          HG12      VAL   5  -9.576   1.838  -7.210
   30   3HG1  VAL   5          HG13      VAL   5  -8.499   1.629  -5.830
   31   1HG2  VAL   5          HG21      VAL   5  -8.765   5.104  -4.623
   32   2HG2  VAL   5          HG22      VAL   5  -7.480   4.514  -5.678
   33   3HG2  VAL   5          HG23      VAL   5  -8.029   3.532  -4.319
   34    H    ARG   6           HN       ARG   6  -8.932   6.873  -7.010
   35    HA   ARG   6           HA       ARG   6  -7.129   6.558  -9.262
   36   1HB   ARG   6          HB2       ARG   6  -7.698   8.918  -7.453
   37   2HB   ARG   6          HB1       ARG   6  -6.637   8.965  -8.856
   38   1HG   ARG   6          HG2       ARG   6  -9.578   8.315  -8.939
   39   2HG   ARG   6          HG1       ARG   6  -8.873   9.893  -9.302
   40   1HD   ARG   6          HD2       ARG   6  -8.299   7.318 -10.766
   41   2HD   ARG   6          HD1       ARG   6  -9.341   8.621 -11.339
   42    HE   ARG   6           HE       ARG   6  -7.069   9.944 -10.981
   43   1HH1  ARG   6          HH11      ARG   6  -7.611   6.804 -12.446
   44   2HH1  ARG   6          HH12      ARG   6  -6.275   6.954 -13.551
   45   1HH2  ARG   6          HH21      ARG   6  -5.332  10.146 -12.431
   46   2HH2  ARG   6          HH22      ARG   6  -4.992   8.861 -13.553
   47    H    VAL   7           HN       VAL   7  -5.328   5.457  -8.822
   48    HA   VAL   7           HA       VAL   7  -3.849   6.127  -6.370
   49    HB   VAL   7           HB       VAL   7  -3.532   3.650  -8.083
   50   1HG1  VAL   7          HG11      VAL   7  -2.197   2.810  -6.196
   51   2HG1  VAL   7          HG12      VAL   7  -2.367   4.373  -5.395
   52   3HG1  VAL   7          HG13      VAL   7  -1.492   4.254  -6.921
   53   1HG2  VAL   7          HG21      VAL   7  -5.690   3.606  -6.995
   54   2HG2  VAL   7          HG22      VAL   7  -4.950   4.002  -5.444
   55   3HG2  VAL   7          HG23      VAL   7  -4.608   2.452  -6.215
   56    H    GLY   8           HN       GLY   8  -2.079   7.313  -6.626
   57   1HA   GLY   8          HA2       GLY   8  -1.165   7.881  -9.326
   58   2HA   GLY   8          HA1       GLY   8  -0.706   8.742  -7.869
   59    H    ASP   9           HN       ASP   9   0.651   7.200 -10.229
   60    HA   ASP   9           HA       ASP   9   2.380   5.328  -8.933
   61   1HB   ASP   9          HB2       ASP   9   2.772   6.867 -11.515
   62   2HB   ASP   9          HB1       ASP   9   3.738   5.494 -10.992
   63    H    LEU  10           HN       LEU  10   3.961   5.838  -7.530
   64    HA   LEU  10           HA       LEU  10   5.013   8.590  -7.631
   65   1HB   LEU  10          HB2       LEU  10   4.724   6.827  -5.199
   66   2HB   LEU  10          HB1       LEU  10   5.329   8.472  -5.215
   67    HG   LEU  10           HG       LEU  10   2.504   7.585  -5.792
   68   1HD1  LEU  10          HD11      LEU  10   1.987   8.882  -3.778
   69   2HD1  LEU  10          HD12      LEU  10   3.708   9.193  -3.547
   70   3HD1  LEU  10          HD13      LEU  10   3.087   7.547  -3.441
   71   1HD2  LEU  10          HD21      LEU  10   1.985   9.979  -5.973
   72   2HD2  LEU  10          HD22      LEU  10   3.099   9.457  -7.236
   73   3HD2  LEU  10          HD23      LEU  10   3.703  10.357  -5.845
   74    H    THR  11           HN       THR  11   6.904   8.206  -8.810
   75    HA   THR  11           HA       THR  11   8.817   6.411  -7.489
   76    HB   THR  11           HB       THR  11   8.675   6.039  -9.887
   77    HG1  THR  11           HG1      THR  11  11.060   7.230  -8.916
   78   1HG2  THR  11          HG21      THR  11   9.479   8.931 -10.219
   79   2HG2  THR  11          HG22      THR  11   7.906   8.239 -10.615
   80   3HG2  THR  11          HG23      THR  11   9.340   7.742 -11.516
   81    H    VAL  12           HN       VAL  12  10.058   7.279  -6.021
   82    HA   VAL  12           HA       VAL  12  11.172   9.952  -6.290
   83    HB   VAL  12           HB       VAL  12   9.346   9.279  -3.961
   84   1HG1  VAL  12          HG11      VAL  12  11.235  10.605  -3.228
   85   2HG1  VAL  12          HG12      VAL  12   9.769  11.585  -3.217
   86   3HG1  VAL  12          HG13      VAL  12  10.945  11.774  -4.517
   87   1HG2  VAL  12          HG21      VAL  12   8.989  11.344  -6.129
   88   2HG2  VAL  12          HG22      VAL  12   7.940  11.128  -4.727
   89   3HG2  VAL  12          HG23      VAL  12   8.059   9.858  -5.944
   90    H    ALA  13           HN       ALA  13  12.936  10.281  -4.826
   91    HA   ALA  13           HA       ALA  13  14.123   7.752  -4.010
   92   1HB   ALA  13          HB1       ALA  13  15.408   9.288  -5.416
   93   2HB   ALA  13          HB2       ALA  13  16.208   8.993  -3.872
   94   3HB   ALA  13          HB3       ALA  13  15.340  10.506  -4.142
   95    H    LYS  14           HN       LYS  14  14.031   7.038  -1.990
   96    HA   LYS  14           HA       LYS  14  14.530   8.913   0.183
   97   1HB   LYS  14          HB2       LYS  14  12.470   6.790   0.663
   98   2HB   LYS  14          HB1       LYS  14  12.818   8.220   1.612
   99   1HG   LYS  14          HG2       LYS  14  10.894   8.902   0.685
  100   2HG   LYS  14          HG1       LYS  14  11.984   9.409  -0.607
  101   1HD   LYS  14          HD2       LYS  14  11.555   7.309  -1.789
  102   2HD   LYS  14          HD1       LYS  14  10.452   6.814  -0.500
  103   1HE   LYS  14          HE2       LYS  14   8.999   8.670  -0.971
  104   2HE   LYS  14          HE1       LYS  14  10.150   9.295  -2.156
  105   1HZ   LYS  14          HZ1       LYS  14   8.323   8.123  -3.224
  106   2HZ   LYS  14          HZ2       LYS  14   8.688   6.715  -2.360
  107   3HZ   LYS  14          HZ3       LYS  14   9.787   7.317  -3.498
  108    H    THR  15           HN       THR  15  14.886   7.621   2.278
  109    HA   THR  15           HA       THR  15  16.232   5.075   1.702
  110    HB   THR  15           HB       THR  15  16.964   5.771   4.255
  111    HG1  THR  15           HG1      THR  15  17.472   8.156   2.920
  112   1HG2  THR  15          HG21      THR  15  18.435   4.903   2.507
  113   2HG2  THR  15          HG22      THR  15  19.136   6.320   3.284
  114   3HG2  THR  15          HG23      THR  15  18.394   6.466   1.691
  115    H    ARG  16           HN       ARG  16  15.855   3.301   3.155
  116    HA   ARG  16           HA       ARG  16  13.147   3.358   4.233
  117   1HB   ARG  16          HB2       ARG  16  15.024   0.989   4.195
  118   2HB   ARG  16          HB1       ARG  16  13.281   0.974   4.447
  119   1HG   ARG  16          HG2       ARG  16  13.345   0.308   2.276
  120   2HG   ARG  16          HG1       ARG  16  13.285   2.056   2.036
  121   1HD   ARG  16          HD2       ARG  16  15.846   1.954   2.037
  122   2HD   ARG  16          HD1       ARG  16  15.648   0.217   1.833
  123    HE   ARG  16           HE       ARG  16  14.576   0.654  -0.266
  124   1HH1  ARG  16          HH11      ARG  16  16.304   3.291   1.189
  125   2HH1  ARG  16          HH12      ARG  16  16.324   4.272  -0.242
  126   1HH2  ARG  16          HH21      ARG  16  14.644   1.913  -2.225
  127   2HH2  ARG  16          HH22      ARG  16  15.405   3.470  -2.191
  128    H    GLY  17           HN       GLY  17  16.198   4.011   5.265
  129   1HA   GLY  17          HA2       GLY  17  15.781   3.247   8.039
  130   2HA   GLY  17          HA1       GLY  17  17.166   4.121   7.390
  131    H    GLN  18           HN       GLN  18  15.511   6.028   5.949
  132    HA   GLN  18           HA       GLN  18  14.922   7.949   7.932
  133   1HB   GLN  18          HB2       GLN  18  15.445   8.535   5.586
  134   2HB   GLN  18          HB1       GLN  18  13.938   7.786   5.069
  135   1HG   GLN  18          HG2       GLN  18  13.710  10.191   5.171
  136   2HG   GLN  18          HG1       GLN  18  12.681   9.419   6.377
  137   1HE2  GLN  18          HE21      GLN  18  12.574  11.218   7.701
  138   2HE2  GLN  18          HE22      GLN  18  13.936  11.787   8.611
  139    H    LEU  19           HN       LEU  19  13.050   5.572   6.176
  140    HA   LEU  19           HA       LEU  19  10.541   6.089   7.361
  141   1HB   LEU  19          HB2       LEU  19  11.733   3.503   6.348
  142   2HB   LEU  19          HB1       LEU  19  10.047   3.722   6.771
  143    HG   LEU  19           HG       LEU  19  11.453   5.217   4.553
  144   1HD1  LEU  19          HD11      LEU  19  10.222   3.743   3.043
  145   2HD1  LEU  19          HD12      LEU  19   9.604   2.837   4.424
  146   3HD1  LEU  19          HD13      LEU  19  11.331   2.828   4.065
  147   1HD2  LEU  19          HD21      LEU  19   9.537   6.402   5.505
  148   2HD2  LEU  19          HD22      LEU  19   8.537   4.966   5.288
  149   3HD2  LEU  19          HD23      LEU  19   9.177   5.816   3.881
  150    H    THR  20           HN       THR  20  10.649   6.374   9.548
  151    HA   THR  20           HA       THR  20  11.992   4.322  11.140
  152    HB   THR  20           HB       THR  20  12.834   6.527  11.590
  153    HG1  THR  20           HG1      THR  20  12.872   5.704  13.538
  154   1HG2  THR  20          HG21      THR  20  11.400   8.342  12.430
  155   2HG2  THR  20          HG22      THR  20   9.980   7.337  12.138
  156   3HG2  THR  20          HG23      THR  20  10.980   7.865  10.785
  157    H    ASP  21           HN       ASP  21  10.087   3.045  10.480
  158    HA   ASP  21           HA       ASP  21   8.154   1.969  10.902
  159   1HB   ASP  21          HB2       ASP  21   8.816   1.841  13.229
  160   2HB   ASP  21          HB1       ASP  21   8.238   3.479  13.525
  161    H    ALA  22           HN       ALA  22   7.281   4.949  12.608
  162    HA   ALA  22           HA       ALA  22   5.003   5.176  10.803
  163   1HB   ALA  22          HB1       ALA  22   4.524   5.177  13.197
  164   2HB   ALA  22          HB2       ALA  22   4.057   6.706  12.451
  165   3HB   ALA  22          HB3       ALA  22   5.538   6.606  13.403
  166    H    ALA  23           HN       ALA  23   6.451   5.906   9.083
  167    HA   ALA  23           HA       ALA  23   6.625   8.821   9.120
  168   1HB   ALA  23          HB1       ALA  23   8.847   8.830   8.122
  169   2HB   ALA  23          HB2       ALA  23   8.912   7.071   8.214
  170   3HB   ALA  23          HB3       ALA  23   8.880   8.031   9.694
  171    HA   PRO  24           HA       PRO  24   4.636   7.497   5.262
  172   1HB   PRO  24          HB2       PRO  24   3.129   9.706   4.954
  173   2HB   PRO  24          HB1       PRO  24   2.684   8.414   6.075
  174   1HG   PRO  24          HG2       PRO  24   4.002  11.043   6.642
  175   2HG   PRO  24          HG1       PRO  24   2.718  10.217   7.543
  176   1HD   PRO  24          HD2       PRO  24   5.349  10.160   8.283
  177   2HD   PRO  24          HD1       PRO  24   4.200   8.867   8.657
  178    H    ILE  25           HN       ILE  25   6.423   7.616   3.900
  179    HA   ILE  25           HA       ILE  25   6.994  10.313   2.846
  180    HB   ILE  25           HB       ILE  25   8.866   7.979   2.511
  181   1HG1  ILE  25          HG12      ILE  25   8.724   9.957   4.795
  182   2HG1  ILE  25          HG11      ILE  25   8.501   8.212   4.906
  183   1HG2  ILE  25          HG21      ILE  25   9.267  10.977   2.517
  184   2HG2  ILE  25          HG22      ILE  25   9.206   9.948   1.087
  185   3HG2  ILE  25          HG23      ILE  25  10.524   9.771   2.244
  186   1HD1  ILE  25          HD11      ILE  25  10.836   7.872   4.295
  187   2HD1  ILE  25          HD12      ILE  25  10.690   8.896   5.724
  188   3HD1  ILE  25          HD13      ILE  25  11.059   9.617   4.157
  189    H    GLY  26           HN       GLY  26   5.103   7.891   2.201
  190   1HA   GLY  26          HA2       GLY  26   5.283   8.472  -0.678
  191   2HA   GLY  26          HA1       GLY  26   4.964   6.832  -0.127
  192    HA   PRO  27           HA       PRO  27   1.002   9.277   1.185
  193   1HB   PRO  27          HB2       PRO  27   0.851  11.887   0.374
  194   2HB   PRO  27          HB1       PRO  27   1.409  11.383   1.974
  195   1HG   PRO  27          HG2       PRO  27   3.012  12.125  -0.448
  196   2HG   PRO  27          HG1       PRO  27   3.277  12.573   1.248
  197   1HD   PRO  27          HD2       PRO  27   4.700  10.621   0.077
  198   2HD   PRO  27          HD1       PRO  27   4.203  10.519   1.776
  199    H    VAL  28           HN       VAL  28  -0.036   8.072  -0.298
  200    HA   VAL  28           HA       VAL  28  -0.100   8.880  -3.093
  201    HB   VAL  28           HB       VAL  28  -1.537   6.585  -1.740
  202   1HG1  VAL  28          HG11      VAL  28  -1.759   5.684  -4.008
  203   2HG1  VAL  28          HG12      VAL  28  -1.005   7.139  -4.657
  204   3HG1  VAL  28          HG13      VAL  28  -2.567   7.243  -3.845
  205   1HG2  VAL  28          HG21      VAL  28   0.225   5.153  -2.648
  206   2HG2  VAL  28          HG22      VAL  28   0.884   6.343  -1.524
  207   3HG2  VAL  28          HG23      VAL  28   1.067   6.575  -3.262
  208    H    THR  29           HN       THR  29  -1.609  10.201  -3.870
  209    HA   THR  29           HA       THR  29  -3.803  11.053  -2.228
  210    HB   THR  29           HB       THR  29  -4.365  12.320  -4.453
  211    HG1  THR  29           HG1      THR  29  -2.756  12.351  -5.931
  212   1HG2  THR  29          HG21      THR  29  -1.870  12.899  -2.846
  213   2HG2  THR  29          HG22      THR  29  -3.511  13.394  -2.430
  214   3HG2  THR  29          HG23      THR  29  -2.726  14.060  -3.861
  215    H    VAL  30           HN       VAL  30  -5.115   9.288  -1.955
  216    HA   VAL  30           HA       VAL  30  -6.097   7.853  -4.291
  217    HB   VAL  30           HB       VAL  30  -6.300   7.364  -1.329
  218   1HG1  VAL  30          HG11      VAL  30  -7.646   5.371  -1.807
  219   2HG1  VAL  30          HG12      VAL  30  -7.766   5.859  -3.498
  220   3HG1  VAL  30          HG13      VAL  30  -8.503   6.851  -2.240
  221   1HG2  VAL  30          HG21      VAL  30  -5.210   5.247  -1.961
  222   2HG2  VAL  30          HG22      VAL  30  -4.265   6.649  -2.465
  223   3HG2  VAL  30          HG23      VAL  30  -5.221   5.758  -3.651
  224    H    GLN  31           HN       GLN  31  -7.807   8.534  -5.278
  225    HA   GLN  31           HA       GLN  31  -9.982   9.766  -3.732
  226   1HB   GLN  31          HB2       GLN  31  -9.018  11.227  -5.464
  227   2HB   GLN  31          HB1       GLN  31  -9.362  10.010  -6.685
  228   1HG   GLN  31          HG2       GLN  31 -11.744  10.266  -6.291
  229   2HG   GLN  31          HG1       GLN  31 -11.420  11.438  -5.014
  230   1HE2  GLN  31          HE21      GLN  31  -9.195  12.625  -6.500
  231   2HE2  GLN  31          HE22      GLN  31  -9.910  13.591  -7.748
  232    H    ALA  32           HN       ALA  32 -11.789   8.609  -3.543
  233    HA   ALA  32           HA       ALA  32 -12.086   6.247  -5.280
  234   1HB   ALA  32          HB1       ALA  32 -13.159   5.112  -3.408
  235   2HB   ALA  32          HB2       ALA  32 -12.938   6.545  -2.404
  236   3HB   ALA  32          HB3       ALA  32 -11.532   5.646  -2.978
  237    H    LEU  33           HN       LEU  33 -13.711   6.436  -6.638
  238    HA   LEU  33           HA       LEU  33 -15.860   8.306  -6.197
  239   1HB   LEU  33          HB2       LEU  33 -15.230   6.358  -8.407
  240   2HB   LEU  33          HB1       LEU  33 -16.736   7.249  -8.363
  241    HG   LEU  33           HG       LEU  33 -15.428   9.375  -8.406
  242   1HD1  LEU  33          HD11      LEU  33 -13.085   7.562  -8.971
  243   2HD1  LEU  33          HD12      LEU  33 -13.310   8.535  -7.516
  244   3HD1  LEU  33          HD13      LEU  33 -13.091   9.322  -9.080
  245   1HD2  LEU  33          HD21      LEU  33 -16.410   8.455 -10.426
  246   2HD2  LEU  33          HD22      LEU  33 -14.970   7.474 -10.696
  247   3HD2  LEU  33          HD23      LEU  33 -14.866   9.232 -10.781
  248    H    GLY  34           HN       GLY  34 -17.611   7.861  -5.049
  249   1HA   GLY  34          HA2       GLY  34 -19.582   6.718  -4.554
  250   2HA   GLY  34          HA1       GLY  34 -18.952   5.311  -5.398
  251    H    CYS  35           HN       CYS  35 -18.791   3.656  -4.086
  252    HA   CYS  35           HA       CYS  35 -18.267   2.331  -2.319
  253   1HB   CYS  35          HB2       CYS  35 -16.581   4.627  -1.310
  254   2HB   CYS  35          HB1       CYS  35 -16.424   2.928  -0.887
  255    H    ASN  36           HN       ASN  36 -20.530   4.242  -2.192
  256    HA   ASN  36           HA       ASN  36 -20.707   5.758   0.110
  257   1HB   ASN  36          HB2       ASN  36 -22.906   4.277  -1.343
  258   2HB   ASN  36          HB1       ASN  36 -23.188   5.497  -0.107
  259   1HD2  ASN  36          HD21      ASN  36 -22.118   4.881  -3.355
  260   2HD2  ASN  36          HD22      ASN  36 -22.167   6.535  -3.889
  261    H    ALA  37           HN       ALA  37 -21.541   2.341  -0.306
  262    HA   ALA  37           HA       ALA  37 -21.637   2.130   2.641
  263   1HB   ALA  37          HB1       ALA  37 -23.141   0.223   2.356
  264   2HB   ALA  37          HB2       ALA  37 -23.082   0.432   0.606
  265   3HB   ALA  37          HB3       ALA  37 -23.809   1.679   1.620
  266    H    ARG  38           HN       ARG  38 -19.290   1.942   0.824
  267    HA   ARG  38           HA       ARG  38 -18.635  -0.909   1.174
  268   1HB   ARG  38          HB2       ARG  38 -18.994   0.077  -1.224
  269   2HB   ARG  38          HB1       ARG  38 -17.418   0.811  -0.955
  270   1HG   ARG  38          HG2       ARG  38 -17.141  -1.216  -2.195
  271   2HG   ARG  38          HG1       ARG  38 -16.464  -1.431  -0.580
  272   1HD   ARG  38          HD2       ARG  38 -19.260  -2.296  -1.274
  273   2HD   ARG  38          HD1       ARG  38 -17.864  -3.339  -1.533
  274    HE   ARG  38           HE       ARG  38 -17.474  -2.943   0.969
  275   1HH1  ARG  38          HH11      ARG  38 -20.624  -3.161  -0.552
  276   2HH1  ARG  38          HH12      ARG  38 -21.424  -3.717   0.888
  277   1HH2  ARG  38          HH21      ARG  38 -18.510  -3.697   2.852
  278   2HH2  ARG  38          HH22      ARG  38 -20.215  -4.051   2.822
  279    H    GLN  39           HN       GLN  39 -16.629  -1.431   1.960
  280    HA   GLN  39           HA       GLN  39 -14.964   0.665   3.032
  281   1HB   GLN  39          HB2       GLN  39 -14.422  -2.311   2.886
  282   2HB   GLN  39          HB1       GLN  39 -13.566  -1.143   3.880
  283   1HG   GLN  39          HG2       GLN  39 -14.932  -1.981   5.464
  284   2HG   GLN  39          HG1       GLN  39 -16.021  -0.752   4.828
  285   1HE2  GLN  39          HE21      GLN  39 -16.615  -3.253   6.193
  286   2HE2  GLN  39          HE22      GLN  39 -17.626  -4.168   5.123
  287    H    VAL  40           HN       VAL  40 -12.822   1.079   2.361
  288    HA   VAL  40           HA       VAL  40 -12.224   0.204  -0.384
  289    HB   VAL  40           HB       VAL  40 -11.245   2.677   1.066
  290   1HG1  VAL  40          HG11      VAL  40 -10.745   1.760  -1.768
  291   2HG1  VAL  40          HG12      VAL  40  -9.556   1.795  -0.466
  292   3HG1  VAL  40          HG13      VAL  40 -10.234   3.303  -1.080
  293   1HG2  VAL  40          HG21      VAL  40 -13.601   2.809   0.389
  294   2HG2  VAL  40          HG22      VAL  40 -13.142   2.409  -1.265
  295   3HG2  VAL  40          HG23      VAL  40 -12.595   3.921  -0.540
  296    H    ALA  41           HN       ALA  41 -10.387  -0.956  -0.709
  297    HA   ALA  41           HA       ALA  41  -8.488  -1.185   1.496
  298   1HB   ALA  41          HB1       ALA  41  -9.755  -3.510   0.060
  299   2HB   ALA  41          HB2       ALA  41 -10.080  -3.023   1.724
  300   3HB   ALA  41          HB3       ALA  41  -8.479  -3.614   1.275
  301    H    LEU  42           HN       LEU  42  -6.419  -1.487   0.872
  302    HA   LEU  42           HA       LEU  42  -5.919  -1.397  -2.018
  303   1HB   LEU  42          HB2       LEU  42  -3.945  -0.865   0.188
  304   2HB   LEU  42          HB1       LEU  42  -3.844  -0.372  -1.494
  305    HG   LEU  42           HG       LEU  42  -5.876   0.669   0.473
  306   1HD1  LEU  42          HD11      LEU  42  -4.563   2.744   0.437
  307   2HD1  LEU  42          HD12      LEU  42  -3.336   1.939  -0.541
  308   3HD1  LEU  42          HD13      LEU  42  -3.648   1.393   1.107
  309   1HD2  LEU  42          HD21      LEU  42  -6.622   0.725  -1.854
  310   2HD2  LEU  42          HD22      LEU  42  -5.151   1.584  -2.311
  311   3HD2  LEU  42          HD23      LEU  42  -6.324   2.352  -1.240
  312    H    LYS  43           HN       LYS  43  -4.360  -2.758  -2.954
  313    HA   LYS  43           HA       LYS  43  -3.372  -4.973  -1.294
  314   1HB   LYS  43          HB2       LYS  43  -4.424  -5.409  -4.099
  315   2HB   LYS  43          HB1       LYS  43  -3.935  -6.630  -2.936
  316   1HG   LYS  43          HG2       LYS  43  -6.247  -6.773  -2.882
  317   2HG   LYS  43          HG1       LYS  43  -5.892  -5.712  -1.517
  318   1HD   LYS  43          HD2       LYS  43  -6.298  -3.758  -2.987
  319   2HD   LYS  43          HD1       LYS  43  -6.768  -4.868  -4.276
  320   1HE   LYS  43          HE2       LYS  43  -8.647  -3.870  -2.936
  321   2HE   LYS  43          HE1       LYS  43  -8.634  -5.635  -3.058
  322   1HZ   LYS  43          HZ1       LYS  43  -7.585  -4.075  -0.766
  323   2HZ   LYS  43          HZ2       LYS  43  -7.662  -5.762  -0.875
  324   3HZ   LYS  43          HZ3       LYS  43  -9.087  -4.852  -0.805
  325    H    ALA  44           HN       ALA  44  -1.394  -5.835  -2.057
  326    HA   ALA  44           HA       ALA  44   0.054  -4.038  -3.818
  327   1HB   ALA  44          HB1       ALA  44   1.186  -4.759  -1.818
  328   2HB   ALA  44          HB2       ALA  44   2.008  -5.437  -3.225
  329   3HB   ALA  44          HB3       ALA  44   0.945  -6.452  -2.247
  330    H    ASP  45           HN       ASP  45   1.228  -4.855  -5.665
  331    HA   ASP  45           HA       ASP  45  -0.307  -6.893  -7.070
  332   1HB   ASP  45          HB2       ASP  45   0.482  -4.613  -8.065
  333   2HB   ASP  45          HB1       ASP  45   2.035  -5.423  -8.253
  334    H    THR  46           HN       THR  46   1.228  -8.303  -8.557
  335    HA   THR  46           HA       THR  46   2.141 -10.306  -6.941
  336    HB   THR  46           HB       THR  46   3.297 -11.091  -9.055
  337    HG1  THR  46           HG1      THR  46   2.080  -8.706 -10.061
  338   1HG2  THR  46          HG21      THR  46   1.025 -11.768  -8.474
  339   2HG2  THR  46          HG22      THR  46   1.171 -11.513 -10.213
  340   3HG2  THR  46          HG23      THR  46   0.391 -10.294  -9.205
  341    H    ASP  47           HN       ASP  47   3.928  -7.492  -7.959
  342    HA   ASP  47           HA       ASP  47   6.544  -8.553  -7.779
  343   1HB   ASP  47          HB2       ASP  47   5.687  -5.686  -7.320
  344   2HB   ASP  47          HB1       ASP  47   7.308  -6.242  -7.723
  345    H    ASN  48           HN       ASN  48   4.383  -7.103  -5.402
  346    HA   ASN  48           HA       ASN  48   6.365  -7.702  -3.320
  347   1HB   ASN  48          HB2       ASN  48   5.827  -5.608  -2.166
  348   2HB   ASN  48          HB1       ASN  48   6.460  -5.277  -3.775
  349   1HD2  ASN  48          HD21      ASN  48   4.767  -3.700  -1.957
  350   2HD2  ASN  48          HD22      ASN  48   3.354  -3.299  -2.870
  351    H    PHE  49           HN       PHE  49   3.712  -8.862  -4.357
  352    HA   PHE  49           HA       PHE  49   2.402  -9.027  -1.711
  353   1HB   PHE  49          HB2       PHE  49   1.089  -7.860  -3.523
  354   2HB   PHE  49          HB1       PHE  49   1.079  -9.370  -4.407
  355    HD1  PHE  49           HD1      PHE  49   0.019  -7.877  -1.149
  356    HD2  PHE  49           HD2      PHE  49  -0.668 -10.845  -4.127
  357    HE1  PHE  49           HE1      PHE  49  -2.119  -8.445  -0.088
  358    HE2  PHE  49           HE2      PHE  49  -2.807 -11.422  -3.057
  359    HZ   PHE  49           HZ       PHE  49  -3.550 -10.207  -1.046
  360    H    GLU  50           HN       GLU  50   3.273 -10.881  -0.943
  361    HA   GLU  50           HA       GLU  50   3.199 -13.233  -2.698
  362   1HB   GLU  50          HB2       GLU  50   4.738 -14.231  -0.887
  363   2HB   GLU  50          HB1       GLU  50   5.410 -13.039  -1.987
  364   1HG   GLU  50          HG2       GLU  50   5.178 -11.316  -0.284
  365   2HG   GLU  50          HG1       GLU  50   4.456 -12.487   0.814
  366    H    GLN  51           HN       GLN  51   1.215 -13.992  -2.501
  367    HA   GLN  51           HA       GLN  51  -0.435 -15.308  -1.693
  368   1HB   GLN  51          HB2       GLN  51   1.308 -16.531  -0.448
  369   2HB   GLN  51          HB1       GLN  51   1.137 -15.399   0.887
  370   1HG   GLN  51          HG2       GLN  51  -0.043 -17.456   1.352
  371   2HG   GLN  51          HG1       GLN  51  -1.176 -16.114   1.203
  372   1HE2  GLN  51          HE21      GLN  51  -2.899 -17.448   0.726
  373   2HE2  GLN  51          HE22      GLN  51  -3.052 -18.261  -0.796
  374    H    GLY  52           HN       GLY  52   0.673 -12.983   0.745
  375   1HA   GLY  52          HA2       GLY  52  -1.606 -11.373   0.607
  376   2HA   GLY  52          HA1       GLY  52  -1.850 -12.523   1.918
  377    H    LYS  53           HN       LYS  53   1.199 -11.123   0.889
  378    HA   LYS  53           HA       LYS  53   1.225  -9.367   3.242
  379   1HB   LYS  53          HB2       LYS  53   3.621 -10.982   2.372
  380   2HB   LYS  53          HB1       LYS  53   3.494  -9.960   3.784
  381   1HG   LYS  53          HG2       LYS  53   1.919 -12.491   3.401
  382   2HG   LYS  53          HG1       LYS  53   3.463 -12.402   4.248
  383   1HD   LYS  53          HD2       LYS  53   2.381 -10.651   5.730
  384   2HD   LYS  53          HD1       LYS  53   0.844 -11.126   5.004
  385   1HE   LYS  53          HE2       LYS  53   1.128 -12.310   7.078
  386   2HE   LYS  53          HE1       LYS  53   1.270 -13.455   5.747
  387   1HZ   LYS  53          HZ1       LYS  53   3.666 -12.198   6.938
  388   2HZ   LYS  53          HZ2       LYS  53   3.558 -13.642   6.054
  389   3HZ   LYS  53          HZ3       LYS  53   2.969 -13.572   7.640
  390    H    PHE  54           HN       PHE  54   1.984  -7.343   2.712
  391    HA   PHE  54           HA       PHE  54   3.400  -7.138   0.157
  392   1HB   PHE  54          HB2       PHE  54   2.606  -4.727   0.100
  393   2HB   PHE  54          HB1       PHE  54   1.424  -5.979  -0.222
  394    HD1  PHE  54           HD1      PHE  54  -0.593  -5.039   0.306
  395    HD2  PHE  54           HD2      PHE  54   2.627  -4.670   3.069
  396    HE1  PHE  54           HE1      PHE  54  -2.125  -4.025   1.944
  397    HE2  PHE  54           HE2      PHE  54   1.095  -3.662   4.714
  398    HZ   PHE  54           HZ       PHE  54  -1.280  -3.347   4.151
  399    H    PHE  55           HN       PHE  55   5.047  -5.627  -0.078
  400    HA   PHE  55           HA       PHE  55   6.307  -4.492   2.252
  401   1HB   PHE  55          HB2       PHE  55   8.409  -5.878   1.894
  402   2HB   PHE  55          HB1       PHE  55   7.065  -6.739   2.628
  403    HD1  PHE  55           HD1      PHE  55   9.341  -6.563  -0.144
  404    HD2  PHE  55           HD2      PHE  55   5.695  -8.287   1.204
  405    HE1  PHE  55           HE1      PHE  55   9.502  -8.281  -1.902
  406    HE2  PHE  55           HE2      PHE  55   5.848 -10.003  -0.546
  407    HZ   PHE  55           HZ       PHE  55   7.752 -10.005  -2.098
  408    H    LEU  56           HN       LEU  56   8.637  -3.791   1.560
  409    HA   LEU  56           HA       LEU  56   8.530  -2.652  -1.130
  410   1HB   LEU  56          HB2       LEU  56  10.720  -2.306   0.917
  411   2HB   LEU  56          HB1       LEU  56  10.397  -1.309  -0.482
  412    HG   LEU  56           HG       LEU  56   8.599  -1.495   1.932
  413   1HD1  LEU  56          HD11      LEU  56  10.746  -0.441   2.461
  414   2HD1  LEU  56          HD12      LEU  56   9.419   0.722   2.492
  415   3HD1  LEU  56          HD13      LEU  56  10.521   0.678   1.115
  416   1HD2  LEU  56          HD21      LEU  56   7.505   0.462   0.953
  417   2HD2  LEU  56          HD22      LEU  56   7.398  -0.941  -0.109
  418   3HD2  LEU  56          HD23      LEU  56   8.557   0.341  -0.456
  419    H    ILE  57           HN       ILE  57   9.245  -3.989  -2.702
  420    HA   ILE  57           HA       ILE  57  11.547  -5.704  -2.070
  421    HB   ILE  57           HB       ILE  57   9.550  -6.925  -2.860
  422   1HG1  ILE  57          HG12      ILE  57  10.678  -8.190  -4.703
  423   2HG1  ILE  57          HG11      ILE  57  11.917  -6.940  -4.739
  424   1HG2  ILE  57          HG21      ILE  57   8.813  -6.734  -5.178
  425   2HG2  ILE  57          HG22      ILE  57   9.934  -5.393  -5.421
  426   3HG2  ILE  57          HG23      ILE  57   8.587  -5.225  -4.295
  427   1HD1  ILE  57          HD11      ILE  57  12.501  -7.467  -2.423
  428   2HD1  ILE  57          HD12      ILE  57  12.676  -8.861  -3.489
  429   3HD1  ILE  57          HD13      ILE  57  11.281  -8.742  -2.415
  430    H    SER  58           HN       SER  58  13.372  -5.605  -3.315
  431    HA   SER  58           HA       SER  58  13.799  -3.090  -4.632
  432   1HB   SER  58          HB2       SER  58  15.513  -4.065  -3.154
  433   2HB   SER  58          HB1       SER  58  15.666  -5.442  -4.242
  434    HG   SER  58           HG       SER  58  16.066  -2.784  -5.128
  435    H    ASP  59           HN       ASP  59  14.616  -2.846  -6.758
  436    HA   ASP  59           HA       ASP  59  13.293  -4.153  -8.804
  437   1HB   ASP  59          HB2       ASP  59  14.265  -2.002  -9.183
  438   2HB   ASP  59          HB1       ASP  59  15.875  -2.587  -8.782
  439    H    ASN  60           HN       ASN  60  16.238  -5.050  -7.171
  440    HA   ASN  60           HA       ASN  60  16.601  -7.262  -9.076
  441   1HB   ASN  60          HB2       ASN  60  18.582  -5.996  -7.176
  442   2HB   ASN  60          HB1       ASN  60  18.910  -7.451  -8.112
  443   1HD2  ASN  60          HD21      ASN  60  18.608  -4.024  -8.173
  444   2HD2  ASN  60          HD22      ASN  60  19.105  -3.787  -9.809
  445    H    ASN  61           HN       ASN  61  14.882  -6.861  -6.522
  446    HA   ASN  61           HA       ASN  61  14.119  -8.091  -4.771
  447   1HB   ASN  61          HB2       ASN  61  15.076 -10.241  -6.650
  448   2HB   ASN  61          HB1       ASN  61  14.237 -10.617  -5.149
  449   1HD2  ASN  61          HD21      ASN  61  12.471 -11.522  -6.172
  450   2HD2  ASN  61          HD22      ASN  61  11.320 -10.572  -7.057
  451    H    ARG  62           HN       ARG  62  16.817  -7.127  -4.401
  452    HA   ARG  62           HA       ARG  62  18.343  -9.263  -3.237
  453   1HB   ARG  62          HB2       ARG  62  19.904  -7.463  -2.529
  454   2HB   ARG  62          HB1       ARG  62  19.558  -7.456  -4.251
  455   1HG   ARG  62          HG2       ARG  62  18.400  -5.486  -4.157
  456   2HG   ARG  62          HG1       ARG  62  17.933  -5.715  -2.469
  457   1HD   ARG  62          HD2       ARG  62  20.754  -5.163  -3.376
  458   2HD   ARG  62          HD1       ARG  62  19.629  -3.910  -2.850
  459    HE   ARG  62           HE       ARG  62  19.572  -5.071  -0.673
  460   1HH1  ARG  62          HH11      ARG  62  22.245  -5.666  -2.839
  461   2HH1  ARG  62          HH12      ARG  62  23.346  -6.103  -1.572
  462   1HH2  ARG  62          HH21      ARG  62  21.014  -5.677   1.008
  463   2HH2  ARG  62          HH22      ARG  62  22.652  -6.100   0.613
  464    H    ASP  63           HN       ASP  63  16.014  -6.985  -2.074
  465    HA   ASP  63           HA       ASP  63  16.248  -8.047   0.620
  466   1HB   ASP  63          HB2       ASP  63  17.824  -6.053   0.429
  467   2HB   ASP  63          HB1       ASP  63  16.401  -5.058   0.157
  468    H    LYS  64           HN       LYS  64  14.301  -7.999   1.689
  469    HA   LYS  64           HA       LYS  64  12.125  -6.451   0.468
  470   1HB   LYS  64          HB2       LYS  64  10.571  -8.245   0.687
  471   2HB   LYS  64          HB1       LYS  64  11.980  -8.908  -0.118
  472   1HG   LYS  64          HG2       LYS  64  11.803 -10.565   1.364
  473   2HG   LYS  64          HG1       LYS  64  12.530  -9.433   2.505
  474   1HD   LYS  64          HD2       LYS  64  10.607 -10.253   3.604
  475   2HD   LYS  64          HD1       LYS  64  10.150  -8.659   3.007
  476   1HE   LYS  64          HE2       LYS  64   8.364 -10.226   2.586
  477   2HE   LYS  64          HE1       LYS  64   9.076  -9.704   1.061
  478   1HZ   LYS  64          HZ1       LYS  64   9.588 -12.286   2.446
  479   2HZ   LYS  64          HZ2       LYS  64  10.354 -11.784   1.021
  480   3HZ   LYS  64          HZ3       LYS  64   8.679 -12.064   1.028
  481    H    LEU  65           HN       LEU  65  10.956  -5.280   1.880
  482    HA   LEU  65           HA       LEU  65  11.068  -5.986   4.713
  483   1HB   LEU  65          HB2       LEU  65  11.522  -3.663   5.355
  484   2HB   LEU  65          HB1       LEU  65  12.839  -4.402   4.479
  485    HG   LEU  65           HG       LEU  65  10.882  -2.647   3.041
  486   1HD1  LEU  65          HD11      LEU  65  11.664  -1.399   5.003
  487   2HD1  LEU  65          HD12      LEU  65  12.316  -0.739   3.502
  488   3HD1  LEU  65          HD13      LEU  65  13.332  -1.737   4.545
  489   1HD2  LEU  65          HD21      LEU  65  12.826  -2.238   1.610
  490   2HD2  LEU  65          HD22      LEU  65  12.458  -3.958   1.713
  491   3HD2  LEU  65          HD23      LEU  65  13.802  -3.289   2.635
  492    H    TYR  66           HN       TYR  66   9.166  -5.857   5.670
  493    HA   TYR  66           HA       TYR  66   6.885  -5.321   4.068
  494   1HB   TYR  66          HB2       TYR  66   7.077  -5.902   7.028
  495   2HB   TYR  66          HB1       TYR  66   5.593  -5.910   6.086
  496    HD1  TYR  66           HD1      TYR  66   8.743  -7.682   6.753
  497    HD2  TYR  66           HD2      TYR  66   5.076  -7.746   4.588
  498    HE1  TYR  66           HE1      TYR  66   9.108 -10.048   6.215
  499    HE2  TYR  66           HE2      TYR  66   5.437 -10.115   4.045
  500    HH   TYR  66           HH       TYR  66   7.739 -12.021   5.610
  501    H    VAL  67           HN       VAL  67   5.372  -3.747   4.184
  502    HA   VAL  67           HA       VAL  67   5.855  -1.466   5.969
  503    HB   VAL  67           HB       VAL  67   5.166   0.057   4.106
  504   1HG1  VAL  67          HG11      VAL  67   7.726  -1.487   3.725
  505   2HG1  VAL  67          HG12      VAL  67   7.484  -0.110   4.799
  506   3HG1  VAL  67          HG13      VAL  67   7.380   0.105   3.053
  507   1HG2  VAL  67          HG21      VAL  67   5.703  -2.374   2.398
  508   2HG2  VAL  67          HG22      VAL  67   5.429  -0.737   1.801
  509   3HG2  VAL  67          HG23      VAL  67   4.138  -1.597   2.639
  510    H    ASN  68           HN       ASN  68   3.905   0.029   5.928
  511    HA   ASN  68           HA       ASN  68   1.435  -1.457   5.381
  512   1HB   ASN  68          HB2       ASN  68   0.434  -0.399   7.437
  513   2HB   ASN  68          HB1       ASN  68   1.664  -1.614   7.760
  514   1HD2  ASN  68          HD21      ASN  68   3.589  -1.009   8.691
  515   2HD2  ASN  68          HD22      ASN  68   3.851   0.550   9.382
  516    H    ILE  69           HN       ILE  69   0.020  -0.377   4.199
  517    HA   ILE  69           HA       ILE  69   0.582   2.386   3.505
  518    HB   ILE  69           HB       ILE  69  -1.867   0.981   2.523
  519   1HG1  ILE  69          HG12      ILE  69   0.904   0.420   1.437
  520   2HG1  ILE  69          HG11      ILE  69  -0.025  -0.705   2.419
  521   1HG2  ILE  69          HG21      ILE  69  -1.389   3.286   1.868
  522   2HG2  ILE  69          HG22      ILE  69  -1.340   2.202   0.477
  523   3HG2  ILE  69          HG23      ILE  69   0.162   2.781   1.198
  524   1HD1  ILE  69          HD11      ILE  69  -1.751  -0.779   0.693
  525   2HD1  ILE  69          HD12      ILE  69  -0.175  -1.275   0.072
  526   3HD1  ILE  69          HD13      ILE  69  -0.804   0.332  -0.296
  527    H    ARG  70           HN       ARG  70   0.116   3.450   5.403
  528    HA   ARG  70           HA       ARG  70  -2.578   3.089   6.520
  529   1HB   ARG  70          HB2       ARG  70  -1.036   2.422   8.145
  530   2HB   ARG  70          HB1       ARG  70   0.101   3.688   7.730
  531   1HG   ARG  70          HG2       ARG  70  -1.222   5.336   8.848
  532   2HG   ARG  70          HG1       ARG  70  -2.536   4.181   9.092
  533   1HD   ARG  70          HD2       ARG  70  -0.852   4.687  11.032
  534   2HD   ARG  70          HD1       ARG  70  -1.412   3.040  10.747
  535    HE   ARG  70           HE       ARG  70   0.829   3.130   9.267
  536   1HH1  ARG  70          HH11      ARG  70   0.223   4.097  12.590
  537   2HH1  ARG  70          HH12      ARG  70   1.828   3.677  13.119
  538   1HH2  ARG  70          HH21      ARG  70   2.916   2.583   9.982
  539   2HH2  ARG  70          HH22      ARG  70   3.351   2.820  11.645
  540    HA   PRO  71           HA       PRO  71  -3.710   7.173   5.268
  541   1HB   PRO  71          HB2       PRO  71  -5.015   7.302   7.939
  542   2HB   PRO  71          HB1       PRO  71  -5.680   7.615   6.332
  543   1HG   PRO  71          HG2       PRO  71  -6.246   5.359   7.649
  544   2HG   PRO  71          HG1       PRO  71  -6.036   5.381   5.888
  545   1HD   PRO  71          HD2       PRO  71  -4.197   4.383   8.006
  546   2HD   PRO  71          HD1       PRO  71  -4.441   3.796   6.350
  547    H    MET  72           HN       MET  72  -2.736   9.081   5.422
  548    HA   MET  72           HA       MET  72  -0.583   9.505   7.148
  549   1HB   MET  72          HB2       MET  72  -0.947  10.626   4.931
  550   2HB   MET  72          HB1       MET  72  -2.166  11.635   5.695
  551   1HG   MET  72          HG2       MET  72   0.665  11.543   6.681
  552   2HG   MET  72          HG1       MET  72   0.162  12.610   5.374
  553   1HE   MET  72          HE1       MET  72  -2.394  14.969   7.153
  554   2HE   MET  72          HE2       MET  72  -2.780  13.479   6.292
  555   3HE   MET  72          HE3       MET  72  -1.563  14.579   5.647
  556    H    ASP  73           HN       ASP  73  -3.705  11.189   7.118
  557    HA   ASP  73           HA       ASP  73  -4.201  10.862   9.870
  558   1HB   ASP  73          HB2       ASP  73  -2.436  12.535  10.174
  559   2HB   ASP  73          HB1       ASP  73  -3.252  13.618   9.049
  560    H    ASN  74           HN       ASN  74  -6.288  10.457   9.529
  561    HA   ASN  74           HA       ASN  74  -8.143  12.424   8.854
  562   1HB   ASN  74          HB2       ASN  74  -8.896  11.508   6.610
  563   2HB   ASN  74          HB1       ASN  74  -7.397  12.428   6.608
  564   1HD2  ASN  74          HD21      ASN  74  -6.475  11.544   4.839
  565   2HD2  ASN  74          HD22      ASN  74  -5.999   9.881   4.728
  566    H    SER  75           HN       SER  75  -7.381   9.003   9.022
  567    HA   SER  75           HA       SER  75  -9.800   8.477  10.461
  568   1HB   SER  75          HB2       SER  75 -10.606   6.745   8.792
  569   2HB   SER  75          HB1       SER  75 -10.799   8.423   8.281
  570    HG   SER  75           HG       SER  75  -8.547   7.979   7.333
  571    H    ALA  76           HN       ALA  76 -10.025   5.956  10.678
  572    HA   ALA  76           HA       ALA  76  -7.334   4.810  11.010
  573   1HB   ALA  76          HB1       ALA  76  -9.834   4.256  12.608
  574   2HB   ALA  76          HB2       ALA  76  -8.432   5.179  13.149
  575   3HB   ALA  76          HB3       ALA  76  -8.280   3.451  12.827
  576    H    TRP  77           HN       TRP  77  -6.895   2.969   9.978
  577    HA   TRP  77           HA       TRP  77  -9.105   1.568   8.622
  578   1HB   TRP  77          HB2       TRP  77  -6.322   2.226   7.683
  579   2HB   TRP  77          HB1       TRP  77  -7.221   0.891   6.975
  580    HD1  TRP  77           HD1      TRP  77  -8.844   4.302   7.833
  581    HE1  TRP  77           HE1      TRP  77  -9.642   5.378   5.623
  582    HE3  TRP  77           HE3      TRP  77  -6.860   0.946   4.519
  583    HZ2  TRP  77           HZ2      TRP  77  -9.445   4.865   2.863
  584    HZ3  TRP  77           HZ3      TRP  77  -7.215   1.316   2.113
  585    HH2  TRP  77           HH2      TRP  77  -8.476   3.237   1.307
  586    H    THR  78           HN       THR  78  -8.946  -0.708   8.474
  587    HA   THR  78           HA       THR  78  -7.520  -1.962  10.642
  588    HB   THR  78           HB       THR  78  -9.237  -3.166   8.457
  589    HG1  THR  78           HG1      THR  78  -9.773  -2.422  11.160
  590   1HG2  THR  78          HG21      THR  78  -9.348  -5.146   9.905
  591   2HG2  THR  78          HG22      THR  78  -8.204  -4.395  11.019
  592   3HG2  THR  78          HG23      THR  78  -7.696  -4.821   9.383
  593    H    THR  79           HN       THR  79  -5.449  -2.503  10.464
  594    HA   THR  79           HA       THR  79  -4.276  -2.728   7.828
  595    HB   THR  79           HB       THR  79  -3.047  -1.375   9.368
  596    HG1  THR  79           HG1      THR  79  -1.884  -2.898   7.927
  597   1HG2  THR  79          HG21      THR  79  -3.818  -2.338  11.478
  598   2HG2  THR  79          HG22      THR  79  -2.057  -2.252  11.431
  599   3HG2  THR  79          HG23      THR  79  -2.871  -3.794  11.170
  600    H    ASP  80           HN       ASP  80  -4.383  -4.551   6.824
  601    HA   ASP  80           HA       ASP  80  -3.433  -6.967   8.216
  602   1HB   ASP  80          HB2       ASP  80  -5.715  -7.113   7.110
  603   2HB   ASP  80          HB1       ASP  80  -4.908  -6.840   5.569
  604    H    ASN  81           HN       ASN  81  -1.947  -8.310   6.733
  605    HA   ASN  81           HA       ASN  81  -0.017  -6.425   5.684
  606   1HB   ASN  81          HB2       ASN  81   0.383  -8.708   7.029
  607   2HB   ASN  81          HB1       ASN  81   0.458  -9.344   5.392
  608   1HD2  ASN  81          HD21      ASN  81   1.526  -6.760   4.379
  609   2HD2  ASN  81          HD22      ASN  81   3.192  -6.745   4.857
  610    H    GLY  82           HN       GLY  82  -2.540  -8.368   4.451
  611   1HA   GLY  82          HA2       GLY  82  -1.406  -8.288   1.746
  612   2HA   GLY  82          HA1       GLY  82  -2.804  -9.225   2.250
  613    H    VAL  83           HN       VAL  83  -4.112  -7.084   3.639
  614    HA   VAL  83           HA       VAL  83  -4.743  -5.265   1.424
  615    HB   VAL  83           HB       VAL  83  -7.148  -5.445   1.943
  616   1HG1  VAL  83          HG11      VAL  83  -5.837  -8.048   1.159
  617   2HG1  VAL  83          HG12      VAL  83  -6.251  -6.716   0.080
  618   3HG1  VAL  83          HG13      VAL  83  -7.528  -7.634   0.880
  619   1HG2  VAL  83          HG21      VAL  83  -6.997  -6.235   4.241
  620   2HG2  VAL  83          HG22      VAL  83  -6.311  -7.763   3.687
  621   3HG2  VAL  83          HG23      VAL  83  -7.973  -7.340   3.273
  622    H    PHE  84           HN       PHE  84  -5.835  -3.303   2.096
  623    HA   PHE  84           HA       PHE  84  -5.613  -2.737   4.968
  624   1HB   PHE  84          HB2       PHE  84  -3.684  -1.880   3.239
  625   2HB   PHE  84          HB1       PHE  84  -4.811  -0.533   3.160
  626    HD1  PHE  84           HD1      PHE  84  -5.659   0.282   5.563
  627    HD2  PHE  84           HD2      PHE  84  -2.036  -1.802   4.785
  628    HE1  PHE  84           HE1      PHE  84  -4.693   1.172   7.646
  629    HE2  PHE  84           HE2      PHE  84  -1.069  -0.917   6.860
  630    HZ   PHE  84           HZ       PHE  84  -2.398   0.575   8.296
  631    H    TYR  85           HN       TYR  85  -7.711  -2.360   5.461
  632    HA   TYR  85           HA       TYR  85  -9.194  -0.545   3.701
  633   1HB   TYR  85          HB2       TYR  85 -11.203  -1.917   3.798
  634   2HB   TYR  85          HB1       TYR  85  -9.891  -2.804   3.046
  635    HD1  TYR  85           HD1      TYR  85 -12.542  -3.066   5.237
  636    HD2  TYR  85           HD2      TYR  85  -8.475  -4.249   4.857
  637    HE1  TYR  85           HE1      TYR  85 -12.955  -4.953   6.761
  638    HE2  TYR  85           HE2      TYR  85  -8.878  -6.144   6.379
  639    HH   TYR  85           HH       TYR  85 -10.495  -6.759   8.185
  640    H    LYS  86           HN       LYS  86 -10.661   0.748   4.656
  641    HA   LYS  86           HA       LYS  86 -10.422   1.126   7.476
  642   1HB   LYS  86          HB2       LYS  86 -12.133   2.908   7.118
  643   2HB   LYS  86          HB1       LYS  86 -10.713   3.073   6.104
  644   1HG   LYS  86          HG2       LYS  86 -11.875   2.405   4.174
  645   2HG   LYS  86          HG1       LYS  86 -13.225   1.761   5.113
  646   1HD   LYS  86          HD2       LYS  86 -13.722   4.055   5.890
  647   2HD   LYS  86          HD1       LYS  86 -12.436   4.658   4.850
  648   1HE   LYS  86          HE2       LYS  86 -14.653   3.008   3.687
  649   2HE   LYS  86          HE1       LYS  86 -14.903   4.719   4.042
  650   1HZ   LYS  86          HZ1       LYS  86 -12.800   3.611   2.280
  651   2HZ   LYS  86          HZ2       LYS  86 -13.024   5.248   2.642
  652   3HZ   LYS  86          HZ3       LYS  86 -14.211   4.406   1.780
  653    H    ASN  87           HN       ASN  87 -12.014   0.857   9.048
  654    HA   ASN  87           HA       ASN  87 -13.937  -1.231   8.612
  655   1HB   ASN  87          HB2       ASN  87 -12.744  -0.853  10.788
  656   2HB   ASN  87          HB1       ASN  87 -13.653   0.639  10.985
  657   1HD2  ASN  87          HD21      ASN  87 -13.770  -2.829  11.056
  658   2HD2  ASN  87          HD22      ASN  87 -15.328  -2.957  11.806
  659    H    ASP  88           HN       ASP  88 -13.807   2.099   8.207
  660    HA   ASP  88           HA       ASP  88 -16.606   2.693   8.433
  661   1HB   ASP  88          HB2       ASP  88 -14.965   4.439   8.830
  662   2HB   ASP  88          HB1       ASP  88 -14.283   4.219   7.223
  663    H    VAL  89           HN       VAL  89 -17.970   3.270   6.657
  664    HA   VAL  89           HA       VAL  89 -17.083   2.210   4.061
  665    HB   VAL  89           HB       VAL  89 -19.418   1.587   3.543
  666   1HG1  VAL  89          HG11      VAL  89 -17.898  -0.100   4.401
  667   2HG1  VAL  89          HG12      VAL  89 -19.537  -0.392   4.974
  668   3HG1  VAL  89          HG13      VAL  89 -18.340   0.316   6.057
  669   1HG2  VAL  89          HG21      VAL  89 -19.956   2.270   6.437
  670   2HG2  VAL  89          HG22      VAL  89 -21.081   1.460   5.347
  671   3HG2  VAL  89          HG23      VAL  89 -20.589   3.124   5.031
  672    H    GLY  90           HN       GLY  90 -17.275   3.538   2.355
  673   1HA   GLY  90          HA2       GLY  90 -18.879   5.456   1.567
  674   2HA   GLY  90          HA1       GLY  90 -18.161   6.268   2.953
  675    H    SER  91           HN       SER  91 -17.847   7.460   0.568
  676    HA   SER  91           HA       SER  91 -15.475   6.775  -0.792
  677   1HB   SER  91          HB2       SER  91 -15.550   9.205  -1.538
  678   2HB   SER  91          HB1       SER  91 -16.999   8.262  -1.882
  679    HG   SER  91           HG       SER  91 -17.892   9.173   0.077
  680    H    TRP  92           HN       TRP  92 -13.419   6.995  -0.202
  681    HA   TRP  92           HA       TRP  92 -12.878   8.165   2.411
  682   1HB   TRP  92          HB2       TRP  92 -12.136   5.847   1.821
  683   2HB   TRP  92          HB1       TRP  92 -11.002   6.589   0.680
  684    HD1  TRP  92           HD1      TRP  92 -11.806   6.656   4.469
  685    HE1  TRP  92           HE1      TRP  92  -9.625   7.232   5.711
  686    HE3  TRP  92           HE3      TRP  92  -8.831   7.421   0.437
  687    HZ2  TRP  92           HZ2      TRP  92  -6.956   7.925   5.020
  688    HZ3  TRP  92           HZ3      TRP  92  -6.515   8.045   0.782
  689    HH2  TRP  92           HH2      TRP  92  -5.567   8.285   3.025
  690    H    GLY  93           HN       GLY  93 -11.619   8.267  -0.861
  691   1HA   GLY  93          HA2       GLY  93 -10.047   9.707  -1.824
  692   2HA   GLY  93          HA1       GLY  93 -11.374  10.792  -1.514
  693    H    GLY  94           HN       GLY  94  -8.267   9.659  -0.327
  694   1HA   GLY  94          HA2       GLY  94  -7.686  12.290   0.693
  695   2HA   GLY  94          HA1       GLY  94  -7.849  11.072   1.950
  696    H    THR  95           HN       THR  95  -5.655  11.232   2.557
  697    HA   THR  95           HA       THR  95  -3.801  10.126   0.560
  698    HB   THR  95           HB       THR  95  -2.001  11.399   1.844
  699    HG1  THR  95           HG1      THR  95  -2.624  13.008   3.185
  700   1HG2  THR  95          HG21      THR  95  -4.082  12.947   0.298
  701   2HG2  THR  95          HG22      THR  95  -2.710  12.072  -0.382
  702   3HG2  THR  95          HG23      THR  95  -2.438  13.495   0.623
  703    H    ILE  96           HN       ILE  96  -3.005   8.233   1.058
  704    HA   ILE  96           HA       ILE  96  -2.484   7.594   3.882
  705    HB   ILE  96           HB       ILE  96  -2.158   5.213   3.081
  706   1HG1  ILE  96          HG12      ILE  96  -2.134   6.135   0.608
  707   2HG1  ILE  96          HG11      ILE  96  -2.721   4.520   0.978
  708   1HG2  ILE  96          HG21      ILE  96  -4.906   6.418   2.863
  709   2HG2  ILE  96          HG22      ILE  96  -4.125   5.810   4.322
  710   3HG2  ILE  96          HG23      ILE  96  -4.568   4.696   3.027
  711   1HD1  ILE  96          HD11      ILE  96  -4.434   6.958   0.577
  712   2HD1  ILE  96          HD12      ILE  96  -5.009   5.327   0.919
  713   3HD1  ILE  96          HD13      ILE  96  -4.174   5.667  -0.595
  714    H    GLY  97           HN       GLY  97  -0.403   6.167   4.071
  715   1HA   GLY  97          HA2       GLY  97   1.582   7.019   2.089
  716   2HA   GLY  97          HA1       GLY  97   1.826   7.478   3.768
  717    H    ILE  98           HN       ILE  98   3.603   5.898   2.253
  718    HA   ILE  98           HA       ILE  98   3.326   3.217   3.298
  719    HB   ILE  98           HB       ILE  98   5.369   4.563   1.546
  720   1HG1  ILE  98          HG12      ILE  98   4.816   2.548   0.106
  721   2HG1  ILE  98          HG11      ILE  98   3.545   2.178   1.274
  722   1HG2  ILE  98          HG21      ILE  98   6.656   3.237   3.149
  723   2HG2  ILE  98          HG22      ILE  98   6.711   2.517   1.542
  724   3HG2  ILE  98          HG23      ILE  98   5.669   1.824   2.783
  725   1HD1  ILE  98          HD11      ILE  98   2.658   3.329  -0.672
  726   2HD1  ILE  98          HD12      ILE  98   3.748   4.687  -0.381
  727   3HD1  ILE  98          HD13      ILE  98   2.475   4.312   0.780
  728    H    TYR  99           HN       TYR  99   3.707   2.913   5.348
  729    HA   TYR  99           HA       TYR  99   6.040   4.190   6.610
  730   1HB   TYR  99          HB2       TYR  99   3.806   2.712   8.022
  731   2HB   TYR  99          HB1       TYR  99   5.028   3.745   8.741
  732    HD1  TYR  99           HD1      TYR  99   4.469   5.904   9.311
  733    HD2  TYR  99           HD2      TYR  99   2.151   3.913   6.365
  734    HE1  TYR  99           HE1      TYR  99   2.884   7.774   9.310
  735    HE2  TYR  99           HE2      TYR  99   0.569   5.789   6.343
  736    HH   TYR  99           HH       TYR  99  -0.161   7.597   7.904
  737    H    VAL 100           HN       VAL 100   7.772   2.852   6.959
  738    HA   VAL 100           HA       VAL 100   7.577   0.089   6.257
  739    HB   VAL 100           HB       VAL 100   9.690   1.454   6.017
  740   1HG1  VAL 100          HG11      VAL 100   9.708   2.566   8.159
  741   2HG1  VAL 100          HG12      VAL 100  11.162   1.578   7.991
  742   3HG1  VAL 100          HG13      VAL 100   9.824   1.018   8.995
  743   1HG2  VAL 100          HG21      VAL 100   9.869  -1.132   7.551
  744   2HG2  VAL 100          HG22      VAL 100  11.172  -0.407   6.611
  745   3HG2  VAL 100          HG23      VAL 100   9.704  -0.960   5.804
  746    H    ASP 101           HN       ASP 101   7.404  -1.681   7.585
  747    HA   ASP 101           HA       ASP 101   6.068  -1.217  10.047
  748   1HB   ASP 101          HB2       ASP 101   5.652  -3.149   8.489
  749   2HB   ASP 101          HB1       ASP 101   7.165  -3.851   9.054
  750    H    GLY 102           HN       GLY 102   7.319  -0.223  11.554
  751   1HA   GLY 102          HA2       GLY 102   8.547  -0.307  13.491
  752   2HA   GLY 102          HA1       GLY 102   8.913  -1.985  13.136
  753    H    GLN 103           HN       GLN 103   9.732   0.441  10.765
  754    HA   GLN 103           HA       GLN 103  11.736   0.889   9.763
  755   1HB   GLN 103          HB2       GLN 103  11.865   2.278  11.881
  756   2HB   GLN 103          HB1       GLN 103  12.855   0.990  12.547
  757   1HG   GLN 103          HG2       GLN 103  14.456   1.304  10.698
  758   2HG   GLN 103          HG1       GLN 103  13.504   2.690  10.165
  759   1HE2  GLN 103          HE21      GLN 103  15.594   1.428  12.635
  760   2HE2  GLN 103          HE22      GLN 103  15.967   2.942  13.384
  761    H    GLN 104           HN       GLN 104  12.487  -0.821   8.660
  762    HA   GLN 104           HA       GLN 104  13.080  -3.287   9.926
  763   1HB   GLN 104          HB2       GLN 104  13.371  -2.276   7.109
  764   2HB   GLN 104          HB1       GLN 104  13.878  -3.897   7.573
  765   1HG   GLN 104          HG2       GLN 104  11.104  -2.806   7.975
  766   2HG   GLN 104          HG1       GLN 104  11.602  -3.766   6.585
  767   1HE2  GLN 104          HE21      GLN 104   9.612  -4.280   8.688
  768   2HE2  GLN 104          HE22      GLN 104  10.053  -5.803   9.381
  769    H    THR 105           HN       THR 105  15.136  -1.054   8.071
  770    HA   THR 105           HA       THR 105  17.488  -1.393   9.530
  771    HB   THR 105           HB       THR 105  17.260  -3.316   7.196
  772    HG1  THR 105           HG1      THR 105  16.905  -3.663   9.834
  773   1HG2  THR 105          HG21      THR 105  19.410  -2.212   7.162
  774   2HG2  THR 105          HG22      THR 105  19.598  -3.888   7.680
  775   3HG2  THR 105          HG23      THR 105  19.653  -2.587   8.868
  776    H    ASN 106           HN       ASN 106  16.378  -1.432   6.153
  777    HA   ASN 106           HA       ASN 106  16.963  -0.286   4.299
  778   1HB   ASN 106          HB2       ASN 106  16.727   1.801   5.582
  779   2HB   ASN 106          HB1       ASN 106  18.379   1.632   6.165
  780   1HD2  ASN 106          HD21      ASN 106  20.077   2.085   4.791
  781   2HD2  ASN 106          HD22      ASN 106  19.870   2.908   3.276
  782    H    THR 107           HN       THR 107  18.134  -2.231   3.911
  783    HA   THR 107           HA       THR 107  20.999  -2.219   4.338
  784    HB   THR 107           HB       THR 107  19.711  -4.163   2.480
  785    HG1  THR 107           HG1      THR 107  18.439  -5.030   3.946
  786   1HG2  THR 107          HG21      THR 107  22.082  -4.352   3.063
  787   2HG2  THR 107          HG22      THR 107  21.172  -5.740   3.661
  788   3HG2  THR 107          HG23      THR 107  21.657  -4.459   4.772
  789    HA   PRO 108           HA       PRO 108  22.339   0.481   1.168
  790   1HB   PRO 108          HB2       PRO 108  23.805  -1.963   0.255
  791   2HB   PRO 108          HB1       PRO 108  24.391  -0.306   0.442
  792   1HG   PRO 108          HG2       PRO 108  24.696  -2.331   2.318
  793   2HG   PRO 108          HG1       PRO 108  24.829  -0.598   2.651
  794   1HD   PRO 108          HD2       PRO 108  22.862  -2.396   3.645
  795   2HD   PRO 108          HD1       PRO 108  22.896  -0.633   3.834
  796    HA   PRO 109           HA       PRO 109  19.299  -1.292  -1.742
  797   1HB   PRO 109          HB2       PRO 109  17.940   1.203  -1.765
  798   2HB   PRO 109          HB1       PRO 109  17.468  -0.278  -0.934
  799   1HG   PRO 109          HG2       PRO 109  18.242   2.077   0.308
  800   2HG   PRO 109          HG1       PRO 109  18.231   0.478   1.066
  801   1HD   PRO 109          HD2       PRO 109  20.513   2.013  -0.089
  802   2HD   PRO 109          HD1       PRO 109  20.456   0.944   1.333
  803    H    GLY 110           HN       GLY 110  18.003   0.418  -3.429
  804   1HA   GLY 110          HA2       GLY 110  19.737   2.052  -4.969
  805   2HA   GLY 110          HA1       GLY 110  19.556   0.456  -5.696
  806    H    ASN 111           HN       ASN 111  17.436  -0.276  -6.245
  807    HA   ASN 111           HA       ASN 111  15.405   1.851  -6.381
  808   1HB   ASN 111          HB2       ASN 111  16.510   1.283  -8.615
  809   2HB   ASN 111          HB1       ASN 111  15.738  -0.294  -8.484
  810   1HD2  ASN 111          HD21      ASN 111  15.266   3.093  -8.987
  811   2HD2  ASN 111          HD22      ASN 111  13.625   3.005  -9.507
  812    H    TYR 112           HN       TYR 112  13.382   1.274  -5.771
  813    HA   TYR 112           HA       TYR 112  12.881  -1.556  -5.139
  814   1HB   TYR 112          HB2       TYR 112  12.484   0.889  -3.468
  815   2HB   TYR 112          HB1       TYR 112  11.334  -0.427  -3.297
  816    HD1  TYR 112           HD1      TYR 112  11.789  -2.115  -1.789
  817    HD2  TYR 112           HD2      TYR 112  15.015   0.198  -3.302
  818    HE1  TYR 112           HE1      TYR 112  13.325  -3.265  -0.255
  819    HE2  TYR 112           HE2      TYR 112  16.561  -0.951  -1.780
  820    HH   TYR 112           HH       TYR 112  15.595  -3.709   0.102
  821    H    THR 113           HN       THR 113  10.851  -2.329  -5.580
  822    HA   THR 113           HA       THR 113   9.051  -0.495  -7.021
  823    HB   THR 113           HB       THR 113   9.695  -3.359  -7.741
  824    HG1  THR 113           HG1      THR 113  10.921  -2.540  -9.332
  825   1HG2  THR 113          HG21      THR 113   7.367  -2.789  -8.228
  826   2HG2  THR 113          HG22      THR 113   8.292  -2.957  -9.719
  827   3HG2  THR 113          HG23      THR 113   7.892  -1.354  -9.108
  828    H    LEU 114           HN       LEU 114   7.264  -0.313  -5.824
  829    HA   LEU 114           HA       LEU 114   6.077  -2.795  -4.808
  830   1HB   LEU 114          HB2       LEU 114   5.058  -1.335  -2.975
  831   2HB   LEU 114          HB1       LEU 114   6.747  -1.778  -2.824
  832    HG   LEU 114           HG       LEU 114   6.115   0.826  -4.109
  833   1HD1  LEU 114          HD11      LEU 114   5.942   1.928  -1.943
  834   2HD1  LEU 114          HD12      LEU 114   6.004   0.364  -1.132
  835   3HD1  LEU 114          HD13      LEU 114   4.630   0.770  -2.158
  836   1HD2  LEU 114          HD21      LEU 114   8.251  -0.103  -2.196
  837   2HD2  LEU 114          HD22      LEU 114   8.163   1.492  -2.942
  838   3HD2  LEU 114          HD23      LEU 114   8.423   0.064  -3.943
  839    H    THR 115           HN       THR 115   4.846  -2.976  -6.649
  840    HA   THR 115           HA       THR 115   3.171  -0.900  -7.634
  841    HB   THR 115           HB       THR 115   2.703  -3.837  -8.112
  842    HG1  THR 115           HG1      THR 115   4.511  -3.982  -9.259
  843   1HG2  THR 115          HG21      THR 115   2.083  -3.052 -10.350
  844   2HG2  THR 115          HG22      THR 115   2.485  -1.398  -9.885
  845   3HG2  THR 115          HG23      THR 115   1.136  -2.229  -9.109
  846    H    LEU 116           HN       LEU 116   1.263  -0.238  -6.813
  847    HA   LEU 116           HA       LEU 116  -0.058  -2.016  -4.869
  848   1HB   LEU 116          HB2       LEU 116  -0.123   0.995  -5.062
  849   2HB   LEU 116          HB1       LEU 116  -1.015   0.042  -3.892
  850    HG   LEU 116           HG       LEU 116   1.992   0.235  -4.090
  851   1HD1  LEU 116          HD11      LEU 116   0.056   1.345  -2.064
  852   2HD1  LEU 116          HD12      LEU 116   0.975   2.274  -3.250
  853   3HD1  LEU 116          HD13      LEU 116   1.816   1.418  -1.956
  854   1HD2  LEU 116          HD21      LEU 116   0.262  -1.205  -2.082
  855   2HD2  LEU 116          HD22      LEU 116   2.017  -1.044  -2.014
  856   3HD2  LEU 116          HD23      LEU 116   1.267  -1.966  -3.315
  857    H    THR 117           HN       THR 117  -1.912  -2.844  -5.469
  858    HA   THR 117           HA       THR 117  -3.280  -1.770  -7.815
  859    HB   THR 117           HB       THR 117  -3.929  -4.288  -6.271
  860    HG1  THR 117           HG1      THR 117  -1.743  -3.813  -7.636
  861   1HG2  THR 117          HG21      THR 117  -4.602  -3.385  -9.076
  862   2HG2  THR 117          HG22      THR 117  -5.726  -3.529  -7.724
  863   3HG2  THR 117          HG23      THR 117  -4.975  -4.971  -8.404
  864    H    GLY 118           HN       GLY 118  -4.938  -0.443  -7.580
  865   1HA   GLY 118          HA2       GLY 118  -6.143   0.016  -5.015
  866   2HA   GLY 118          HA1       GLY 118  -6.584   0.785  -6.534
  867    H    GLY 119           HN       GLY 119  -8.501  -0.010  -4.716
  868   1HA   GLY 119          HA2       GLY 119 -10.398  -1.203  -6.246
  869   2HA   GLY 119          HA1       GLY 119  -9.580  -2.558  -5.479
  870    H    TYR 120           HN       TYR 120 -12.070  -2.504  -4.841
  871    HA   TYR 120           HA       TYR 120 -12.155  -1.140  -2.244
  872   1HB   TYR 120          HB2       TYR 120 -14.589  -1.303  -2.315
  873   2HB   TYR 120          HB1       TYR 120 -13.976  -0.442  -3.717
  874    HD1  TYR 120           HD1      TYR 120 -15.695  -3.444  -2.538
  875    HD2  TYR 120           HD2      TYR 120 -14.142  -1.431  -5.965
  876    HE1  TYR 120           HE1      TYR 120 -17.017  -4.909  -3.999
  877    HE2  TYR 120           HE2      TYR 120 -15.467  -2.900  -7.428
  878    HH   TYR 120           HH       TYR 120 -16.575  -5.005  -7.425
  879    H    TRP 121           HN       TRP 121 -13.824  -2.427  -0.798
  880    HA   TRP 121           HA       TRP 121 -13.164  -5.273  -0.840
  881   1HB   TRP 121          HB2       TRP 121 -11.406  -4.350   0.486
  882   2HB   TRP 121          HB1       TRP 121 -12.519  -3.300   1.351
  883    HD1  TRP 121           HD1      TRP 121 -14.300  -4.617   2.982
  884    HE1  TRP 121           HE1      TRP 121 -13.897  -6.643   4.496
  885    HE3  TRP 121           HE3      TRP 121 -10.055  -6.472   0.772
  886    HZ2  TRP 121           HZ2      TRP 121 -12.069  -8.724   4.720
  887    HZ3  TRP 121           HZ3      TRP 121  -9.061  -8.512   1.756
  888    HH2  TRP 121           HH2      TRP 121 -10.053  -9.602   3.662
  889    H    ALA 122           HN       ALA 122 -14.753  -6.561   0.220
  890    HA   ALA 122           HA       ALA 122 -17.074  -5.109   1.250
  891   1HB   ALA 122          HB1       ALA 122 -17.290  -7.104  -0.995
  892   2HB   ALA 122          HB2       ALA 122 -17.405  -5.352  -1.177
  893   3HB   ALA 122          HB3       ALA 122 -18.617  -6.224  -0.237
  894    H    LYS 123           HN       LYS 123 -15.692  -6.353   3.023
  895    HA   LYS 123           HA       LYS 123 -17.540  -7.838   4.369
  896   1HB   LYS 123          HB2       LYS 123 -16.991  -9.569   2.532
  897   2HB   LYS 123          HB1       LYS 123 -15.480  -9.806   3.398
  898   1HG   LYS 123          HG2       LYS 123 -16.997 -11.492   4.110
  899   2HG   LYS 123          HG1       LYS 123 -16.814 -10.346   5.437
  900   1HD   LYS 123          HD2       LYS 123 -19.079 -10.157   3.467
  901   2HD   LYS 123          HD1       LYS 123 -19.175 -11.178   4.899
  902   1HE   LYS 123          HE2       LYS 123 -18.642  -8.206   4.923
  903   2HE   LYS 123          HE1       LYS 123 -20.215  -8.949   5.202
  904   1HZ   LYS 123          HZ1       LYS 123 -19.027  -8.350   7.260
  905   2HZ   LYS 123          HZ2       LYS 123 -17.805  -9.463   6.873
  906   3HZ   LYS 123          HZ3       LYS 123 -19.385 -10.005   7.164
  907    H    ASP 124           HN       ASP 124 -14.915  -9.724   4.959
  908    HA   ASP 124           HA       ASP 124 -13.207  -7.899   6.298
  909   1HB   ASP 124          HB2       ASP 124 -13.696  -8.541   8.617
  910   2HB   ASP 124          HB1       ASP 124 -15.095  -7.787   7.863
  911    H    ASN 125           HN       ASN 125 -11.346  -8.764   6.023
  912    HA   ASN 125           HA       ASN 125  -9.562 -10.112   6.026
  913   1HB   ASN 125          HB2       ASN 125  -9.922 -10.409   8.308
  914   2HB   ASN 125          HB1       ASN 125 -11.223 -11.562   8.043
  915   1HD2  ASN 125          HD21      ASN 125  -7.767 -11.054   7.845
  916   2HD2  ASN 125          HD22      ASN 125  -7.321 -12.734   7.864
  917    H    LYS 126           HN       LYS 126 -12.544 -11.820   5.322
  918    HA   LYS 126           HA       LYS 126 -11.387 -14.187   4.345
  919   1HB   LYS 126          HB2       LYS 126 -13.541 -14.651   3.341
  920   2HB   LYS 126          HB1       LYS 126 -13.764 -13.980   4.947
  921   1HG   LYS 126          HG2       LYS 126 -15.304 -12.710   3.932
  922   2HG   LYS 126          HG1       LYS 126 -13.918 -11.733   3.445
  923   1HD   LYS 126          HD2       LYS 126 -13.797 -12.888   1.324
  924   2HD   LYS 126          HD1       LYS 126 -15.083 -13.993   1.816
  925   1HE   LYS 126          HE2       LYS 126 -16.649 -12.136   1.933
  926   2HE   LYS 126          HE1       LYS 126 -15.369 -11.006   1.489
  927   1HZ   LYS 126          HZ1       LYS 126 -15.152 -12.314  -0.626
  928   2HZ   LYS 126          HZ2       LYS 126 -16.624 -11.487  -0.455
  929   3HZ   LYS 126          HZ3       LYS 126 -16.557 -13.160  -0.185
  930    H    GLN 127           HN       GLN 127 -10.967 -11.176   3.204
  931    HA   GLN 127           HA       GLN 127  -9.921 -10.328   1.409
  932   1HB   GLN 127          HB2       GLN 127  -9.685 -13.228   0.679
  933   2HB   GLN 127          HB1       GLN 127  -9.166 -11.965  -0.430
  934   1HG   GLN 127          HG2       GLN 127  -7.694 -11.083   1.375
  935   2HG   GLN 127          HG1       GLN 127  -8.121 -12.503   2.337
  936   1HE2  GLN 127          HE21      GLN 127  -7.395 -14.530   1.687
  937   2HE2  GLN 127          HE22      GLN 127  -6.101 -14.726   0.553
  938    H    GLY 128           HN       GLY 128 -12.610 -10.184   1.575
  939   1HA   GLY 128          HA2       GLY 128 -13.720 -10.659  -1.040
  940   2HA   GLY 128          HA1       GLY 128 -14.468  -9.738   0.261
  941    H    PHE 129           HN       PHE 129 -11.565  -9.528  -1.775
  942    HA   PHE 129           HA       PHE 129 -11.970  -6.619  -1.879
  943   1HB   PHE 129          HB2       PHE 129  -9.599  -6.452  -2.375
  944   2HB   PHE 129          HB1       PHE 129  -9.811  -7.463  -0.955
  945    HD1  PHE 129           HD1      PHE 129  -9.383  -9.868  -1.069
  946    HD2  PHE 129           HD2      PHE 129  -8.708  -7.336  -4.426
  947    HE1  PHE 129           HE1      PHE 129  -8.012 -11.622  -2.114
  948    HE2  PHE 129           HE2      PHE 129  -7.343  -9.091  -5.476
  949    HZ   PHE 129           HZ       PHE 129  -6.992 -11.237  -4.322
  950    H    THR 130           HN       THR 130 -11.981  -5.564  -3.883
  951    HA   THR 130           HA       THR 130 -11.838  -7.277  -6.272
  952    HB   THR 130           HB       THR 130 -13.802  -5.002  -5.969
  953    HG1  THR 130           HG1      THR 130 -14.245  -7.819  -5.667
  954   1HG2  THR 130          HG21      THR 130 -13.551  -7.241  -7.982
  955   2HG2  THR 130          HG22      THR 130 -13.209  -5.534  -8.265
  956   3HG2  THR 130          HG23      THR 130 -14.859  -6.058  -7.934
  957    HA   PRO 131           HA       PRO 131  -8.775  -4.093  -7.205
  958   1HB   PRO 131          HB2       PRO 131  -8.627  -5.644  -9.721
  959   2HB   PRO 131          HB1       PRO 131  -7.340  -5.212  -8.590
  960   1HG   PRO 131          HG2       PRO 131  -8.255  -7.716  -8.750
  961   2HG   PRO 131          HG1       PRO 131  -7.788  -7.004  -7.194
  962   1HD   PRO 131          HD2       PRO 131 -10.523  -7.412  -8.351
  963   2HD   PRO 131          HD1       PRO 131  -9.958  -7.655  -6.684
  964    H    SER 132           HN       SER 132  -9.430  -2.177  -7.892
  965    HA   SER 132           HA       SER 132 -10.962  -1.918 -10.355
  966   1HB   SER 132          HB2       SER 132 -11.956  -0.949  -7.662
  967   2HB   SER 132          HB1       SER 132 -12.668  -0.490  -9.206
  968    HG   SER 132           HG       SER 132 -13.869  -2.180  -8.746
  969    H    GLY 133           HN       GLY 133 -10.947   0.241 -11.199
  970   1HA   GLY 133          HA2       GLY 133 -10.296   2.477 -11.298
  971   2HA   GLY 133          HA1       GLY 133  -9.511   2.292  -9.734
  972    H    THR 134           HN       THR 134  -7.399   2.588  -9.834
  973    HA   THR 134           HA       THR 134  -5.975   1.751 -12.275
  974    HB   THR 134           HB       THR 134  -5.407   4.219 -10.624
  975    HG1  THR 134           HG1      THR 134  -7.290   4.521 -11.827
  976   1HG2  THR 134          HG21      THR 134  -3.906   4.817 -12.487
  977   2HG2  THR 134          HG22      THR 134  -4.232   3.253 -13.234
  978   3HG2  THR 134          HG23      THR 134  -3.401   3.333 -11.679
  979    H    THR 135           HN       THR 135  -4.020   0.763 -12.010
  980    HA   THR 135           HA       THR 135  -3.182   0.090  -9.297
  981    HB   THR 135           HB       THR 135  -1.931  -0.826 -11.893
  982    HG1  THR 135           HG1      THR 135  -4.118  -1.439 -11.916
  983   1HG2  THR 135          HG21      THR 135  -1.178  -2.728 -10.544
  984   2HG2  THR 135          HG22      THR 135  -1.957  -2.030  -9.122
  985   3HG2  THR 135          HG23      THR 135  -0.595  -1.202  -9.879
  986    H    GLY 136           HN       GLY 136  -1.819   1.455  -8.322
  987   1HA   GLY 136          HA2       GLY 136  -0.129   3.196  -9.970
  988   2HA   GLY 136          HA1       GLY 136  -0.521   3.443  -8.274
  989    H    THR 137           HN       THR 137   1.976   2.871 -10.182
  990    HA   THR 137           HA       THR 137   3.216   0.789  -8.546
  991    HB   THR 137           HB       THR 137   4.369   2.212 -10.957
  992    HG1  THR 137           HG1      THR 137   2.373   0.951 -11.327
  993   1HG2  THR 137          HG21      THR 137   5.840   0.231 -11.061
  994   2HG2  THR 137          HG22      THR 137   5.116  -0.368  -9.568
  995   3HG2  THR 137          HG23      THR 137   6.045   1.131  -9.558
  996    H    THR 138           HN       THR 138   3.755   1.726  -6.620
  997    HA   THR 138           HA       THR 138   5.120   4.257  -6.532
  998    HB   THR 138           HB       THR 138   4.848   2.226  -4.306
  999    HG1  THR 138           HG1      THR 138   2.777   2.736  -4.708
 1000   1HG2  THR 138          HG21      THR 138   5.133   4.182  -2.848
 1001   2HG2  THR 138          HG22      THR 138   5.354   5.205  -4.267
 1002   3HG2  THR 138          HG23      THR 138   6.531   3.947  -3.895
 1003    H    LYS 139           HN       LYS 139   7.207   4.504  -6.943
 1004    HA   LYS 139           HA       LYS 139   8.943   2.137  -6.734
 1005   1HB   LYS 139          HB2       LYS 139   8.559   2.943  -9.056
 1006   2HB   LYS 139          HB1       LYS 139   9.256   4.492  -8.608
 1007   1HG   LYS 139          HG2       LYS 139  11.401   3.536  -8.283
 1008   2HG   LYS 139          HG1       LYS 139  10.755   1.897  -8.378
 1009   1HD   LYS 139          HD2       LYS 139  10.613   3.858 -10.659
 1010   2HD   LYS 139          HD1       LYS 139  11.949   2.731 -10.442
 1011   1HE   LYS 139          HE2       LYS 139   9.059   1.911 -10.669
 1012   2HE   LYS 139          HE1       LYS 139  10.187   1.947 -12.023
 1013   1HZ   LYS 139          HZ1       LYS 139  10.524   0.301  -9.569
 1014   2HZ   LYS 139          HZ2       LYS 139  11.546   0.304 -10.915
 1015   3HZ   LYS 139          HZ3       LYS 139   9.961  -0.273 -11.061
 1016    H    LEU 140           HN       LEU 140  10.424   2.228  -5.274
 1017    HA   LEU 140           HA       LEU 140  10.991   4.824  -4.029
 1018   1HB   LEU 140          HB2       LEU 140   9.979   3.659  -2.366
 1019   2HB   LEU 140          HB1       LEU 140  10.475   2.098  -2.976
 1020    HG   LEU 140           HG       LEU 140  12.758   2.545  -2.063
 1021   1HD1  LEU 140          HD11      LEU 140  11.408   4.917  -0.790
 1022   2HD1  LEU 140          HD12      LEU 140  12.653   4.980  -2.038
 1023   3HD1  LEU 140          HD13      LEU 140  13.036   4.337  -0.442
 1024   1HD2  LEU 140          HD21      LEU 140  10.491   2.663  -0.084
 1025   2HD2  LEU 140          HD22      LEU 140  12.141   2.146   0.261
 1026   3HD2  LEU 140          HD23      LEU 140  11.136   1.205  -0.842
 1027    H    THR 141           HN       THR 141  12.710   5.446  -5.184
 1028    HA   THR 141           HA       THR 141  15.059   3.751  -5.473
 1029    HB   THR 141           HB       THR 141  14.773   6.653  -6.285
 1030    HG1  THR 141           HG1      THR 141  13.539   6.057  -7.897
 1031   1HG2  THR 141          HG21      THR 141  16.444   6.063  -7.978
 1032   2HG2  THR 141          HG22      THR 141  16.478   4.405  -7.376
 1033   3HG2  THR 141          HG23      THR 141  17.044   5.726  -6.353
 1034    H    VAL 142           HN       VAL 142  17.062   4.204  -4.382
 1035    HA   VAL 142           HA       VAL 142  16.823   6.252  -2.281
 1036    HB   VAL 142           HB       VAL 142  17.480   4.059  -1.454
 1037   1HG1  VAL 142          HG11      VAL 142  18.598   3.164  -3.403
 1038   2HG1  VAL 142          HG12      VAL 142  19.682   3.110  -2.013
 1039   3HG1  VAL 142          HG13      VAL 142  19.886   4.356  -3.244
 1040   1HG2  VAL 142          HG21      VAL 142  19.496   4.722  -0.214
 1041   2HG2  VAL 142          HG22      VAL 142  18.292   6.009  -0.267
 1042   3HG2  VAL 142          HG23      VAL 142  19.708   6.084  -1.315
 1043    H    THR 143           HN       THR 143  17.772   8.132  -2.504
 1044    HA   THR 143           HA       THR 143  20.327   8.426  -3.806
 1045    HB   THR 143           HB       THR 143  17.934   9.895  -4.955
 1046    HG1  THR 143           HG1      THR 143  18.888   7.480  -5.534
 1047   1HG2  THR 143          HG21      THR 143  20.846   9.928  -5.761
 1048   2HG2  THR 143          HG22      THR 143  19.986  11.235  -4.946
 1049   3HG2  THR 143          HG23      THR 143  19.536  10.771  -6.588
  Start of MODEL    2
    1    H    GLU   1           H        GLU   1 -23.566   2.735  -9.136
    2    HA   GLU   1           HA       GLU   1 -21.805   2.643  -7.550
    3   1HB   GLU   1          HB2       GLU   1 -23.136  -0.047  -7.919
    4   2HB   GLU   1          HB1       GLU   1 -22.328   0.484  -6.452
    5   1HG   GLU   1          HG2       GLU   1 -23.949   2.265  -6.177
    6   2HG   GLU   1          HG1       GLU   1 -24.743   1.792  -7.681
    7    H    GLU   2           HN       GLU   2 -19.797   2.846  -8.580
    8    HA   GLU   2           HA       GLU   2 -18.216   0.420  -8.422
    9   1HB   GLU   2          HB2       GLU   2 -18.909   0.552 -10.813
   10   2HB   GLU   2          HB1       GLU   2 -18.194   2.153 -10.887
   11   1HG   GLU   2          HG2       GLU   2 -16.002   1.187 -10.358
   12   2HG   GLU   2          HG1       GLU   2 -16.727  -0.421 -10.385
   13    H    CYS   3           HN       CYS   3 -17.050   1.235  -6.776
   14    HA   CYS   3           HA       CYS   3 -16.191   3.992  -6.851
   15   1HB   CYS   3          HB2       CYS   3 -17.016   2.907  -4.736
   16   2HB   CYS   3          HB1       CYS   3 -15.531   1.959  -4.724
   17    H    GLN   4           HN       GLN   4 -14.639   4.270  -8.309
   18    HA   GLN   4           HA       GLN   4 -12.383   2.456  -8.427
   19   1HB   GLN   4          HB2       GLN   4 -13.067   4.973  -9.941
   20   2HB   GLN   4          HB1       GLN   4 -11.550   4.110 -10.154
   21   1HG   GLN   4          HG2       GLN   4 -12.848   2.098 -10.793
   22   2HG   GLN   4          HG1       GLN   4 -14.316   3.073 -10.710
   23   1HE2  GLN   4          HE21      GLN   4 -14.709   2.666 -12.907
   24   2HE2  GLN   4          HE22      GLN   4 -13.814   3.492 -14.143
   25    H    VAL   5           HN       VAL   5 -10.380   2.843  -7.683
   26    HA   VAL   5           HA       VAL   5  -9.965   5.345  -6.192
   27    HB   VAL   5           HB       VAL   5  -9.836   3.483  -4.676
   28   1HG1  VAL   5          HG11      VAL   5  -7.860   2.247  -6.582
   29   2HG1  VAL   5          HG12      VAL   5  -9.505   1.691  -6.271
   30   3HG1  VAL   5          HG13      VAL   5  -8.292   1.613  -4.994
   31   1HG2  VAL   5          HG21      VAL   5  -7.051   4.389  -5.398
   32   2HG2  VAL   5          HG22      VAL   5  -7.523   3.642  -3.873
   33   3HG2  VAL   5          HG23      VAL   5  -8.173   5.220  -4.318
   34    H    ARG   6           HN       ARG   6  -8.521   6.716  -7.017
   35    HA   ARG   6           HA       ARG   6  -6.802   5.763  -9.170
   36   1HB   ARG   6          HB2       ARG   6  -7.637   8.540  -8.348
   37   2HB   ARG   6          HB1       ARG   6  -6.414   8.230  -9.576
   38   1HG   ARG   6          HG2       ARG   6  -8.080   6.922 -10.848
   39   2HG   ARG   6          HG1       ARG   6  -9.294   7.366  -9.650
   40   1HD   ARG   6          HD2       ARG   6  -9.069   9.695 -10.210
   41   2HD   ARG   6          HD1       ARG   6  -7.724   9.342 -11.298
   42    HE   ARG   6           HE       ARG   6  -9.876   7.819 -12.161
   43   1HH1  ARG   6          HH11      ARG   6  -9.110  11.237 -11.862
   44   2HH1  ARG   6          HH12      ARG   6 -10.142  11.695 -13.188
   45   1HH2  ARG   6          HH21      ARG   6 -11.178   8.414 -13.896
   46   2HH2  ARG   6          HH22      ARG   6 -11.301  10.088 -14.359
   47    H    VAL   7           HN       VAL   7  -5.009   4.937  -8.454
   48    HA   VAL   7           HA       VAL   7  -3.510   6.312  -6.331
   49    HB   VAL   7           HB       VAL   7  -3.094   3.531  -7.458
   50   1HG1  VAL   7          HG11      VAL   7  -1.043   4.516  -6.565
   51   2HG1  VAL   7          HG12      VAL   7  -1.612   3.199  -5.539
   52   3HG1  VAL   7          HG13      VAL   7  -1.867   4.874  -5.048
   53   1HG2  VAL   7          HG21      VAL   7  -4.007   2.753  -5.297
   54   2HG2  VAL   7          HG22      VAL   7  -5.191   3.629  -6.268
   55   3HG2  VAL   7          HG23      VAL   7  -4.413   4.422  -4.897
   56    H    GLY   8           HN       GLY   8  -1.960   7.633  -7.023
   57   1HA   GLY   8          HA2       GLY   8  -1.024   7.538  -9.743
   58   2HA   GLY   8          HA1       GLY   8  -0.528   8.684  -8.506
   59    H    ASP   9           HN       ASP   9   1.087   7.206 -10.449
   60    HA   ASP   9           HA       ASP   9   2.532   5.190  -9.022
   61   1HB   ASP   9          HB2       ASP   9   3.370   6.746 -11.481
   62   2HB   ASP   9          HB1       ASP   9   4.113   5.265 -10.889
   63    H    LEU  10           HN       LEU  10   3.770   5.649  -7.336
   64    HA   LEU  10           HA       LEU  10   4.891   8.329  -7.061
   65   1HB   LEU  10          HB2       LEU  10   4.663   6.023  -5.138
   66   2HB   LEU  10          HB1       LEU  10   5.467   7.531  -4.750
   67    HG   LEU  10           HG       LEU  10   2.542   7.234  -5.441
   68   1HD1  LEU  10          HD11      LEU  10   3.137   6.246  -3.284
   69   2HD1  LEU  10          HD12      LEU  10   2.158   7.698  -3.087
   70   3HD1  LEU  10          HD13      LEU  10   3.897   7.761  -2.802
   71   1HD2  LEU  10          HD21      LEU  10   4.109   9.630  -4.483
   72   2HD2  LEU  10          HD22      LEU  10   2.365   9.562  -4.721
   73   3HD2  LEU  10          HD23      LEU  10   3.449   9.409  -6.104
   74    H    THR  11           HN       THR  11   6.652   8.252  -8.501
   75    HA   THR  11           HA       THR  11   8.797   6.395  -7.787
   76    HB   THR  11           HB       THR  11   8.843   8.574  -9.888
   77    HG1  THR  11           HG1      THR  11   7.397   6.392  -9.896
   78   1HG2  THR  11          HG21      THR  11  10.704   7.283 -10.819
   79   2HG2  THR  11          HG22      THR  11  10.565   6.119  -9.501
   80   3HG2  THR  11          HG23      THR  11  11.052   7.780  -9.164
   81    H    VAL  12           HN       VAL  12  10.065   6.957  -6.133
   82    HA   VAL  12           HA       VAL  12  10.647   9.810  -5.711
   83    HB   VAL  12           HB       VAL  12  10.103   7.960  -3.392
   84   1HG1  VAL  12          HG11      VAL  12   9.827  10.038  -2.152
   85   2HG1  VAL  12          HG12      VAL  12  10.144  10.961  -3.621
   86   3HG1  VAL  12          HG13      VAL  12  11.411   9.954  -2.923
   87   1HG2  VAL  12          HG21      VAL  12   8.041   8.069  -4.700
   88   2HG2  VAL  12          HG22      VAL  12   8.124   9.831  -4.694
   89   3HG2  VAL  12          HG23      VAL  12   7.875   8.955  -3.184
   90    H    ALA  13           HN       ALA  13  12.671  10.256  -4.927
   91    HA   ALA  13           HA       ALA  13  14.516   7.981  -4.765
   92   1HB   ALA  13          HB1       ALA  13  15.092  10.928  -5.072
   93   2HB   ALA  13          HB2       ALA  13  15.073   9.741  -6.377
   94   3HB   ALA  13          HB3       ALA  13  16.285   9.630  -5.100
   95    H    LYS  14           HN       LYS  14  14.364   7.247  -2.706
   96    HA   LYS  14           HA       LYS  14  15.179   9.024  -0.535
   97   1HB   LYS  14          HB2       LYS  14  12.581   7.475  -0.579
   98   2HB   LYS  14          HB1       LYS  14  13.323   8.033   0.909
   99   1HG   LYS  14          HG2       LYS  14  12.608   9.928  -1.303
  100   2HG   LYS  14          HG1       LYS  14  11.434   9.423  -0.088
  101   1HD   LYS  14          HD2       LYS  14  12.255  11.363   0.848
  102   2HD   LYS  14          HD1       LYS  14  13.298  10.153   1.595
  103   1HE   LYS  14          HE2       LYS  14  14.974  10.590  -0.186
  104   2HE   LYS  14          HE1       LYS  14  13.945  11.895  -0.774
  105   1HZ   LYS  14          HZ1       LYS  14  15.612  12.829   0.629
  106   2HZ   LYS  14          HZ2       LYS  14  15.292  11.717   1.861
  107   3HZ   LYS  14          HZ3       LYS  14  14.145  12.907   1.483
  108    H    THR  15           HN       THR  15  15.445   7.696   1.532
  109    HA   THR  15           HA       THR  15  16.419   4.997   0.890
  110    HB   THR  15           HB       THR  15  17.615   5.181   3.100
  111    HG1  THR  15           HG1      THR  15  17.639   7.115   4.153
  112   1HG2  THR  15          HG21      THR  15  18.793   5.617   1.007
  113   2HG2  THR  15          HG22      THR  15  19.367   6.693   2.280
  114   3HG2  THR  15          HG23      THR  15  18.263   7.298   1.046
  115    H    ARG  16           HN       ARG  16  16.131   3.408   2.841
  116    HA   ARG  16           HA       ARG  16  13.314   3.554   3.606
  117   1HB   ARG  16          HB2       ARG  16  15.282   1.303   4.133
  118   2HB   ARG  16          HB1       ARG  16  13.551   1.262   4.459
  119   1HG   ARG  16          HG2       ARG  16  13.763   0.069   2.474
  120   2HG   ARG  16          HG1       ARG  16  13.268   1.681   1.947
  121   1HD   ARG  16          HD2       ARG  16  15.777   2.163   1.699
  122   2HD   ARG  16          HD1       ARG  16  15.983   0.417   1.790
  123    HE   ARG  16           HE       ARG  16  14.708   0.227  -0.222
  124   1HH1  ARG  16          HH11      ARG  16  15.659   3.451   0.660
  125   2HH1  ARG  16          HH12      ARG  16  15.473   4.117  -0.931
  126   1HH2  ARG  16          HH21      ARG  16  14.458   1.079  -2.375
  127   2HH2  ARG  16          HH22      ARG  16  14.785   2.756  -2.661
  128    H    GLY  17           HN       GLY  17  16.400   4.208   4.823
  129   1HA   GLY  17          HA2       GLY  17  15.916   4.056   7.603
  130   2HA   GLY  17          HA1       GLY  17  17.100   5.097   6.822
  131    H    GLN  18           HN       GLN  18  14.959   6.328   5.166
  132    HA   GLN  18           HA       GLN  18  14.141   8.499   6.723
  133   1HB   GLN  18          HB2       GLN  18  14.109   8.674   4.330
  134   2HB   GLN  18          HB1       GLN  18  13.030   7.296   4.180
  135   1HG   GLN  18          HG2       GLN  18  11.750   9.241   3.749
  136   2HG   GLN  18          HG1       GLN  18  11.276   8.639   5.337
  137   1HE2  GLN  18          HE21      GLN  18  11.821   9.800   7.172
  138   2HE2  GLN  18          HE22      GLN  18  12.351  11.447   7.099
  139    H    LEU  19           HN       LEU  19  12.802   5.342   6.237
  140    HA   LEU  19           HA       LEU  19  10.333   6.032   7.634
  141   1HB   LEU  19          HB2       LEU  19  10.997   3.314   6.553
  142   2HB   LEU  19          HB1       LEU  19   9.424   4.052   6.795
  143    HG   LEU  19           HG       LEU  19  11.393   4.869   4.655
  144   1HD1  LEU  19          HD11      LEU  19   9.851   3.780   3.104
  145   2HD1  LEU  19          HD12      LEU  19   8.878   3.218   4.463
  146   3HD1  LEU  19          HD13      LEU  19  10.528   2.629   4.257
  147   1HD2  LEU  19          HD21      LEU  19   8.520   5.649   5.115
  148   2HD2  LEU  19          HD22      LEU  19   9.519   6.130   3.742
  149   3HD2  LEU  19          HD23      LEU  19   9.927   6.682   5.369
  150    H    THR  20           HN       THR  20  10.649   6.035   9.778
  151    HA   THR  20           HA       THR  20  12.158   3.825  10.963
  152    HB   THR  20           HB       THR  20  13.157   5.903  11.601
  153    HG1  THR  20           HG1      THR  20  11.529   4.905  13.719
  154   1HG2  THR  20          HG21      THR  20  11.297   7.410  11.115
  155   2HG2  THR  20          HG22      THR  20  11.944   7.701  12.730
  156   3HG2  THR  20          HG23      THR  20  10.433   6.812  12.532
  157    H    ASP  21           HN       ASP  21  10.232   2.588  10.483
  158    HA   ASP  21           HA       ASP  21   8.346   1.485  11.027
  159   1HB   ASP  21          HB2       ASP  21   9.118   1.275  13.289
  160   2HB   ASP  21          HB1       ASP  21   8.677   2.941  13.654
  161    H    ALA  22           HN       ALA  22   7.592   4.471  12.807
  162    HA   ALA  22           HA       ALA  22   5.278   4.762  11.024
  163   1HB   ALA  22          HB1       ALA  22   4.777   4.576  13.412
  164   2HB   ALA  22          HB2       ALA  22   4.290   6.142  12.768
  165   3HB   ALA  22          HB3       ALA  22   5.760   6.004  13.734
  166    H    ALA  23           HN       ALA  23   7.166   5.496   9.591
  167    HA   ALA  23           HA       ALA  23   6.896   8.398   9.433
  168   1HB   ALA  23          HB1       ALA  23   9.099   8.052  10.460
  169   2HB   ALA  23          HB2       ALA  23   9.253   8.692   8.824
  170   3HB   ALA  23          HB3       ALA  23   9.551   6.981   9.135
  171    HA   PRO  24           HA       PRO  24   5.963   6.797   5.384
  172   1HB   PRO  24          HB2       PRO  24   4.379   8.790   4.638
  173   2HB   PRO  24          HB1       PRO  24   3.892   7.694   5.934
  174   1HG   PRO  24          HG2       PRO  24   4.974  10.472   6.098
  175   2HG   PRO  24          HG1       PRO  24   3.709   9.703   7.073
  176   1HD   PRO  24          HD2       PRO  24   6.393   9.996   7.812
  177   2HD   PRO  24          HD1       PRO  24   5.225   8.898   8.562
  178    H    ILE  25           HN       ILE  25   6.277   7.400   3.192
  179    HA   ILE  25           HA       ILE  25   8.089   9.683   2.740
  180    HB   ILE  25           HB       ILE  25   8.563   8.270   0.555
  181   1HG1  ILE  25          HG12      ILE  25   7.938   6.133   2.592
  182   2HG1  ILE  25          HG11      ILE  25   6.958   6.511   1.181
  183   1HG2  ILE  25          HG21      ILE  25  10.266   9.021   2.089
  184   2HG2  ILE  25          HG22      ILE  25  10.550   7.332   1.664
  185   3HG2  ILE  25          HG23      ILE  25   9.842   7.744   3.228
  186   1HD1  ILE  25          HD11      ILE  25   8.808   5.871  -0.277
  187   2HD1  ILE  25          HD12      ILE  25   8.338   4.551   0.796
  188   3HD1  ILE  25          HD13      ILE  25   9.788   5.493   1.140
  189    H    GLY  26           HN       GLY  26   5.754   7.606   1.029
  190   1HA   GLY  26          HA2       GLY  26   4.932   9.984  -0.507
  191   2HA   GLY  26          HA1       GLY  26   4.935   8.351  -1.157
  192    HA   PRO  27           HA       PRO  27   0.992   8.942   1.492
  193   1HB   PRO  27          HB2       PRO  27   0.122  11.492   1.698
  194   2HB   PRO  27          HB1       PRO  27   1.204  10.762   2.890
  195   1HG   PRO  27          HG2       PRO  27   1.807  12.681   0.695
  196   2HG   PRO  27          HG1       PRO  27   2.539  12.546   2.301
  197   1HD   PRO  27          HD2       PRO  27   3.652  11.589  -0.066
  198   2HD   PRO  27          HD1       PRO  27   4.111  11.077   1.564
  199    H    VAL  28           HN       VAL  28  -0.087   8.022  -0.195
  200    HA   VAL  28           HA       VAL  28  -0.635   9.419  -2.644
  201    HB   VAL  28           HB       VAL  28  -2.034   6.934  -1.657
  202   1HG1  VAL  28          HG11      VAL  28  -2.311   6.455  -4.041
  203   2HG1  VAL  28          HG12      VAL  28  -1.512   7.977  -4.434
  204   3HG1  VAL  28          HG13      VAL  28  -3.058   7.987  -3.585
  205   1HG2  VAL  28          HG21      VAL  28   0.580   7.114  -3.144
  206   2HG2  VAL  28          HG22      VAL  28  -0.335   5.633  -2.870
  207   3HG2  VAL  28          HG23      VAL  28   0.339   6.516  -1.502
  208    H    THR  29           HN       THR  29  -2.258  10.808  -2.989
  209    HA   THR  29           HA       THR  29  -4.281  11.138  -0.966
  210    HB   THR  29           HB       THR  29  -3.393  13.158  -1.904
  211    HG1  THR  29           HG1      THR  29  -5.837  12.789  -1.559
  212   1HG2  THR  29          HG21      THR  29  -4.392  12.220  -4.594
  213   2HG2  THR  29          HG22      THR  29  -2.703  12.334  -4.101
  214   3HG2  THR  29          HG23      THR  29  -3.682  13.795  -4.246
  215    H    VAL  30           HN       VAL  30  -5.317   9.162  -1.084
  216    HA   VAL  30           HA       VAL  30  -6.458   8.100  -3.457
  217    HB   VAL  30           HB       VAL  30  -7.112   7.558  -0.556
  218   1HG1  VAL  30          HG11      VAL  30  -8.994   6.941  -1.963
  219   2HG1  VAL  30          HG12      VAL  30  -8.180   5.498  -1.361
  220   3HG1  VAL  30          HG13      VAL  30  -7.924   6.027  -3.025
  221   1HG2  VAL  30          HG21      VAL  30  -5.774   5.521  -0.898
  222   2HG2  VAL  30          HG22      VAL  30  -4.822   6.985  -1.149
  223   3HG2  VAL  30          HG23      VAL  30  -5.396   6.056  -2.534
  224    H    GLN  31           HN       GLN  31  -8.042   9.044  -4.534
  225    HA   GLN  31           HA       GLN  31 -10.246  10.229  -3.006
  226   1HB   GLN  31          HB2       GLN  31 -10.844  11.437  -5.065
  227   2HB   GLN  31          HB1       GLN  31  -9.216  11.822  -4.528
  228   1HG   GLN  31          HG2       GLN  31  -8.350  10.213  -6.211
  229   2HG   GLN  31          HG1       GLN  31  -9.998  10.016  -6.803
  230   1HE2  GLN  31          HE21      GLN  31 -10.586  12.866  -6.242
  231   2HE2  GLN  31          HE22      GLN  31  -9.835  13.749  -7.526
  232    H    ALA  32           HN       ALA  32 -12.234   9.372  -3.179
  233    HA   ALA  32           HA       ALA  32 -12.393   6.853  -4.668
  234   1HB   ALA  32          HB1       ALA  32 -12.723   6.724  -2.244
  235   2HB   ALA  32          HB2       ALA  32 -14.168   6.232  -3.125
  236   3HB   ALA  32          HB3       ALA  32 -14.092   7.827  -2.374
  237    H    LEU  33           HN       LEU  33 -13.722   6.649  -6.366
  238    HA   LEU  33           HA       LEU  33 -15.628   8.832  -6.876
  239   1HB   LEU  33          HB2       LEU  33 -14.442   6.834  -8.805
  240   2HB   LEU  33          HB1       LEU  33 -15.509   8.155  -9.230
  241    HG   LEU  33           HG       LEU  33 -12.717   8.447  -8.119
  242   1HD1  LEU  33          HD11      LEU  33 -12.155   9.271 -10.349
  243   2HD1  LEU  33          HD12      LEU  33 -13.799   8.925 -10.892
  244   3HD1  LEU  33          HD13      LEU  33 -12.734   7.606 -10.406
  245   1HD2  LEU  33          HD21      LEU  33 -14.204  10.271  -7.438
  246   2HD2  LEU  33          HD22      LEU  33 -14.640  10.540  -9.125
  247   3HD2  LEU  33          HD23      LEU  33 -12.984  10.818  -8.587
  248    H    GLY  34           HN       GLY  34 -17.634   8.291  -6.239
  249   1HA   GLY  34          HA2       GLY  34 -19.651   7.194  -6.213
  250   2HA   GLY  34          HA1       GLY  34 -19.047   6.226  -7.548
  251    H    CYS  35           HN       CYS  35 -18.396   6.560  -4.052
  252    HA   CYS  35           HA       CYS  35 -17.880   3.706  -3.885
  253   1HB   CYS  35          HB2       CYS  35 -17.167   6.045  -2.350
  254   2HB   CYS  35          HB1       CYS  35 -17.825   4.792  -1.306
  255    H    ASN  36           HN       ASN  36 -19.797   5.866  -1.807
  256    HA   ASN  36           HA       ASN  36 -21.779   5.662  -0.754
  257   1HB   ASN  36          HB2       ASN  36 -22.302   3.425  -2.714
  258   2HB   ASN  36          HB1       ASN  36 -23.501   4.109  -1.626
  259   1HD2  ASN  36          HD21      ASN  36 -23.582   3.958  -4.474
  260   2HD2  ASN  36          HD22      ASN  36 -23.689   5.583  -5.068
  261    H    ALA  37           HN       ALA  37 -20.736   2.353  -1.529
  262    HA   ALA  37           HA       ALA  37 -20.661   1.722   1.320
  263   1HB   ALA  37          HB1       ALA  37 -22.928   1.116   0.621
  264   2HB   ALA  37          HB2       ALA  37 -21.982  -0.322   1.011
  265   3HB   ALA  37          HB3       ALA  37 -22.265   0.116  -0.673
  266    H    ARG  38           HN       ARG  38 -18.399   1.919   0.586
  267    HA   ARG  38           HA       ARG  38 -17.402  -0.693  -0.246
  268   1HB   ARG  38          HB2       ARG  38 -17.485   0.588  -2.301
  269   2HB   ARG  38          HB1       ARG  38 -16.659   1.934  -1.533
  270   1HG   ARG  38          HG2       ARG  38 -15.210  -0.630  -1.530
  271   2HG   ARG  38          HG1       ARG  38 -15.447   0.128  -3.106
  272   1HD   ARG  38          HD2       ARG  38 -14.517   2.236  -2.134
  273   2HD   ARG  38          HD1       ARG  38 -14.132   1.333  -0.672
  274    HE   ARG  38           HE       ARG  38 -12.702  -0.082  -2.178
  275   1HH1  ARG  38          HH11      ARG  38 -13.457   3.242  -2.962
  276   2HH1  ARG  38          HH12      ARG  38 -12.008   3.494  -3.877
  277   1HH2  ARG  38          HH21      ARG  38 -10.765   0.249  -3.379
  278   2HH2  ARG  38          HH22      ARG  38 -10.482   1.795  -4.115
  279    H    GLN  39           HN       GLN  39 -15.731  -1.350   1.003
  280    HA   GLN  39           HA       GLN  39 -14.509   0.543   2.821
  281   1HB   GLN  39          HB2       GLN  39 -13.758  -2.361   2.516
  282   2HB   GLN  39          HB1       GLN  39 -13.603  -1.335   3.937
  283   1HG   GLN  39          HG2       GLN  39 -16.119  -1.227   3.986
  284   2HG   GLN  39          HG1       GLN  39 -16.112  -2.496   2.765
  285   1HE2  GLN  39          HE21      GLN  39 -13.867  -2.186   5.439
  286   2HE2  GLN  39          HE22      GLN  39 -14.363  -3.632   6.263
  287    H    VAL  40           HN       VAL  40 -12.986   1.789   1.973
  288    HA   VAL  40           HA       VAL  40 -11.583   1.229  -0.400
  289    HB   VAL  40           HB       VAL  40 -10.770   3.174   1.771
  290   1HG1  VAL  40          HG11      VAL  40  -9.664   4.383  -0.053
  291   2HG1  VAL  40          HG12      VAL  40 -10.137   3.114  -1.181
  292   3HG1  VAL  40          HG13      VAL  40  -9.016   2.753   0.130
  293   1HG2  VAL  40          HG21      VAL  40 -12.596   3.593  -0.597
  294   2HG2  VAL  40          HG22      VAL  40 -12.031   4.854   0.500
  295   3HG2  VAL  40          HG23      VAL  40 -13.077   3.566   1.099
  296    H    ALA  41           HN       ALA  41 -10.161  -0.377  -0.599
  297    HA   ALA  41           HA       ALA  41  -8.255  -0.864   1.550
  298   1HB   ALA  41          HB1       ALA  41  -9.978  -2.609   1.552
  299   2HB   ALA  41          HB2       ALA  41  -8.405  -3.253   1.081
  300   3HB   ALA  41          HB3       ALA  41  -9.635  -2.943  -0.146
  301    H    LEU  42           HN       LEU  42  -6.188  -1.092   0.902
  302    HA   LEU  42           HA       LEU  42  -5.693  -0.900  -1.980
  303   1HB   LEU  42          HB2       LEU  42  -3.789  -0.402   0.308
  304   2HB   LEU  42          HB1       LEU  42  -3.495  -0.064  -1.388
  305    HG   LEU  42           HG       LEU  42  -5.538   1.311   0.359
  306   1HD1  LEU  42          HD11      LEU  42  -3.257   1.944   0.897
  307   2HD1  LEU  42          HD12      LEU  42  -4.092   3.266   0.082
  308   3HD1  LEU  42          HD13      LEU  42  -2.932   2.277  -0.804
  309   1HD2  LEU  42          HD21      LEU  42  -6.284   1.121  -1.969
  310   2HD2  LEU  42          HD22      LEU  42  -4.766   1.830  -2.515
  311   3HD2  LEU  42          HD23      LEU  42  -5.890   2.789  -1.554
  312    H    LYS  43           HN       LYS  43  -4.870  -2.570  -3.044
  313    HA   LYS  43           HA       LYS  43  -3.628  -4.742  -1.492
  314   1HB   LYS  43          HB2       LYS  43  -4.874  -4.860  -4.252
  315   2HB   LYS  43          HB1       LYS  43  -4.079  -6.201  -3.444
  316   1HG   LYS  43          HG2       LYS  43  -6.300  -6.646  -3.073
  317   2HG   LYS  43          HG1       LYS  43  -5.836  -5.808  -1.591
  318   1HD   LYS  43          HD2       LYS  43  -6.604  -3.761  -3.286
  319   2HD   LYS  43          HD1       LYS  43  -7.756  -5.051  -3.642
  320   1HE   LYS  43          HE2       LYS  43  -7.128  -3.907  -0.930
  321   2HE   LYS  43          HE1       LYS  43  -8.591  -3.622  -1.869
  322   1HZ   LYS  43          HZ1       LYS  43  -7.725  -6.290  -0.912
  323   2HZ   LYS  43          HZ2       LYS  43  -9.196  -5.900  -1.654
  324   3HZ   LYS  43          HZ3       LYS  43  -8.844  -5.308  -0.110
  325    H    ALA  44           HN       ALA  44  -1.684  -5.618  -2.305
  326    HA   ALA  44           HA       ALA  44  -0.251  -3.755  -4.043
  327   1HB   ALA  44          HB1       ALA  44   1.771  -4.986  -3.252
  328   2HB   ALA  44          HB2       ALA  44   0.718  -5.898  -2.169
  329   3HB   ALA  44          HB3       ALA  44   0.874  -4.149  -1.987
  330    H    ASP  45           HN       ASP  45   1.030  -4.564  -5.744
  331    HA   ASP  45           HA       ASP  45  -0.222  -6.661  -7.238
  332   1HB   ASP  45          HB2       ASP  45   0.796  -4.639  -8.281
  333   2HB   ASP  45          HB1       ASP  45   2.383  -5.207  -7.767
  334    H    THR  46           HN       THR  46   0.788  -8.662  -7.880
  335    HA   THR  46           HA       THR  46   1.788 -10.049  -5.669
  336    HB   THR  46           HB       THR  46   0.562 -11.132  -7.525
  337    HG1  THR  46           HG1      THR  46   2.916 -12.045  -6.391
  338   1HG2  THR  46          HG21      THR  46   3.177 -10.857  -9.020
  339   2HG2  THR  46          HG22      THR  46   1.663 -10.047  -9.423
  340   3HG2  THR  46          HG23      THR  46   1.785 -11.800  -9.551
  341    H    ASP  47           HN       ASP  47   3.484  -8.159  -7.975
  342    HA   ASP  47           HA       ASP  47   6.002  -9.438  -7.877
  343   1HB   ASP  47          HB2       ASP  47   5.244  -7.638  -9.506
  344   2HB   ASP  47          HB1       ASP  47   5.542  -6.472  -8.221
  345    H    ASN  48           HN       ASN  48   4.314  -7.370  -5.692
  346    HA   ASN  48           HA       ASN  48   6.560  -7.483  -3.808
  347   1HB   ASN  48          HB2       ASN  48   5.978  -5.146  -3.092
  348   2HB   ASN  48          HB1       ASN  48   6.660  -5.240  -4.714
  349   1HD2  ASN  48          HD21      ASN  48   3.911  -4.442  -2.819
  350   2HD2  ASN  48          HD22      ASN  48   2.940  -3.823  -4.113
  351    H    PHE  49           HN       PHE  49   4.063  -8.984  -4.187
  352    HA   PHE  49           HA       PHE  49   2.952  -8.641  -1.495
  353   1HB   PHE  49          HB2       PHE  49   1.423  -7.470  -3.016
  354   2HB   PHE  49          HB1       PHE  49   1.309  -8.895  -4.026
  355    HD1  PHE  49           HD1      PHE  49   0.285  -7.345  -0.878
  356    HD2  PHE  49           HD2      PHE  49  -0.119 -10.745  -3.406
  357    HE1  PHE  49           HE1      PHE  49  -1.644  -8.103   0.450
  358    HE2  PHE  49           HE2      PHE  49  -2.046 -11.499  -2.093
  359    HZ   PHE  49           HZ       PHE  49  -2.958 -10.069  -0.319
  360    H    GLU  50           HN       GLU  50   3.709 -10.510  -0.663
  361    HA   GLU  50           HA       GLU  50   3.312 -12.978  -2.214
  362   1HB   GLU  50          HB2       GLU  50   5.182 -12.368   0.075
  363   2HB   GLU  50          HB1       GLU  50   4.926 -13.985  -0.563
  364   1HG   GLU  50          HG2       GLU  50   5.681 -13.155  -2.782
  365   2HG   GLU  50          HG1       GLU  50   6.089 -11.622  -2.009
  366    H    GLN  51           HN       GLN  51   1.630 -14.118  -1.707
  367    HA   GLN  51           HA       GLN  51   0.044 -15.254  -0.581
  368   1HB   GLN  51          HB2       GLN  51   1.705 -14.612   1.860
  369   2HB   GLN  51          HB1       GLN  51   0.352 -15.734   1.828
  370   1HG   GLN  51          HG2       GLN  51   1.556 -17.105   0.178
  371   2HG   GLN  51          HG1       GLN  51   2.925 -16.000   0.287
  372   1HE2  GLN  51          HE21      GLN  51   2.547 -15.617   3.172
  373   2HE2  GLN  51          HE22      GLN  51   3.131 -17.065   3.922
  374    H    GLY  52           HN       GLY  52   0.937 -12.449   1.432
  375   1HA   GLY  52          HA2       GLY  52  -1.445 -11.049   0.961
  376   2HA   GLY  52          HA1       GLY  52  -1.645 -11.988   2.439
  377    H    LYS  53           HN       LYS  53   1.451 -10.687   1.430
  378    HA   LYS  53           HA       LYS  53   1.163  -8.517   3.374
  379   1HB   LYS  53          HB2       LYS  53   3.009 -10.736   3.350
  380   2HB   LYS  53          HB1       LYS  53   3.868  -9.234   3.174
  381   1HG   LYS  53          HG2       LYS  53   3.756  -9.861   5.505
  382   2HG   LYS  53          HG1       LYS  53   2.801  -8.402   5.236
  383   1HD   LYS  53          HD2       LYS  53   0.758  -9.646   5.276
  384   2HD   LYS  53          HD1       LYS  53   1.632 -11.181   5.314
  385   1HE   LYS  53          HE2       LYS  53   1.737  -9.071   7.467
  386   2HE   LYS  53          HE1       LYS  53   0.719 -10.508   7.516
  387   1HZ   LYS  53          HZ1       LYS  53   2.747 -10.815   8.785
  388   2HZ   LYS  53          HZ2       LYS  53   3.692 -10.492   7.415
  389   3HZ   LYS  53          HZ3       LYS  53   2.713 -11.877   7.461
  390    H    PHE  54           HN       PHE  54   1.727  -6.546   2.554
  391    HA   PHE  54           HA       PHE  54   3.051  -6.536  -0.046
  392   1HB   PHE  54          HB2       PHE  54   2.496  -3.996   0.094
  393   2HB   PHE  54          HB1       PHE  54   1.255  -5.157  -0.327
  394    HD1  PHE  54           HD1      PHE  54  -0.793  -4.366   0.436
  395    HD2  PHE  54           HD2      PHE  54   2.639  -4.050   2.927
  396    HE1  PHE  54           HE1      PHE  54  -2.200  -3.510   2.267
  397    HE2  PHE  54           HE2      PHE  54   1.242  -3.187   4.756
  398    HZ   PHE  54           HZ       PHE  54  -1.290  -2.795   4.278
  399    H    PHE  55           HN       PHE  55   4.921  -5.533  -0.461
  400    HA   PHE  55           HA       PHE  55   6.435  -4.267   1.650
  401   1HB   PHE  55          HB2       PHE  55   8.234  -5.967   1.605
  402   2HB   PHE  55          HB1       PHE  55   6.723  -6.633   2.204
  403    HD1  PHE  55           HD1      PHE  55   9.197  -6.716  -0.456
  404    HD2  PHE  55           HD2      PHE  55   5.433  -8.210   0.850
  405    HE1  PHE  55           HE1      PHE  55   9.331  -8.516  -2.131
  406    HE2  PHE  55           HE2      PHE  55   5.561 -10.012  -0.817
  407    HZ   PHE  55           HZ       PHE  55   7.513 -10.165  -2.312
  408    H    LEU  56           HN       LEU  56   8.717  -3.783   0.818
  409    HA   LEU  56           HA       LEU  56   8.651  -2.991  -1.971
  410   1HB   LEU  56          HB2       LEU  56  10.875  -2.821   0.065
  411   2HB   LEU  56          HB1       LEU  56  10.973  -2.205  -1.559
  412    HG   LEU  56           HG       LEU  56   9.001  -0.697  -0.930
  413   1HD1  LEU  56          HD11      LEU  56   9.922  -1.499   1.820
  414   2HD1  LEU  56          HD12      LEU  56   8.343  -1.838   1.109
  415   3HD1  LEU  56          HD13      LEU  56   8.822  -0.173   1.446
  416   1HD2  LEU  56          HD21      LEU  56  11.280   0.086  -1.268
  417   2HD2  LEU  56          HD22      LEU  56  11.680  -0.336   0.397
  418   3HD2  LEU  56          HD23      LEU  56  10.509   0.941   0.068
  419    H    ILE  57           HN       ILE  57   9.466  -4.190  -3.635
  420    HA   ILE  57           HA       ILE  57  11.099  -6.508  -2.873
  421    HB   ILE  57           HB       ILE  57   9.061  -7.033  -4.193
  422   1HG1  ILE  57          HG12      ILE  57  10.191  -8.464  -5.871
  423   2HG1  ILE  57          HG11      ILE  57  11.688  -7.583  -5.589
  424   1HG2  ILE  57          HG21      ILE  57   8.912  -5.050  -5.574
  425   2HG2  ILE  57          HG22      ILE  57   8.993  -6.490  -6.588
  426   3HG2  ILE  57          HG23      ILE  57  10.420  -5.473  -6.386
  427   1HD1  ILE  57          HD11      ILE  57  11.691  -9.692  -4.407
  428   2HD1  ILE  57          HD12      ILE  57  10.201  -9.249  -3.574
  429   3HD1  ILE  57          HD13      ILE  57  11.687  -8.348  -3.265
  430    H    SER  58           HN       SER  58  13.109  -6.741  -3.577
  431    HA   SER  58           HA       SER  58  14.531  -4.399  -4.256
  432   1HB   SER  58          HB2       SER  58  15.376  -6.261  -2.833
  433   2HB   SER  58          HB1       SER  58  15.503  -7.258  -4.279
  434    HG   SER  58           HG       SER  58  17.280  -5.569  -3.302
  435    H    ASP  59           HN       ASP  59  16.396  -4.792  -6.009
  436    HA   ASP  59           HA       ASP  59  15.197  -4.334  -8.472
  437   1HB   ASP  59          HB2       ASP  59  17.388  -3.501  -8.111
  438   2HB   ASP  59          HB1       ASP  59  18.013  -5.101  -7.728
  439    H    ASN  60           HN       ASN  60  16.685  -7.309  -7.237
  440    HA   ASN  60           HA       ASN  60  15.458  -8.734  -9.507
  441   1HB   ASN  60          HB2       ASN  60  17.880  -8.946  -9.536
  442   2HB   ASN  60          HB1       ASN  60  17.889  -9.454  -7.852
  443   1HD2  ASN  60          HD21      ASN  60  15.632 -10.512 -10.353
  444   2HD2  ASN  60          HD22      ASN  60  16.138 -12.168 -10.337
  445    H    ASN  61           HN       ASN  61  16.528  -9.423  -6.186
  446    HA   ASN  61           HA       ASN  61  14.067 -10.077  -5.089
  447   1HB   ASN  61          HB2       ASN  61  14.203 -12.569  -5.044
  448   2HB   ASN  61          HB1       ASN  61  13.954 -11.937  -6.666
  449   1HD2  ASN  61          HD21      ASN  61  14.795 -13.651  -7.751
  450   2HD2  ASN  61          HD22      ASN  61  16.469 -14.084  -7.701
  451    H    ARG  62           HN       ARG  62  16.637  -8.878  -4.536
  452    HA   ARG  62           HA       ARG  62  18.246 -10.654  -2.982
  453   1HB   ARG  62          HB2       ARG  62  18.350  -7.635  -3.112
  454   2HB   ARG  62          HB1       ARG  62  19.617  -8.700  -2.518
  455   1HG   ARG  62          HG2       ARG  62  18.613  -8.568  -5.355
  456   2HG   ARG  62          HG1       ARG  62  20.112  -7.860  -4.752
  457   1HD   ARG  62          HD2       ARG  62  20.883 -10.115  -4.116
  458   2HD   ARG  62          HD1       ARG  62  19.406 -10.790  -4.804
  459    HE   ARG  62           HE       ARG  62  20.730  -9.209  -6.735
  460   1HH1  ARG  62          HH11      ARG  62  20.903 -12.321  -5.132
  461   2HH1  ARG  62          HH12      ARG  62  21.875 -13.041  -6.377
  462   1HH2  ARG  62          HH21      ARG  62  21.979 -10.164  -8.381
  463   2HH2  ARG  62          HH22      ARG  62  22.505 -11.817  -8.216
  464    H    ASP  63           HN       ASP  63  16.019  -8.016  -2.236
  465    HA   ASP  63           HA       ASP  63  15.957  -8.871   0.562
  466   1HB   ASP  63          HB2       ASP  63  15.848  -5.982   0.380
  467   2HB   ASP  63          HB1       ASP  63  16.888  -6.993   1.376
  468    H    LYS  64           HN       LYS  64  14.094  -8.193   1.706
  469    HA   LYS  64           HA       LYS  64  12.043  -6.764   0.200
  470   1HB   LYS  64          HB2       LYS  64  10.319  -8.352   0.652
  471   2HB   LYS  64          HB1       LYS  64  11.651  -9.240  -0.066
  472   1HG   LYS  64          HG2       LYS  64  11.612 -10.641   1.647
  473   2HG   LYS  64          HG1       LYS  64  12.031  -9.310   2.730
  474   1HD   LYS  64          HD2       LYS  64  10.015 -10.273   3.568
  475   2HD   LYS  64          HD1       LYS  64   9.582  -8.742   2.809
  476   1HE   LYS  64          HE2       LYS  64   7.973 -10.425   2.181
  477   2HE   LYS  64          HE1       LYS  64   8.924  -9.965   0.770
  478   1HZ   LYS  64          HZ1       LYS  64  10.307 -11.969   1.196
  479   2HZ   LYS  64          HZ2       LYS  64   8.701 -12.312   0.777
  480   3HZ   LYS  64          HZ3       LYS  64   9.201 -12.433   2.397
  481    H    LEU  65           HN       LEU  65  10.811  -5.439   1.453
  482    HA   LEU  65           HA       LEU  65  10.922  -5.741   4.352
  483   1HB   LEU  65          HB2       LEU  65  11.345  -3.335   4.661
  484   2HB   LEU  65          HB1       LEU  65  12.693  -4.209   3.971
  485    HG   LEU  65           HG       LEU  65  10.831  -2.747   2.149
  486   1HD1  LEU  65          HD11      LEU  65  11.365  -1.161   3.927
  487   2HD1  LEU  65          HD12      LEU  65  12.180  -0.732   2.422
  488   3HD1  LEU  65          HD13      LEU  65  13.084  -1.506   3.724
  489   1HD2  LEU  65          HD21      LEU  65  12.557  -4.178   1.187
  490   2HD2  LEU  65          HD22      LEU  65  13.796  -3.324   2.109
  491   3HD2  LEU  65          HD23      LEU  65  12.894  -2.481   0.850
  492    H    TYR  66           HN       TYR  66   8.963  -5.566   5.204
  493    HA   TYR  66           HA       TYR  66   6.751  -5.143   3.451
  494   1HB   TYR  66          HB2       TYR  66   6.726  -5.505   6.451
  495   2HB   TYR  66          HB1       TYR  66   5.360  -5.700   5.361
  496    HD1  TYR  66           HD1      TYR  66   8.429  -7.209   6.634
  497    HD2  TYR  66           HD2      TYR  66   5.190  -7.689   3.909
  498    HE1  TYR  66           HE1      TYR  66   8.980  -9.588   6.400
  499    HE2  TYR  66           HE2      TYR  66   5.742 -10.065   3.675
  500    HH   TYR  66           HH       TYR  66   7.756 -11.698   5.777
  501    H    VAL  67           HN       VAL  67   5.032  -3.640   3.705
  502    HA   VAL  67           HA       VAL  67   5.882  -1.104   4.949
  503    HB   VAL  67           HB       VAL  67   4.505   0.064   3.256
  504   1HG1  VAL  67          HG11      VAL  67   6.685  -1.697   2.158
  505   2HG1  VAL  67          HG12      VAL  67   6.892  -0.128   2.939
  506   3HG1  VAL  67          HG13      VAL  67   6.062  -0.240   1.387
  507   1HG2  VAL  67          HG21      VAL  67   3.813  -1.136   1.233
  508   2HG2  VAL  67          HG22      VAL  67   2.979  -1.734   2.668
  509   3HG2  VAL  67          HG23      VAL  67   4.310  -2.659   1.974
  510    H    ASN  68           HN       ASN  68   4.176   0.308   5.653
  511    HA   ASN  68           HA       ASN  68   1.626  -1.045   6.262
  512   1HB   ASN  68          HB2       ASN  68   3.065   0.961   8.029
  513   2HB   ASN  68          HB1       ASN  68   1.523   0.197   8.380
  514   1HD2  ASN  68          HD21      ASN  68   2.420  -2.441   7.436
  515   2HD2  ASN  68          HD22      ASN  68   3.486  -3.036   8.664
  516    H    ILE  69           HN       ILE  69  -0.053   0.002   5.333
  517    HA   ILE  69           HA       ILE  69   0.424   2.710   4.322
  518    HB   ILE  69           HB       ILE  69  -2.134   1.251   3.801
  519   1HG1  ILE  69          HG12      ILE  69  -0.374  -0.439   3.367
  520   2HG1  ILE  69          HG11      ILE  69  -1.181   0.076   1.892
  521   1HG2  ILE  69          HG21      ILE  69  -1.981   2.439   1.670
  522   2HG2  ILE  69          HG22      ILE  69  -0.404   3.074   2.137
  523   3HG2  ILE  69          HG23      ILE  69  -1.846   3.543   3.037
  524   1HD1  ILE  69          HD11      ILE  69   0.715   1.528   1.380
  525   2HD1  ILE  69          HD12      ILE  69   1.172  -0.169   1.524
  526   3HD1  ILE  69          HD13      ILE  69   1.528   0.955   2.838
  527    H    ARG  70           HN       ARG  70   0.203   3.895   6.276
  528    HA   ARG  70           HA       ARG  70  -2.287   3.523   7.763
  529   1HB   ARG  70          HB2       ARG  70   0.084   5.274   8.422
  530   2HB   ARG  70          HB1       ARG  70  -1.294   4.962   9.467
  531   1HG   ARG  70          HG2       ARG  70   0.803   2.999   8.584
  532   2HG   ARG  70          HG1       ARG  70   0.544   3.636  10.208
  533   1HD   ARG  70          HD2       ARG  70  -1.289   1.823   8.649
  534   2HD   ARG  70          HD1       ARG  70  -0.351   1.406  10.082
  535    HE   ARG  70           HE       ARG  70  -2.469   3.451  10.214
  536   1HH1  ARG  70          HH11      ARG  70  -1.052   0.439  11.294
  537   2HH1  ARG  70          HH12      ARG  70  -2.181   0.224  12.601
  538   1HH2  ARG  70          HH21      ARG  70  -4.001   3.147  11.881
  539   2HH2  ARG  70          HH22      ARG  70  -3.895   1.744  12.902
  540    HA   PRO  71           HA       PRO  71  -4.309   7.029   5.812
  541   1HB   PRO  71          HB2       PRO  71  -5.651   7.064   8.450
  542   2HB   PRO  71          HB1       PRO  71  -6.351   7.070   6.831
  543   1HG   PRO  71          HG2       PRO  71  -6.349   4.892   8.418
  544   2HG   PRO  71          HG1       PRO  71  -6.283   4.796   6.651
  545   1HD   PRO  71          HD2       PRO  71  -4.172   4.260   8.640
  546   2HD   PRO  71          HD1       PRO  71  -4.327   3.681   6.972
  547    H    MET  72           HN       MET  72  -3.700   9.090   5.825
  548    HA   MET  72           HA       MET  72  -2.058  10.094   7.956
  549   1HB   MET  72          HB2       MET  72  -1.658  10.614   5.537
  550   2HB   MET  72          HB1       MET  72  -3.144  11.557   5.538
  551   1HG   MET  72          HG2       MET  72  -2.207  13.081   7.168
  552   2HG   MET  72          HG1       MET  72  -0.734  12.115   7.250
  553   1HE   MET  72          HE1       MET  72   0.873  14.076   6.714
  554   2HE   MET  72          HE2       MET  72  -0.510  15.170   6.757
  555   3HE   MET  72          HE3       MET  72   0.623  15.233   5.408
  556    H    ASP  73           HN       ASP  73  -3.621   9.929   9.659
  557    HA   ASP  73           HA       ASP  73  -4.968  10.885  11.221
  558   1HB   ASP  73          HB2       ASP  73  -4.745  13.300   9.422
  559   2HB   ASP  73          HB1       ASP  73  -5.568  13.313  10.977
  560    H    ASN  74           HN       ASN  74  -6.080   9.577   8.713
  561    HA   ASN  74           HA       ASN  74  -8.757  10.798   8.816
  562   1HB   ASN  74          HB2       ASN  74  -7.187   9.788   6.491
  563   2HB   ASN  74          HB1       ASN  74  -8.941   9.665   6.451
  564   1HD2  ASN  74          HD21      ASN  74  -6.220  11.844   6.502
  565   2HD2  ASN  74          HD22      ASN  74  -7.099  13.262   6.042
  566    H    SER  75           HN       SER  75  -9.875   9.565  10.120
  567    HA   SER  75           HA       SER  75 -11.276   7.936  10.753
  568   1HB   SER  75          HB2       SER  75 -12.091   6.343   9.073
  569   2HB   SER  75          HB1       SER  75 -12.022   7.983   8.434
  570    HG   SER  75           HG       SER  75  -9.689   6.735   7.991
  571    H    ALA  76           HN       ALA  76 -11.563   5.396  10.773
  572    HA   ALA  76           HA       ALA  76  -9.002   4.314  11.729
  573   1HB   ALA  76          HB1       ALA  76 -10.341   2.789  13.088
  574   2HB   ALA  76          HB2       ALA  76 -11.819   3.469  12.410
  575   3HB   ALA  76          HB3       ALA  76 -10.769   4.469  13.416
  576    H    TRP  77           HN       TRP  77  -8.058   2.864  10.491
  577    HA   TRP  77           HA       TRP  77  -9.700   1.326   8.590
  578   1HB   TRP  77          HB2       TRP  77  -6.850   2.295   8.470
  579   2HB   TRP  77          HB1       TRP  77  -7.413   0.991   7.433
  580    HD1  TRP  77           HD1      TRP  77  -9.429   4.185   8.244
  581    HE1  TRP  77           HE1      TRP  77  -9.865   5.443   6.038
  582    HE3  TRP  77           HE3      TRP  77  -6.632   1.292   5.098
  583    HZ2  TRP  77           HZ2      TRP  77  -9.103   5.238   3.332
  584    HZ3  TRP  77           HZ3      TRP  77  -6.530   1.895   2.716
  585    HH2  TRP  77           HH2      TRP  77  -7.738   3.831   1.853
  586    H    THR  78           HN       THR  78  -9.348  -0.886   8.370
  587    HA   THR  78           HA       THR  78  -8.210  -2.216  10.674
  588    HB   THR  78           HB       THR  78  -9.450  -3.395   8.173
  589    HG1  THR  78           HG1      THR  78 -10.501  -2.291  10.492
  590   1HG2  THR  78          HG21      THR  78  -9.694  -5.427   9.530
  591   2HG2  THR  78          HG22      THR  78  -8.850  -4.638  10.863
  592   3HG2  THR  78          HG23      THR  78  -7.998  -4.977   9.357
  593    H    THR  79           HN       THR  79  -6.122  -2.627  10.777
  594    HA   THR  79           HA       THR  79  -4.552  -2.283   8.369
  595    HB   THR  79           HB       THR  79  -3.796  -1.003  10.205
  596    HG1  THR  79           HG1      THR  79  -2.093  -3.255   9.801
  597   1HG2  THR  79          HG21      THR  79  -3.625  -3.555  11.806
  598   2HG2  THR  79          HG22      THR  79  -4.798  -2.259  12.035
  599   3HG2  THR  79          HG23      THR  79  -3.088  -1.964  12.349
  600    H    ASP  80           HN       ASP  80  -5.005  -4.195   7.285
  601    HA   ASP  80           HA       ASP  80  -3.542  -6.523   8.299
  602   1HB   ASP  80          HB2       ASP  80  -5.479  -6.104   6.044
  603   2HB   ASP  80          HB1       ASP  80  -4.318  -7.424   5.934
  604    H    ASN  81           HN       ASN  81  -1.746  -7.349   7.084
  605    HA   ASN  81           HA       ASN  81  -0.244  -5.115   5.988
  606   1HB   ASN  81          HB2       ASN  81   0.490  -7.187   7.616
  607   2HB   ASN  81          HB1       ASN  81   1.074  -7.734   6.047
  608   1HD2  ASN  81          HD21      ASN  81   2.580  -6.390   4.907
  609   2HD2  ASN  81          HD22      ASN  81   3.562  -5.255   5.765
  610    H    GLY  82           HN       GLY  82  -2.406  -6.972   4.659
  611   1HA   GLY  82          HA2       GLY  82  -0.940  -7.123   2.103
  612   2HA   GLY  82          HA1       GLY  82  -2.144  -8.318   2.569
  613    H    VAL  83           HN       VAL  83  -3.825  -6.222   3.804
  614    HA   VAL  83           HA       VAL  83  -4.642  -4.616   1.508
  615    HB   VAL  83           HB       VAL  83  -7.024  -5.173   1.844
  616   1HG1  VAL  83          HG11      VAL  83  -7.004  -7.418   0.849
  617   2HG1  VAL  83          HG12      VAL  83  -5.302  -7.581   1.282
  618   3HG1  VAL  83          HG13      VAL  83  -5.801  -6.358   0.113
  619   1HG2  VAL  83          HG21      VAL  83  -6.007  -7.307   3.720
  620   2HG2  VAL  83          HG22      VAL  83  -7.673  -7.134   3.171
  621   3HG2  VAL  83          HG23      VAL  83  -6.943  -5.883   4.176
  622    H    PHE  84           HN       PHE  84  -5.412  -2.593   2.135
  623    HA   PHE  84           HA       PHE  84  -5.687  -2.254   5.049
  624   1HB   PHE  84          HB2       PHE  84  -3.705  -1.129   3.490
  625   2HB   PHE  84          HB1       PHE  84  -4.906   0.159   3.590
  626    HD1  PHE  84           HD1      PHE  84  -5.785   0.729   5.947
  627    HD2  PHE  84           HD2      PHE  84  -2.209  -1.456   5.216
  628    HE1  PHE  84           HE1      PHE  84  -4.992   1.277   8.208
  629    HE2  PHE  84           HE2      PHE  84  -1.406  -0.905   7.473
  630    HZ   PHE  84           HZ       PHE  84  -2.799   0.459   8.974
  631    H    TYR  85           HN       TYR  85  -7.751  -1.895   5.484
  632    HA   TYR  85           HA       TYR  85  -9.289  -0.202   3.654
  633   1HB   TYR  85          HB2       TYR  85 -11.201  -1.777   3.731
  634   2HB   TYR  85          HB1       TYR  85  -9.810  -2.449   2.906
  635    HD1  TYR  85           HD1      TYR  85 -12.355  -3.181   5.102
  636    HD2  TYR  85           HD2      TYR  85  -8.175  -3.801   4.606
  637    HE1  TYR  85           HE1      TYR  85 -12.480  -5.178   6.542
  638    HE2  TYR  85           HE2      TYR  85  -8.290  -5.799   6.037
  639    HH   TYR  85           HH       TYR  85  -9.686  -6.762   7.746
  640    H    LYS  86           HN       LYS  86 -10.722   1.112   4.631
  641    HA   LYS  86           HA       LYS  86 -10.912   1.121   7.480
  642   1HB   LYS  86          HB2       LYS  86 -12.523   2.937   7.192
  643   2HB   LYS  86          HB1       LYS  86 -11.089   3.212   6.223
  644   1HG   LYS  86          HG2       LYS  86 -12.213   2.742   4.219
  645   2HG   LYS  86          HG1       LYS  86 -13.581   2.009   5.064
  646   1HD   LYS  86          HD2       LYS  86 -14.196   4.161   5.996
  647   2HD   LYS  86          HD1       LYS  86 -12.782   4.909   5.256
  648   1HE   LYS  86          HE2       LYS  86 -13.665   4.501   3.049
  649   2HE   LYS  86          HE1       LYS  86 -15.024   3.596   3.715
  650   1HZ   LYS  86          HZ1       LYS  86 -15.966   5.532   4.601
  651   2HZ   LYS  86          HZ2       LYS  86 -15.423   6.014   3.072
  652   3HZ   LYS  86          HZ3       LYS  86 -14.535   6.424   4.455
  653    H    ASN  87           HN       ASN  87 -12.573   0.443   8.745
  654    HA   ASN  87           HA       ASN  87 -14.157  -1.722   7.880
  655   1HB   ASN  87          HB2       ASN  87 -13.459  -1.361  10.234
  656   2HB   ASN  87          HB1       ASN  87 -14.533   0.028  10.325
  657   1HD2  ASN  87          HD21      ASN  87 -15.264  -3.010   8.690
  658   2HD2  ASN  87          HD22      ASN  87 -16.545  -3.470   9.753
  659    H    ASP  88           HN       ASP  88 -14.652   1.695   7.928
  660    HA   ASP  88           HA       ASP  88 -17.484   1.701   7.620
  661   1HB   ASP  88          HB2       ASP  88 -15.505   3.840   6.786
  662   2HB   ASP  88          HB1       ASP  88 -17.234   4.053   7.054
  663    H    VAL  89           HN       VAL  89 -18.687   2.093   5.728
  664    HA   VAL  89           HA       VAL  89 -17.247   1.504   3.235
  665    HB   VAL  89           HB       VAL  89 -19.392   0.671   2.320
  666   1HG1  VAL  89          HG11      VAL  89 -19.419  -1.452   3.544
  667   2HG1  VAL  89          HG12      VAL  89 -18.460  -0.716   4.828
  668   3HG1  VAL  89          HG13      VAL  89 -17.778  -0.898   3.212
  669   1HG2  VAL  89          HG21      VAL  89 -21.249   0.150   3.825
  670   2HG2  VAL  89          HG22      VAL  89 -20.934   1.886   3.784
  671   3HG2  VAL  89          HG23      VAL  89 -20.393   0.924   5.161
  672    H    GLY  90           HN       GLY  90 -17.113   3.124   1.838
  673   1HA   GLY  90          HA2       GLY  90 -18.890   4.620   0.612
  674   2HA   GLY  90          HA1       GLY  90 -18.907   5.417   2.179
  675    H    SER  91           HN       SER  91 -18.284   7.180   0.554
  676    HA   SER  91           HA       SER  91 -15.802   7.338  -0.651
  677   1HB   SER  91          HB2       SER  91 -16.133   9.846  -0.347
  678   2HB   SER  91          HB1       SER  91 -17.434   8.979  -1.164
  679    HG   SER  91           HG       SER  91 -17.619   9.200   1.612
  680    H    TRP  92           HN       TRP  92 -13.819   8.127  -0.042
  681    HA   TRP  92           HA       TRP  92 -13.383   8.551   2.836
  682   1HB   TRP  92          HB2       TRP  92 -12.628   6.286   2.061
  683   2HB   TRP  92          HB1       TRP  92 -11.459   7.113   1.022
  684    HD1  TRP  92           HD1      TRP  92 -12.348   6.770   4.758
  685    HE1  TRP  92           HE1      TRP  92 -10.216   7.182   6.129
  686    HE3  TRP  92           HE3      TRP  92  -9.206   8.011   0.949
  687    HZ2  TRP  92           HZ2      TRP  92  -7.532   7.927   5.636
  688    HZ3  TRP  92           HZ3      TRP  92  -6.903   8.578   1.479
  689    HH2  TRP  92           HH2      TRP  92  -6.059   8.528   3.769
  690    H    GLY  93           HN       GLY  93 -11.894   8.861  -0.336
  691   1HA   GLY  93          HA2       GLY  93 -10.397  10.426  -1.167
  692   2HA   GLY  93          HA1       GLY  93 -11.735  11.470  -0.767
  693    H    GLY  94           HN       GLY  94  -8.586  10.336   0.187
  694   1HA   GLY  94          HA2       GLY  94  -8.098  12.798   1.609
  695   2HA   GLY  94          HA1       GLY  94  -8.141  11.379   2.647
  696    H    THR  95           HN       THR  95  -6.099  10.972   3.186
  697    HA   THR  95           HA       THR  95  -4.215  10.388   1.040
  698    HB   THR  95           HB       THR  95  -2.468  11.526   2.719
  699    HG1  THR  95           HG1      THR  95  -4.879  13.036   3.012
  700   1HG2  THR  95          HG21      THR  95  -2.497  13.506   1.270
  701   2HG2  THR  95          HG22      THR  95  -4.072  13.021   0.643
  702   3HG2  THR  95          HG23      THR  95  -2.653  12.018   0.340
  703    H    ILE  96           HN       ILE  96  -3.122   8.570   1.393
  704    HA   ILE  96           HA       ILE  96  -2.750   7.660   4.168
  705    HB   ILE  96           HB       ILE  96  -2.600   5.300   3.034
  706   1HG1  ILE  96          HG12      ILE  96  -4.501   5.196   1.269
  707   2HG1  ILE  96          HG11      ILE  96  -4.161   6.906   1.034
  708   1HG2  ILE  96          HG21      ILE  96  -4.173   5.728   4.742
  709   2HG2  ILE  96          HG22      ILE  96  -5.055   4.984   3.407
  710   3HG2  ILE  96          HG23      ILE  96  -5.164   6.724   3.678
  711   1HD1  ILE  96          HD11      ILE  96  -1.869   6.375   0.440
  712   2HD1  ILE  96          HD12      ILE  96  -3.017   5.526  -0.596
  713   3HD1  ILE  96          HD13      ILE  96  -2.193   4.661   0.701
  714    H    GLY  97           HN       GLY  97  -0.705   6.727   4.635
  715   1HA   GLY  97          HA2       GLY  97   1.309   7.410   2.583
  716   2HA   GLY  97          HA1       GLY  97   1.546   7.710   4.299
  717    H    ILE  98           HN       ILE  98   3.164   6.137   2.433
  718    HA   ILE  98           HA       ILE  98   2.827   3.456   3.526
  719    HB   ILE  98           HB       ILE  98   4.627   4.517   1.347
  720   1HG1  ILE  98          HG12      ILE  98   2.346   2.539   1.330
  721   2HG1  ILE  98          HG11      ILE  98   2.224   4.215   0.814
  722   1HG2  ILE  98          HG21      ILE  98   4.448   1.701   2.411
  723   2HG2  ILE  98          HG22      ILE  98   5.820   2.791   2.600
  724   3HG2  ILE  98          HG23      ILE  98   5.366   2.215   0.997
  725   1HD1  ILE  98          HD11      ILE  98   2.400   2.764  -1.102
  726   2HD1  ILE  98          HD12      ILE  98   3.892   2.066  -0.473
  727   3HD1  ILE  98          HD13      ILE  98   3.853   3.756  -0.973
  728    H    TYR  99           HN       TYR  99   3.666   3.109   5.401
  729    HA   TYR  99           HA       TYR  99   6.228   4.320   6.176
  730   1HB   TYR  99          HB2       TYR  99   4.246   2.785   7.886
  731   2HB   TYR  99          HB1       TYR  99   5.621   3.719   8.456
  732    HD1  TYR  99           HD1      TYR  99   5.101   5.761   9.442
  733    HD2  TYR  99           HD2      TYR  99   2.570   4.281   6.369
  734    HE1  TYR  99           HE1      TYR  99   3.651   7.728   9.695
  735    HE2  TYR  99           HE2      TYR  99   1.112   6.240   6.612
  736    HH   TYR  99           HH       TYR  99   2.008   8.999   8.370
  737    H    VAL 100           HN       VAL 100   7.869   2.845   7.097
  738    HA   VAL 100           HA       VAL 100   7.725   0.210   5.878
  739    HB   VAL 100           HB       VAL 100   9.853   1.619   5.881
  740   1HG1  VAL 100          HG11      VAL 100  11.313   1.387   7.824
  741   2HG1  VAL 100          HG12      VAL 100  10.001   0.613   8.715
  742   3HG1  VAL 100          HG13      VAL 100   9.852   2.296   8.208
  743   1HG2  VAL 100          HG21      VAL 100   9.984  -1.211   6.899
  744   2HG2  VAL 100          HG22      VAL 100  11.283  -0.343   6.080
  745   3HG2  VAL 100          HG23      VAL 100   9.791  -0.715   5.219
  746    H    ASP 101           HN       ASP 101   7.378  -1.653   6.949
  747    HA   ASP 101           HA       ASP 101   5.993  -1.536   9.390
  748   1HB   ASP 101          HB2       ASP 101   5.635  -3.285   7.683
  749   2HB   ASP 101          HB1       ASP 101   7.215  -3.961   8.064
  750    H    GLY 102           HN       GLY 102   7.078  -0.759  11.119
  751   1HA   GLY 102          HA2       GLY 102   8.204  -1.035  13.093
  752   2HA   GLY 102          HA1       GLY 102   8.599  -2.664  12.577
  753    H    GLN 103           HN       GLN 103   9.525   0.069  10.611
  754    HA   GLN 103           HA       GLN 103  11.553   0.744   9.855
  755   1HB   GLN 103          HB2       GLN 103  11.676   1.671  12.156
  756   2HB   GLN 103          HB1       GLN 103  12.490   0.200  12.675
  757   1HG   GLN 103          HG2       GLN 103  14.318   0.670  11.117
  758   2HG   GLN 103          HG1       GLN 103  13.505   2.153  10.621
  759   1HE2  GLN 103          HE21      GLN 103  15.182   3.469  11.293
  760   2HE2  GLN 103          HE22      GLN 103  15.526   3.754  12.963
  761    H    GLN 104           HN       GLN 104  12.201  -0.708   8.376
  762    HA   GLN 104           HA       GLN 104  13.107  -3.330   9.181
  763   1HB   GLN 104          HB2       GLN 104  12.643  -2.035   6.504
  764   2HB   GLN 104          HB1       GLN 104  13.348  -3.641   6.663
  765   1HG   GLN 104          HG2       GLN 104  10.693  -2.878   7.853
  766   2HG   GLN 104          HG1       GLN 104  10.874  -3.564   6.240
  767   1HE2  GLN 104          HE21      GLN 104   9.576  -4.547   8.738
  768   2HE2  GLN 104          HE22      GLN 104  10.255  -6.118   9.003
  769    H    THR 105           HN       THR 105  14.597  -0.601   9.428
  770    HA   THR 105           HA       THR 105  16.763  -0.183   9.954
  771    HB   THR 105           HB       THR 105  17.419  -2.960   8.950
  772    HG1  THR 105           HG1      THR 105  16.738  -3.721  10.862
  773   1HG2  THR 105          HG21      THR 105  19.253  -2.833  10.562
  774   2HG2  THR 105          HG22      THR 105  18.762  -1.195  10.998
  775   3HG2  THR 105          HG23      THR 105  19.365  -1.532   9.375
  776    H    ASN 106           HN       ASN 106  15.617  -0.674   6.906
  777    HA   ASN 106           HA       ASN 106  16.241  -0.090   4.818
  778   1HB   ASN 106          HB2       ASN 106  16.817   2.055   5.785
  779   2HB   ASN 106          HB1       ASN 106  18.371   1.439   6.313
  780   1HD2  ASN 106          HD21      ASN 106  20.026   1.203   4.813
  781   2HD2  ASN 106          HD22      ASN 106  19.966   1.943   3.247
  782    H    THR 107           HN       THR 107  16.681  -2.196   4.288
  783    HA   THR 107           HA       THR 107  19.239  -3.419   4.659
  784    HB   THR 107           HB       THR 107  17.215  -4.302   2.611
  785    HG1  THR 107           HG1      THR 107  16.393  -5.486   4.674
  786   1HG2  THR 107          HG21      THR 107  19.292  -5.597   2.854
  787   2HG2  THR 107          HG22      THR 107  17.882  -6.539   3.339
  788   3HG2  THR 107          HG23      THR 107  18.939  -5.837   4.564
  789    HA   PRO 108           HA       PRO 108  21.909  -1.705   1.597
  790   1HB   PRO 108          HB2       PRO 108  22.151  -4.333   0.337
  791   2HB   PRO 108          HB1       PRO 108  23.374  -3.364   1.156
  792   1HG   PRO 108          HG2       PRO 108  21.780  -5.563   2.200
  793   2HG   PRO 108          HG1       PRO 108  23.182  -4.762   2.925
  794   1HD   PRO 108          HD2       PRO 108  20.665  -4.554   3.938
  795   2HD   PRO 108          HD1       PRO 108  21.876  -3.262   4.090
  796    HA   PRO 109           HA       PRO 109  18.484  -1.711  -1.352
  797   1HB   PRO 109          HB2       PRO 109  17.921   0.884  -1.255
  798   2HB   PRO 109          HB1       PRO 109  17.555  -0.186   0.102
  799   1HG   PRO 109          HG2       PRO 109  19.746   1.804  -0.202
  800   2HG   PRO 109          HG1       PRO 109  18.859   1.323   1.253
  801   1HD   PRO 109          HD2       PRO 109  21.399   0.395   0.433
  802   2HD   PRO 109          HD1       PRO 109  20.391  -0.264   1.745
  803    H    GLY 110           HN       GLY 110  17.924   0.206  -3.059
  804   1HA   GLY 110          HA2       GLY 110  19.874   1.413  -4.592
  805   2HA   GLY 110          HA1       GLY 110  19.747  -0.247  -5.178
  806    H    ASN 111           HN       ASN 111  17.567  -1.016  -5.722
  807    HA   ASN 111           HA       ASN 111  15.659   1.113  -6.393
  808   1HB   ASN 111          HB2       ASN 111  17.035   0.335  -8.405
  809   2HB   ASN 111          HB1       ASN 111  16.219  -1.218  -8.234
  810   1HD2  ASN 111          HD21      ASN 111  15.983   2.034  -9.256
  811   2HD2  ASN 111          HD22      ASN 111  14.384   1.951  -9.922
  812    H    TYR 112           HN       TYR 112  13.648   0.638  -5.653
  813    HA   TYR 112           HA       TYR 112  13.003  -2.194  -5.217
  814   1HB   TYR 112          HB2       TYR 112  12.581   0.067  -3.271
  815   2HB   TYR 112          HB1       TYR 112  11.658  -1.428  -3.190
  816    HD1  TYR 112           HD1      TYR 112  12.624  -3.435  -2.377
  817    HD2  TYR 112           HD2      TYR 112  15.035   0.025  -2.881
  818    HE1  TYR 112           HE1      TYR 112  14.413  -4.501  -1.085
  819    HE2  TYR 112           HE2      TYR 112  16.841  -1.038  -1.588
  820    HH   TYR 112           HH       TYR 112  17.005  -2.869   0.194
  821    H    THR 113           HN       THR 113  11.019  -2.826  -5.737
  822    HA   THR 113           HA       THR 113   9.219  -0.791  -6.867
  823    HB   THR 113           HB       THR 113   9.425  -3.740  -7.514
  824    HG1  THR 113           HG1      THR 113  11.154  -2.792  -8.456
  825   1HG2  THR 113          HG21      THR 113   7.149  -2.871  -7.817
  826   2HG2  THR 113          HG22      THR 113   7.900  -3.228  -9.371
  827   3HG2  THR 113          HG23      THR 113   7.777  -1.559  -8.814
  828    H    LEU 114           HN       LEU 114   7.338  -0.494  -5.870
  829    HA   LEU 114           HA       LEU 114   6.067  -2.758  -4.569
  830   1HB   LEU 114          HB2       LEU 114   5.371  -1.174  -2.675
  831   2HB   LEU 114          HB1       LEU 114   6.983  -1.861  -2.639
  832    HG   LEU 114           HG       LEU 114   6.596   0.833  -3.845
  833   1HD1  LEU 114          HD11      LEU 114   5.390   0.932  -1.716
  834   2HD1  LEU 114          HD12      LEU 114   6.875   1.880  -1.660
  835   3HD1  LEU 114          HD13      LEU 114   6.811   0.296  -0.887
  836   1HD2  LEU 114          HD21      LEU 114   8.823  -0.402  -2.240
  837   2HD2  LEU 114          HD22      LEU 114   8.844   1.198  -2.981
  838   3HD2  LEU 114          HD23      LEU 114   8.779  -0.242  -3.996
  839    H    THR 115           HN       THR 115   4.692  -2.805  -6.274
  840    HA   THR 115           HA       THR 115   3.176  -0.452  -7.029
  841    HB   THR 115           HB       THR 115   2.969  -3.279  -8.085
  842    HG1  THR 115           HG1      THR 115   4.485  -2.671  -9.606
  843   1HG2  THR 115          HG21      THR 115   2.127  -0.624  -9.258
  844   2HG2  THR 115          HG22      THR 115   1.051  -1.885  -8.655
  845   3HG2  THR 115          HG23      THR 115   2.040  -2.179 -10.085
  846    H    LEU 116           HN       LEU 116   1.081  -0.095  -6.545
  847    HA   LEU 116           HA       LEU 116  -0.296  -2.128  -4.917
  848   1HB   LEU 116          HB2       LEU 116  -0.146   0.840  -4.647
  849   2HB   LEU 116          HB1       LEU 116  -1.546  -0.015  -4.035
  850    HG   LEU 116           HG       LEU 116   0.112  -1.411  -2.667
  851   1HD1  LEU 116          HD11      LEU 116   1.923   0.897  -3.358
  852   2HD1  LEU 116          HD12      LEU 116   2.137  -0.775  -3.875
  853   3HD1  LEU 116          HD13      LEU 116   2.247  -0.363  -2.164
  854   1HD2  LEU 116          HD21      LEU 116   0.214   0.266  -0.904
  855   2HD2  LEU 116          HD22      LEU 116  -1.359   0.268  -1.700
  856   3HD2  LEU 116          HD23      LEU 116  -0.182   1.526  -2.073
  857    H    THR 117           HN       THR 117  -1.947  -2.968  -5.938
  858    HA   THR 117           HA       THR 117  -3.215  -1.562  -8.140
  859    HB   THR 117           HB       THR 117  -3.734  -4.352  -7.085
  860    HG1  THR 117           HG1      THR 117  -1.828  -3.266  -8.828
  861   1HG2  THR 117          HG21      THR 117  -4.761  -4.736  -9.276
  862   2HG2  THR 117          HG22      THR 117  -4.463  -3.055  -9.718
  863   3HG2  THR 117          HG23      THR 117  -5.587  -3.438  -8.413
  864    H    GLY 118           HN       GLY 118  -4.831  -0.231  -7.703
  865   1HA   GLY 118          HA2       GLY 118  -6.194  -0.188  -5.221
  866   2HA   GLY 118          HA1       GLY 118  -6.624   0.735  -6.654
  867    H    GLY 119           HN       GLY 119  -8.245  -0.777  -4.662
  868   1HA   GLY 119          HA2       GLY 119 -10.178  -1.782  -6.460
  869   2HA   GLY 119          HA1       GLY 119  -9.304  -3.120  -5.722
  870    H    TYR 120           HN       TYR 120 -11.869  -3.166  -5.156
  871    HA   TYR 120           HA       TYR 120 -12.088  -1.821  -2.565
  872   1HB   TYR 120          HB2       TYR 120 -14.446  -2.153  -2.618
  873   2HB   TYR 120          HB1       TYR 120 -13.969  -1.511  -4.179
  874    HD1  TYR 120           HD1      TYR 120 -15.102  -4.559  -2.404
  875    HD2  TYR 120           HD2      TYR 120 -14.402  -2.722  -6.185
  876    HE1  TYR 120           HE1      TYR 120 -16.371  -6.347  -3.507
  877    HE2  TYR 120           HE2      TYR 120 -15.667  -4.518  -7.292
  878    HH   TYR 120           HH       TYR 120 -16.431  -6.724  -6.945
  879    H    TRP 121           HN       TRP 121 -13.646  -3.316  -1.123
  880    HA   TRP 121           HA       TRP 121 -12.696  -6.044  -1.042
  881   1HB   TRP 121          HB2       TRP 121 -10.866  -5.135   0.127
  882   2HB   TRP 121          HB1       TRP 121 -11.851  -3.908   0.912
  883    HD1  TRP 121           HD1      TRP 121 -13.591  -4.877   2.812
  884    HE1  TRP 121           HE1      TRP 121 -13.265  -6.765   4.516
  885    HE3  TRP 121           HE3      TRP 121  -9.629  -7.272   0.634
  886    HZ2  TRP 121           HZ2      TRP 121 -11.575  -8.930   4.898
  887    HZ3  TRP 121           HZ3      TRP 121  -8.725  -9.265   1.799
  888    HH2  TRP 121           HH2      TRP 121  -9.693 -10.062   3.845
  889    H    ALA 122           HN       ALA 122 -14.120  -7.341   0.099
  890    HA   ALA 122           HA       ALA 122 -16.286  -5.987   1.554
  891   1HB   ALA 122          HB1       ALA 122 -17.094  -6.880  -0.582
  892   2HB   ALA 122          HB2       ALA 122 -17.829  -7.705   0.793
  893   3HB   ALA 122          HB3       ALA 122 -16.535  -8.487  -0.116
  894    H    LYS 123           HN       LYS 123 -16.971  -6.925   3.438
  895    HA   LYS 123           HA       LYS 123 -17.027  -8.212   5.293
  896   1HB   LYS 123          HB2       LYS 123 -17.029 -10.100   3.544
  897   2HB   LYS 123          HB1       LYS 123 -15.329 -10.291   3.938
  898   1HG   LYS 123          HG2       LYS 123 -16.458 -11.896   5.222
  899   2HG   LYS 123          HG1       LYS 123 -16.061 -10.597   6.347
  900   1HD   LYS 123          HD2       LYS 123 -18.727 -10.784   4.968
  901   2HD   LYS 123          HD1       LYS 123 -18.401 -11.591   6.499
  902   1HE   LYS 123          HE2       LYS 123 -17.868  -9.433   7.521
  903   2HE   LYS 123          HE1       LYS 123 -18.182  -8.626   5.985
  904   1HZ   LYS 123          HZ1       LYS 123 -20.473  -9.435   6.097
  905   2HZ   LYS 123          HZ2       LYS 123 -20.091  -8.452   7.427
  906   3HZ   LYS 123          HZ3       LYS 123 -20.159 -10.137   7.608
  907    H    ASP 124           HN       ASP 124 -14.526 -10.084   5.728
  908    HA   ASP 124           HA       ASP 124 -12.360  -8.252   6.070
  909   1HB   ASP 124          HB2       ASP 124 -12.264  -8.428   8.557
  910   2HB   ASP 124          HB1       ASP 124 -13.644  -7.505   7.974
  911    H    ASN 125           HN       ASN 125 -10.501  -9.309   6.079
  912    HA   ASN 125           HA       ASN 125  -8.896 -10.892   6.275
  913   1HB   ASN 125          HB2       ASN 125  -9.693 -11.102   8.546
  914   2HB   ASN 125          HB1       ASN 125 -10.881 -12.290   8.036
  915   1HD2  ASN 125          HD21      ASN 125 -10.148 -13.972   9.230
  916   2HD2  ASN 125          HD22      ASN 125  -8.614 -14.737   8.977
  917    H    LYS 126           HN       LYS 126 -12.084 -12.269   5.613
  918    HA   LYS 126           HA       LYS 126 -11.210 -14.696   4.476
  919   1HB   LYS 126          HB2       LYS 126 -13.467 -14.912   3.643
  920   2HB   LYS 126          HB1       LYS 126 -13.520 -14.227   5.258
  921   1HG   LYS 126          HG2       LYS 126 -14.962 -12.783   4.330
  922   2HG   LYS 126          HG1       LYS 126 -13.501 -11.968   3.764
  923   1HD   LYS 126          HD2       LYS 126 -13.632 -13.206   1.655
  924   2HD   LYS 126          HD1       LYS 126 -15.086 -14.029   2.223
  925   1HE   LYS 126          HE2       LYS 126 -16.124 -11.745   2.472
  926   2HE   LYS 126          HE1       LYS 126 -14.730 -11.111   1.611
  927   1HZ   LYS 126          HZ1       LYS 126 -16.725 -13.053   0.588
  928   2HZ   LYS 126          HZ2       LYS 126 -15.299 -12.660  -0.229
  929   3HZ   LYS 126          HZ3       LYS 126 -16.472 -11.467   0.044
  930    H    GLN 127           HN       GLN 127 -10.726 -11.650   3.436
  931    HA   GLN 127           HA       GLN 127  -9.889 -10.678   1.613
  932   1HB   GLN 127          HB2       GLN 127  -8.526 -12.869   1.627
  933   2HB   GLN 127          HB1       GLN 127  -9.550 -13.337   0.272
  934   1HG   GLN 127          HG2       GLN 127  -8.837 -11.403  -0.985
  935   2HG   GLN 127          HG1       GLN 127  -7.890 -10.828   0.384
  936   1HE2  GLN 127          HE21      GLN 127  -7.013 -13.589   1.018
  937   2HE2  GLN 127          HE22      GLN 127  -5.789 -13.950  -0.143
  938    H    GLY 128           HN       GLY 128 -12.159  -9.984   1.441
  939   1HA   GLY 128          HA2       GLY 128 -13.503 -11.066  -0.909
  940   2HA   GLY 128          HA1       GLY 128 -14.175  -9.888   0.214
  941    H    PHE 129           HN       PHE 129 -11.100  -9.921  -1.527
  942    HA   PHE 129           HA       PHE 129 -11.404  -7.106  -2.032
  943   1HB   PHE 129          HB2       PHE 129  -9.116  -7.127  -2.456
  944   2HB   PHE 129          HB1       PHE 129  -9.279  -8.437  -1.307
  945    HD1  PHE 129           HD1      PHE 129  -9.658 -10.809  -2.387
  946    HD2  PHE 129           HD2      PHE 129  -7.887  -7.487  -4.376
  947    HE1  PHE 129           HE1      PHE 129  -8.554 -12.345  -3.962
  948    HE2  PHE 129           HE2      PHE 129  -6.782  -9.017  -5.952
  949    HZ   PHE 129           HZ       PHE 129  -7.117 -11.435  -5.763
  950    H    THR 130           HN       THR 130 -11.298  -6.149  -4.122
  951    HA   THR 130           HA       THR 130 -11.172  -7.842  -6.473
  952    HB   THR 130           HB       THR 130 -13.592  -6.072  -6.036
  953    HG1  THR 130           HG1      THR 130 -13.122  -8.672  -5.385
  954   1HG2  THR 130          HG21      THR 130 -12.887  -7.934  -8.309
  955   2HG2  THR 130          HG22      THR 130 -12.853  -6.172  -8.370
  956   3HG2  THR 130          HG23      THR 130 -14.385  -7.016  -8.150
  957    HA   PRO 131           HA       PRO 131  -8.776  -4.216  -7.621
  958   1HB   PRO 131          HB2       PRO 131  -9.090  -5.407 -10.328
  959   2HB   PRO 131          HB1       PRO 131  -7.621  -4.921  -9.473
  960   1HG   PRO 131          HG2       PRO 131  -8.249  -7.497  -9.745
  961   2HG   PRO 131          HG1       PRO 131  -7.525  -6.884  -8.246
  962   1HD   PRO 131          HD2       PRO 131 -10.370  -7.602  -8.825
  963   2HD   PRO 131          HD1       PRO 131  -9.418  -7.869  -7.350
  964    H    SER 132           HN       SER 132  -9.496  -2.233  -8.082
  965    HA   SER 132           HA       SER 132 -11.488  -1.754 -10.118
  966   1HB   SER 132          HB2       SER 132 -12.110  -1.076  -7.229
  967   2HB   SER 132          HB1       SER 132 -13.111  -0.688  -8.628
  968    HG   SER 132           HG       SER 132 -12.624  -3.291  -8.693
  969    H    GLY 133           HN       GLY 133 -10.427  -0.171 -11.168
  970   1HA   GLY 133          HA2       GLY 133 -10.171   2.285 -11.100
  971   2HA   GLY 133          HA1       GLY 133  -9.415   2.073  -9.528
  972    H    THR 134           HN       THR 134  -7.325   2.495  -9.660
  973    HA   THR 134           HA       THR 134  -5.879   1.635 -12.077
  974    HB   THR 134           HB       THR 134  -4.285   3.566 -11.407
  975    HG1  THR 134           HG1      THR 134  -6.683   4.287 -10.037
  976   1HG2  THR 134          HG21      THR 134  -7.038   4.170 -12.500
  977   2HG2  THR 134          HG22      THR 134  -5.664   3.579 -13.432
  978   3HG2  THR 134          HG23      THR 134  -5.608   5.182 -12.698
  979    H    THR 135           HN       THR 135  -3.718   0.939 -11.819
  980    HA   THR 135           HA       THR 135  -3.010   0.174  -9.072
  981    HB   THR 135           HB       THR 135  -3.238  -1.763 -10.518
  982    HG1  THR 135           HG1      THR 135  -0.763  -2.311 -10.486
  983   1HG2  THR 135          HG21      THR 135  -1.161  -0.469 -12.286
  984   2HG2  THR 135          HG22      THR 135  -2.856  -0.751 -12.690
  985   3HG2  THR 135          HG23      THR 135  -1.765  -2.119 -12.457
  986    H    GLY 136           HN       GLY 136  -1.525   1.404  -8.157
  987   1HA   GLY 136          HA2       GLY 136   0.089   3.148  -9.879
  988   2HA   GLY 136          HA1       GLY 136  -0.239   3.404  -8.171
  989    H    THR 137           HN       THR 137   2.184   2.860 -10.161
  990    HA   THR 137           HA       THR 137   3.510   0.754  -8.643
  991    HB   THR 137           HB       THR 137   4.458   2.318 -11.056
  992    HG1  THR 137           HG1      THR 137   2.703   0.892 -11.504
  993   1HG2  THR 137          HG21      THR 137   6.195   0.591 -11.238
  994   2HG2  THR 137          HG22      THR 137   5.631  -0.130  -9.730
  995   3HG2  THR 137          HG23      THR 137   6.334   1.488  -9.725
  996    H    THR 138           HN       THR 138   4.112   1.592  -6.672
  997    HA   THR 138           HA       THR 138   5.501   4.115  -6.531
  998    HB   THR 138           HB       THR 138   5.292   1.987  -4.388
  999    HG1  THR 138           HG1      THR 138   3.259   2.576  -4.372
 1000   1HG2  THR 138          HG21      THR 138   5.922   4.934  -4.246
 1001   2HG2  THR 138          HG22      THR 138   7.052   3.612  -3.963
 1002   3HG2  THR 138          HG23      THR 138   5.703   3.870  -2.858
 1003    H    LYS 139           HN       LYS 139   7.450   4.256  -7.354
 1004    HA   LYS 139           HA       LYS 139   9.275   1.954  -7.132
 1005   1HB   LYS 139          HB2       LYS 139   8.688   2.678  -9.459
 1006   2HB   LYS 139          HB1       LYS 139   9.390   4.250  -9.106
 1007   1HG   LYS 139          HG2       LYS 139  11.061   3.114 -10.262
 1008   2HG   LYS 139          HG1       LYS 139  11.537   2.980  -8.572
 1009   1HD   LYS 139          HD2       LYS 139  11.836   0.851  -9.705
 1010   2HD   LYS 139          HD1       LYS 139  10.560   0.722  -8.492
 1011   1HE   LYS 139          HE2       LYS 139   8.860   0.770 -10.137
 1012   2HE   LYS 139          HE1       LYS 139   9.986   1.296 -11.386
 1013   1HZ   LYS 139          HZ1       LYS 139   9.453  -1.038 -11.635
 1014   2HZ   LYS 139          HZ2       LYS 139   9.992  -1.367 -10.059
 1015   3HZ   LYS 139          HZ3       LYS 139  11.092  -0.853 -11.242
 1016    H    LEU 140           HN       LEU 140  10.591   2.192  -5.555
 1017    HA   LEU 140           HA       LEU 140  11.345   4.900  -4.750
 1018   1HB   LEU 140          HB2       LEU 140  10.195   3.917  -2.980
 1019   2HB   LEU 140          HB1       LEU 140  10.924   2.345  -3.242
 1020    HG   LEU 140           HG       LEU 140  13.059   3.205  -2.413
 1021   1HD1  LEU 140          HD11      LEU 140  12.780   5.550  -3.023
 1022   2HD1  LEU 140          HD12      LEU 140  13.160   5.384  -1.308
 1023   3HD1  LEU 140          HD13      LEU 140  11.504   5.722  -1.817
 1024   1HD2  LEU 140          HD21      LEU 140  10.709   3.599  -0.572
 1025   2HD2  LEU 140          HD22      LEU 140  12.388   3.473  -0.046
 1026   3HD2  LEU 140          HD23      LEU 140  11.610   2.108  -0.846
 1027    H    THR 141           HN       THR 141  13.186   5.413  -5.644
 1028    HA   THR 141           HA       THR 141  15.379   3.469  -5.772
 1029    HB   THR 141           HB       THR 141  15.200   6.233  -7.007
 1030    HG1  THR 141           HG1      THR 141  13.889   4.065  -7.677
 1031   1HG2  THR 141          HG21      THR 141  17.064   5.482  -8.399
 1032   2HG2  THR 141          HG22      THR 141  17.080   3.931  -7.560
 1033   3HG2  THR 141          HG23      THR 141  17.497   5.408  -6.690
 1034    H    VAL 142           HN       VAL 142  17.376   3.908  -4.756
 1035    HA   VAL 142           HA       VAL 142  17.098   5.377  -2.318
 1036    HB   VAL 142           HB       VAL 142  19.499   3.997  -3.500
 1037   1HG1  VAL 142          HG11      VAL 142  20.164   5.696  -1.857
 1038   2HG1  VAL 142          HG12      VAL 142  20.438   4.064  -1.249
 1039   3HG1  VAL 142          HG13      VAL 142  19.049   4.991  -0.685
 1040   1HG2  VAL 142          HG21      VAL 142  17.630   2.519  -3.080
 1041   2HG2  VAL 142          HG22      VAL 142  17.491   3.139  -1.435
 1042   3HG2  VAL 142          HG23      VAL 142  18.923   2.231  -1.916
 1043    H    THR 143           HN       THR 143  17.610   7.360  -1.864
 1044    HA   THR 143           HA       THR 143  19.947   8.619  -2.971
 1045    HB   THR 143           HB       THR 143  17.229   9.905  -3.349
 1046    HG1  THR 143           HG1      THR 143  18.433   8.224  -4.891
 1047   1HG2  THR 143          HG21      THR 143  18.927  11.545  -2.692
 1048   2HG2  THR 143          HG22      THR 143  18.464  11.755  -4.382
 1049   3HG2  THR 143          HG23      THR 143  19.990  10.966  -3.976
  Start of MODEL    3
    1    H    GLU   1           H        GLU   1 -20.759  -2.245  -4.528
    2    HA   GLU   1           HA       GLU   1 -22.050  -0.678  -6.678
    3   1HB   GLU   1          HB2       GLU   1 -20.886   0.099  -4.011
    4   2HB   GLU   1          HB1       GLU   1 -21.063   1.258  -5.323
    5   1HG   GLU   1          HG2       GLU   1 -23.275  -0.298  -3.999
    6   2HG   GLU   1          HG1       GLU   1 -22.926   1.419  -3.795
    7    H    GLU   2           HN       GLU   2 -20.476   1.015  -7.467
    8    HA   GLU   2           HA       GLU   2 -18.052  -0.398  -8.271
    9   1HB   GLU   2          HB2       GLU   2 -19.398   0.488 -10.073
   10   2HB   GLU   2          HB1       GLU   2 -19.413   2.085  -9.338
   11   1HG   GLU   2          HG2       GLU   2 -16.975   2.227  -9.682
   12   2HG   GLU   2          HG1       GLU   2 -17.027   0.666 -10.501
   13    H    CYS   3           HN       CYS   3 -16.193   0.048  -7.329
   14    HA   CYS   3           HA       CYS   3 -15.879   2.694  -6.086
   15   1HB   CYS   3          HB2       CYS   3 -15.295  -0.011  -5.040
   16   2HB   CYS   3          HB1       CYS   3 -14.089   1.229  -4.702
   17    H    GLN   4           HN       GLN   4 -14.761   3.773  -7.583
   18    HA   GLN   4           HA       GLN   4 -12.503   2.514  -8.907
   19   1HB   GLN   4          HB2       GLN   4 -13.493   5.369  -9.058
   20   2HB   GLN   4          HB1       GLN   4 -12.282   4.639 -10.102
   21   1HG   GLN   4          HG2       GLN   4 -15.151   3.758  -9.930
   22   2HG   GLN   4          HG1       GLN   4 -14.507   4.861 -11.142
   23   1HE2  GLN   4          HE21      GLN   4 -15.030   3.539 -12.836
   24   2HE2  GLN   4          HE22      GLN   4 -14.209   2.046 -13.161
   25    H    VAL   5           HN       VAL   5 -10.732   2.293  -7.713
   26    HA   VAL   5           HA       VAL   5 -10.001   4.417  -5.849
   27    HB   VAL   5           HB       VAL   5  -8.742   1.697  -6.283
   28   1HG1  VAL   5          HG11      VAL   5  -7.112   3.306  -5.467
   29   2HG1  VAL   5          HG12      VAL   5  -7.531   2.156  -4.197
   30   3HG1  VAL   5          HG13      VAL   5  -8.208   3.784  -4.171
   31   1HG2  VAL   5          HG21      VAL   5 -10.519   2.706  -4.060
   32   2HG2  VAL   5          HG22      VAL   5  -9.777   1.108  -4.150
   33   3HG2  VAL   5          HG23      VAL   5 -10.997   1.580  -5.333
   34    H    ARG   6           HN       ARG   6  -8.885   6.018  -6.655
   35    HA   ARG   6           HA       ARG   6  -7.318   5.661  -9.058
   36   1HB   ARG   6          HB2       ARG   6  -7.922   8.090  -7.374
   37   2HB   ARG   6          HB1       ARG   6  -6.894   8.131  -8.801
   38   1HG   ARG   6          HG2       ARG   6  -9.799   7.337  -8.731
   39   2HG   ARG   6          HG1       ARG   6  -9.148   8.867  -9.323
   40   1HD   ARG   6          HD2       ARG   6  -7.927   7.693 -11.068
   41   2HD   ARG   6          HD1       ARG   6  -8.505   6.146 -10.454
   42    HE   ARG   6           HE       ARG   6 -10.547   8.052 -11.229
   43   1HH1  ARG   6          HH11      ARG   6  -8.576   5.319 -12.151
   44   2HH1  ARG   6          HH12      ARG   6  -9.624   4.820 -13.443
   45   1HH2  ARG   6          HH21      ARG   6 -11.961   7.388 -12.918
   46   2HH2  ARG   6          HH22      ARG   6 -11.578   5.962 -13.838
   47    H    VAL   7           HN       VAL   7  -5.545   4.520  -8.630
   48    HA   VAL   7           HA       VAL   7  -3.649   5.736  -6.743
   49    HB   VAL   7           HB       VAL   7  -4.263   3.494  -5.996
   50   1HG1  VAL   7          HG11      VAL   7  -3.741   1.506  -7.296
   51   2HG1  VAL   7          HG12      VAL   7  -3.287   2.524  -8.662
   52   3HG1  VAL   7          HG13      VAL   7  -4.953   2.515  -8.087
   53   1HG2  VAL   7          HG21      VAL   7  -1.985   4.256  -5.595
   54   2HG2  VAL   7          HG22      VAL   7  -1.475   3.572  -7.140
   55   3HG2  VAL   7          HG23      VAL   7  -2.032   2.512  -5.844
   56    H    GLY   8           HN       GLY   8  -2.119   6.803  -7.753
   57   1HA   GLY   8          HA2       GLY   8  -1.517   6.085 -10.537
   58   2HA   GLY   8          HA1       GLY   8  -1.208   7.648  -9.794
   59    H    ASP   9           HN       ASP   9   0.888   7.170 -10.911
   60    HA   ASP   9           HA       ASP   9   2.621   5.443  -9.305
   61   1HB   ASP   9          HB2       ASP   9   4.264   5.689 -11.108
   62   2HB   ASP   9          HB1       ASP   9   2.728   5.113 -11.744
   63    H    LEU  10           HN       LEU  10   4.369   6.239  -8.231
   64    HA   LEU  10           HA       LEU  10   4.980   9.065  -8.399
   65   1HB   LEU  10          HB2       LEU  10   4.820   9.402  -5.961
   66   2HB   LEU  10          HB1       LEU  10   3.265   9.102  -6.709
   67    HG   LEU  10           HG       LEU  10   4.747   6.840  -5.418
   68   1HD1  LEU  10          HD11      LEU  10   4.727   8.645  -3.765
   69   2HD1  LEU  10          HD12      LEU  10   3.628   7.344  -3.307
   70   3HD1  LEU  10          HD13      LEU  10   2.989   8.836  -3.995
   71   1HD2  LEU  10          HD21      LEU  10   2.767   6.315  -6.733
   72   2HD2  LEU  10          HD22      LEU  10   1.823   7.479  -5.804
   73   3HD2  LEU  10          HD23      LEU  10   2.458   6.035  -5.018
   74    H    THR  11           HN       THR  11   7.085   9.346  -8.316
   75    HA   THR  11           HA       THR  11   8.736   7.148  -7.274
   76    HB   THR  11           HB       THR  11   9.541   9.298  -9.240
   77    HG1  THR  11           HG1      THR  11   7.997   7.917 -10.184
   78   1HG2  THR  11          HG21      THR  11  11.459   7.831  -9.665
   79   2HG2  THR  11          HG22      THR  11  10.884   6.718  -8.423
   80   3HG2  THR  11          HG23      THR  11  11.407   8.343  -7.977
   81    H    VAL  12           HN       VAL  12   9.614   7.531  -5.363
   82    HA   VAL  12           HA       VAL  12  10.364  10.301  -4.678
   83    HB   VAL  12           HB       VAL  12   9.374   8.194  -2.742
   84   1HG1  VAL  12          HG11      VAL  12   9.315  10.035  -1.127
   85   2HG1  VAL  12          HG12      VAL  12  10.005  11.115  -2.339
   86   3HG1  VAL  12          HG13      VAL  12  10.948   9.752  -1.733
   87   1HG2  VAL  12          HG21      VAL  12   7.361   9.573  -2.527
   88   2HG2  VAL  12          HG22      VAL  12   7.557   8.961  -4.170
   89   3HG2  VAL  12          HG23      VAL  12   7.959  10.637  -3.800
   90    H    ALA  13           HN       ALA  13  12.504  10.490  -4.491
   91    HA   ALA  13           HA       ALA  13  14.109   8.100  -4.050
   92   1HB   ALA  13          HB1       ALA  13  14.937  10.912  -4.761
   93   2HB   ALA  13          HB2       ALA  13  14.769   9.553  -5.874
   94   3HB   ALA  13          HB3       ALA  13  16.021   9.527  -4.632
   95    H    LYS  14           HN       LYS  14  13.998   7.604  -1.945
   96    HA   LYS  14           HA       LYS  14  15.352   9.390  -0.074
   97   1HB   LYS  14          HB2       LYS  14  12.661   8.112   0.488
   98   2HB   LYS  14          HB1       LYS  14  13.668   8.887   1.699
   99   1HG   LYS  14          HG2       LYS  14  12.448  10.252  -0.692
  100   2HG   LYS  14          HG1       LYS  14  11.835  10.320   0.961
  101   1HD   LYS  14          HD2       LYS  14  13.911  11.388   1.688
  102   2HD   LYS  14          HD1       LYS  14  14.538  11.303   0.041
  103   1HE   LYS  14          HE2       LYS  14  12.569  12.679  -0.681
  104   2HE   LYS  14          HE1       LYS  14  12.171  12.893   1.024
  105   1HZ   LYS  14          HZ1       LYS  14  14.697  13.739  -0.295
  106   2HZ   LYS  14          HZ2       LYS  14  14.344  13.932   1.351
  107   3HZ   LYS  14          HZ3       LYS  14  13.436  14.763   0.184
  108    H    THR  15           HN       THR  15  15.351   7.972   2.172
  109    HA   THR  15           HA       THR  15  16.470   5.373   1.413
  110    HB   THR  15           HB       THR  15  17.355   5.429   3.800
  111    HG1  THR  15           HG1      THR  15  17.229   7.340   4.910
  112   1HG2  THR  15          HG21      THR  15  18.236   7.658   1.960
  113   2HG2  THR  15          HG22      THR  15  18.753   5.976   1.848
  114   3HG2  THR  15          HG23      THR  15  19.190   6.941   3.257
  115    H    ARG  16           HN       ARG  16  15.976   3.501   2.892
  116    HA   ARG  16           HA       ARG  16  13.114   3.501   3.460
  117   1HB   ARG  16          HB2       ARG  16  15.062   1.194   3.684
  118   2HB   ARG  16          HB1       ARG  16  13.312   1.089   3.802
  119   1HG   ARG  16          HG2       ARG  16  13.619   0.411   1.650
  120   2HG   ARG  16          HG1       ARG  16  13.412   2.144   1.399
  121   1HD   ARG  16          HD2       ARG  16  15.935   2.319   1.555
  122   2HD   ARG  16          HD1       ARG  16  15.966   0.565   1.448
  123    HE   ARG  16           HE       ARG  16  15.400   0.697  -0.773
  124   1HH1  ARG  16          HH11      ARG  16  15.066   3.819   0.718
  125   2HH1  ARG  16          HH12      ARG  16  14.995   4.695  -0.775
  126   1HH2  ARG  16          HH21      ARG  16  15.273   1.835  -2.788
  127   2HH2  ARG  16          HH22      ARG  16  15.092   3.556  -2.769
  128    H    GLY  17           HN       GLY  17  16.161   3.532   5.115
  129   1HA   GLY  17          HA2       GLY  17  15.257   2.825   7.706
  130   2HA   GLY  17          HA1       GLY  17  16.670   3.810   7.345
  131    H    GLN  18           HN       GLN  18  15.093   5.746   5.860
  132    HA   GLN  18           HA       GLN  18  14.544   7.720   7.686
  133   1HB   GLN  18          HB2       GLN  18  14.759   8.069   5.269
  134   2HB   GLN  18          HB1       GLN  18  13.249   7.216   4.997
  135   1HG   GLN  18          HG2       GLN  18  12.643   9.437   4.808
  136   2HG   GLN  18          HG1       GLN  18  12.198   9.037   6.468
  137   1HE2  GLN  18          HE21      GLN  18  13.290   9.961   8.164
  138   2HE2  GLN  18          HE22      GLN  18  14.426  11.248   7.968
  139    H    LEU  19           HN       LEU  19  12.502   5.103   6.619
  140    HA   LEU  19           HA       LEU  19  10.043   6.313   7.306
  141   1HB   LEU  19          HB2       LEU  19  10.657   3.418   6.786
  142   2HB   LEU  19          HB1       LEU  19   9.060   4.145   6.809
  143    HG   LEU  19           HG       LEU  19  11.261   4.681   4.821
  144   1HD1  LEU  19          HD11      LEU  19   9.648   3.833   3.198
  145   2HD1  LEU  19          HD12      LEU  19   8.502   3.513   4.500
  146   3HD1  LEU  19          HD13      LEU  19  10.022   2.623   4.425
  147   1HD2  LEU  19          HD21      LEU  19   9.675   6.213   3.756
  148   2HD2  LEU  19          HD22      LEU  19  10.152   6.755   5.364
  149   3HD2  LEU  19          HD23      LEU  19   8.577   6.005   5.119
  150    H    THR  20           HN       THR  20  12.333   4.604   9.140
  151    HA   THR  20           HA       THR  20  12.326   3.817  11.313
  152    HB   THR  20           HB       THR  20  10.930   6.446  11.799
  153    HG1  THR  20           HG1      THR  20  12.537   6.899  10.309
  154   1HG2  THR  20          HG21      THR  20  12.431   6.549  13.731
  155   2HG2  THR  20          HG22      THR  20  13.138   4.999  13.272
  156   3HG2  THR  20          HG23      THR  20  11.450   5.083  13.778
  157    H    ASP  21           HN       ASP  21  10.394   2.370  10.381
  158    HA   ASP  21           HA       ASP  21   8.589   1.143  10.881
  159   1HB   ASP  21          HB2       ASP  21   9.216   1.162  13.217
  160   2HB   ASP  21          HB1       ASP  21   8.500   2.758  13.436
  161    H    ALA  22           HN       ALA  22   7.778   4.463  12.015
  162    HA   ALA  22           HA       ALA  22   5.666   4.446   9.995
  163   1HB   ALA  22          HB1       ALA  22   3.978   5.242  11.562
  164   2HB   ALA  22          HB2       ALA  22   5.136   5.122  12.887
  165   3HB   ALA  22          HB3       ALA  22   4.599   3.664  12.051
  166    H    ALA  23           HN       ALA  23   7.518   5.834   9.215
  167    HA   ALA  23           HA       ALA  23   6.690   8.604   9.751
  168   1HB   ALA  23          HB1       ALA  23   8.917   8.265  10.736
  169   2HB   ALA  23          HB2       ALA  23   8.976   9.380   9.369
  170   3HB   ALA  23          HB3       ALA  23   9.520   7.713   9.173
  171    HA   PRO  24           HA       PRO  24   5.730   7.538   5.483
  172   1HB   PRO  24          HB2       PRO  24   3.972   9.558   5.069
  173   2HB   PRO  24          HB1       PRO  24   3.554   8.081   5.940
  174   1HG   PRO  24          HG2       PRO  24   4.315  10.770   7.013
  175   2HG   PRO  24          HG1       PRO  24   3.031   9.673   7.556
  176   1HD   PRO  24          HD2       PRO  24   5.414   9.879   8.826
  177   2HD   PRO  24          HD1       PRO  24   4.494   8.363   8.762
  178    H    ILE  25           HN       ILE  25   7.222   7.977   4.004
  179    HA   ILE  25           HA       ILE  25   8.289  10.630   3.646
  180    HB   ILE  25           HB       ILE  25   9.193   9.524   1.468
  181   1HG1  ILE  25          HG12      ILE  25   8.544   7.075   3.098
  182   2HG1  ILE  25          HG11      ILE  25   7.737   7.547   1.618
  183   1HG2  ILE  25          HG21      ILE  25  10.553  10.204   3.370
  184   2HG2  ILE  25          HG22      ILE  25  11.116   8.670   2.709
  185   3HG2  ILE  25          HG23      ILE  25  10.168   8.694   4.196
  186   1HD1  ILE  25          HD11      ILE  25   9.363   5.816   1.178
  187   2HD1  ILE  25          HD12      ILE  25  10.635   6.811   1.886
  188   3HD1  ILE  25          HD13      ILE  25   9.845   7.324   0.396
  189    H    GLY  26           HN       GLY  26   6.538   8.465   1.407
  190   1HA   GLY  26          HA2       GLY  26   5.524  10.896   0.073
  191   2HA   GLY  26          HA1       GLY  26   5.976   9.433  -0.793
  192    HA   PRO  27           HA       PRO  27   1.685   8.870   1.383
  193   1HB   PRO  27          HB2       PRO  27   0.176  11.126   1.163
  194   2HB   PRO  27          HB1       PRO  27   1.103  10.712   2.609
  195   1HG   PRO  27          HG2       PRO  27   1.746  12.640   0.427
  196   2HG   PRO  27          HG1       PRO  27   2.062  12.762   2.166
  197   1HD   PRO  27          HD2       PRO  27   3.965  12.083   0.320
  198   2HD   PRO  27          HD1       PRO  27   4.017  11.570   2.016
  199    H    VAL  28           HN       VAL  28   0.717   7.693  -0.105
  200    HA   VAL  28           HA       VAL  28   0.439   8.543  -2.837
  201    HB   VAL  28           HB       VAL  28  -0.812   6.147  -1.474
  202   1HG1  VAL  28          HG11      VAL  28  -0.272   6.696  -4.393
  203   2HG1  VAL  28          HG12      VAL  28  -1.851   6.732  -3.608
  204   3HG1  VAL  28          HG13      VAL  28  -0.960   5.216  -3.726
  205   1HG2  VAL  28          HG21      VAL  28   1.613   6.101  -1.217
  206   2HG2  VAL  28          HG22      VAL  28   1.812   6.342  -2.954
  207   3HG2  VAL  28          HG23      VAL  28   1.077   4.857  -2.347
  208    H    THR  29           HN       THR  29  -1.157   9.775  -3.576
  209    HA   THR  29           HA       THR  29  -3.378  10.490  -1.961
  210    HB   THR  29           HB       THR  29  -2.931  11.019  -4.902
  211    HG1  THR  29           HG1      THR  29  -2.272  12.852  -2.846
  212   1HG2  THR  29          HG21      THR  29  -5.181  11.486  -4.080
  213   2HG2  THR  29          HG22      THR  29  -4.322  12.969  -4.500
  214   3HG2  THR  29          HG23      THR  29  -4.501  12.500  -2.809
  215    H    VAL  30           HN       VAL  30  -4.818   8.892  -1.579
  216    HA   VAL  30           HA       VAL  30  -5.665   7.160  -3.781
  217    HB   VAL  30           HB       VAL  30  -6.422   7.034  -0.856
  218   1HG1  VAL  30          HG11      VAL  30  -6.794   5.028  -3.078
  219   2HG1  VAL  30          HG12      VAL  30  -8.063   5.977  -2.307
  220   3HG1  VAL  30          HG13      VAL  30  -7.182   4.764  -1.379
  221   1HG2  VAL  30          HG21      VAL  30  -4.046   6.657  -1.106
  222   2HG2  VAL  30          HG22      VAL  30  -4.336   5.491  -2.396
  223   3HG2  VAL  30          HG23      VAL  30  -4.850   5.128  -0.749
  224    H    GLN  31           HN       GLN  31  -7.285   7.889  -4.957
  225    HA   GLN  31           HA       GLN  31  -9.401   9.466  -3.677
  226   1HB   GLN  31          HB2       GLN  31  -8.829   9.032  -6.616
  227   2HB   GLN  31          HB1       GLN  31 -10.082  10.073  -5.958
  228   1HG   GLN  31          HG2       GLN  31  -7.117  10.446  -5.598
  229   2HG   GLN  31          HG1       GLN  31  -8.145  11.340  -6.714
  230   1HE2  GLN  31          HE21      GLN  31  -9.660  12.810  -5.885
  231   2HE2  GLN  31          HE22      GLN  31  -9.485  13.474  -4.286
  232    H    ALA  32           HN       ALA  32 -11.428   8.670  -3.498
  233    HA   ALA  32           HA       ALA  32 -11.940   6.030  -4.691
  234   1HB   ALA  32          HB1       ALA  32 -11.625   5.849  -2.273
  235   2HB   ALA  32          HB2       ALA  32 -13.283   5.465  -2.734
  236   3HB   ALA  32          HB3       ALA  32 -12.907   7.031  -2.014
  237    H    LEU  33           HN       LEU  33 -13.319   6.324  -6.305
  238    HA   LEU  33           HA       LEU  33 -15.501   8.270  -5.934
  239   1HB   LEU  33          HB2       LEU  33 -14.119   7.387  -8.469
  240   2HB   LEU  33          HB1       LEU  33 -15.583   8.346  -8.447
  241    HG   LEU  33           HG       LEU  33 -14.230  10.053  -7.078
  242   1HD1  LEU  33          HD11      LEU  33 -12.339   8.611  -6.539
  243   2HD1  LEU  33          HD12      LEU  33 -11.819  10.023  -7.460
  244   3HD1  LEU  33          HD13      LEU  33 -11.960   8.455  -8.255
  245   1HD2  LEU  33          HD21      LEU  33 -14.943  10.414  -9.378
  246   2HD2  LEU  33          HD22      LEU  33 -13.535   9.529  -9.964
  247   3HD2  LEU  33          HD23      LEU  33 -13.322  11.059  -9.112
  248    H    GLY  34           HN       GLY  34 -17.543   7.608  -6.124
  249   1HA   GLY  34          HA2       GLY  34 -19.302   6.284  -7.006
  250   2HA   GLY  34          HA1       GLY  34 -18.127   5.046  -7.430
  251    H    CYS  35           HN       CYS  35 -17.207   5.854  -4.470
  252    HA   CYS  35           HA       CYS  35 -18.455   3.503  -3.338
  253   1HB   CYS  35          HB2       CYS  35 -16.406   5.383  -2.153
  254   2HB   CYS  35          HB1       CYS  35 -16.902   3.841  -1.471
  255    H    ASN  36           HN       ASN  36 -20.594   4.121  -2.985
  256    HA   ASN  36           HA       ASN  36 -21.030   6.299  -1.089
  257   1HB   ASN  36          HB2       ASN  36 -22.968   4.580  -2.655
  258   2HB   ASN  36          HB1       ASN  36 -23.474   5.782  -1.473
  259   1HD2  ASN  36          HD21      ASN  36 -24.557   7.024  -2.980
  260   2HD2  ASN  36          HD22      ASN  36 -23.738   7.947  -4.192
  261    H    ALA  37           HN       ALA  37 -20.676   2.928  -1.178
  262    HA   ALA  37           HA       ALA  37 -20.908   2.649   1.635
  263   1HB   ALA  37          HB1       ALA  37 -22.778   1.071   1.700
  264   2HB   ALA  37          HB2       ALA  37 -23.064   1.334  -0.021
  265   3HB   ALA  37          HB3       ALA  37 -23.299   2.654   1.123
  266    H    ARG  38           HN       ARG  38 -18.800   1.897   1.176
  267    HA   ARG  38           HA       ARG  38 -18.636  -0.932   0.782
  268   1HB   ARG  38          HB2       ARG  38 -18.732   0.092  -1.578
  269   2HB   ARG  38          HB1       ARG  38 -17.155   0.785  -1.210
  270   1HG   ARG  38          HG2       ARG  38 -16.782  -1.182  -2.471
  271   2HG   ARG  38          HG1       ARG  38 -16.319  -1.538  -0.808
  272   1HD   ARG  38          HD2       ARG  38 -19.059  -2.200  -1.833
  273   2HD   ARG  38          HD1       ARG  38 -17.698  -3.281  -2.116
  274    HE   ARG  38           HE       ARG  38 -17.473  -3.191   0.432
  275   1HH1  ARG  38          HH11      ARG  38 -20.518  -2.982  -1.298
  276   2HH1  ARG  38          HH12      ARG  38 -21.437  -3.707  -0.008
  277   1HH2  ARG  38          HH21      ARG  38 -18.691  -4.122   2.120
  278   2HH2  ARG  38          HH22      ARG  38 -20.410  -4.331   1.930
  279    H    GLN  39           HN       GLN  39 -16.643  -1.760   1.531
  280    HA   GLN  39           HA       GLN  39 -14.931   0.067   2.953
  281   1HB   GLN  39          HB2       GLN  39 -14.537  -2.892   2.428
  282   2HB   GLN  39          HB1       GLN  39 -13.622  -1.904   3.548
  283   1HG   GLN  39          HG2       GLN  39 -15.119  -3.180   4.834
  284   2HG   GLN  39          HG1       GLN  39 -15.726  -1.529   4.830
  285   1HE2  GLN  39          HE21      GLN  39 -17.749  -2.374   5.452
  286   2HE2  GLN  39          HE22      GLN  39 -18.810  -3.099   4.292
  287    H    VAL  40           HN       VAL  40 -13.212   1.057   2.102
  288    HA   VAL  40           HA       VAL  40 -12.232   0.233  -0.523
  289    HB   VAL  40           HB       VAL  40 -11.489   2.653   1.139
  290   1HG1  VAL  40          HG11      VAL  40 -10.466   3.500  -0.923
  291   2HG1  VAL  40          HG12      VAL  40 -10.850   1.981  -1.733
  292   3HG1  VAL  40          HG13      VAL  40  -9.705   2.000  -0.390
  293   1HG2  VAL  40          HG21      VAL  40 -13.817   2.722   0.418
  294   2HG2  VAL  40          HG22      VAL  40 -13.320   2.418  -1.247
  295   3HG2  VAL  40          HG23      VAL  40 -12.855   3.921  -0.449
  296    H    ALA  41           HN       ALA  41 -10.403  -0.920  -0.753
  297    HA   ALA  41           HA       ALA  41  -8.683  -1.228   1.600
  298   1HB   ALA  41          HB1       ALA  41 -10.075  -3.230   1.109
  299   2HB   ALA  41          HB2       ALA  41  -8.339  -3.530   1.031
  300   3HB   ALA  41          HB3       ALA  41  -9.270  -3.351  -0.456
  301    H    LEU  42           HN       LEU  42  -6.513  -1.325   1.275
  302    HA   LEU  42           HA       LEU  42  -5.544  -0.516  -1.375
  303   1HB   LEU  42          HB2       LEU  42  -4.013  -0.513   1.220
  304   2HB   LEU  42          HB1       LEU  42  -3.643   0.377  -0.248
  305    HG   LEU  42           HG       LEU  42  -6.096   0.913   1.419
  306   1HD1  LEU  42          HD11      LEU  42  -4.873   2.859   2.294
  307   2HD1  LEU  42          HD12      LEU  42  -3.406   2.265   1.514
  308   3HD1  LEU  42          HD13      LEU  42  -4.162   1.327   2.802
  309   1HD2  LEU  42          HD21      LEU  42  -6.086   3.047   0.204
  310   2HD2  LEU  42          HD22      LEU  42  -6.242   1.667  -0.884
  311   3HD2  LEU  42          HD23      LEU  42  -4.695   2.499  -0.730
  312    H    LYS  43           HN       LYS  43  -4.660  -2.075  -2.591
  313    HA   LYS  43           HA       LYS  43  -3.498  -4.420  -1.235
  314   1HB   LYS  43          HB2       LYS  43  -4.764  -4.429  -3.983
  315   2HB   LYS  43          HB1       LYS  43  -4.193  -5.818  -3.076
  316   1HG   LYS  43          HG2       LYS  43  -6.518  -5.911  -2.890
  317   2HG   LYS  43          HG1       LYS  43  -5.976  -5.211  -1.360
  318   1HD   LYS  43          HD2       LYS  43  -6.681  -3.069  -1.950
  319   2HD   LYS  43          HD1       LYS  43  -6.719  -3.450  -3.671
  320   1HE   LYS  43          HE2       LYS  43  -8.540  -4.836  -1.754
  321   2HE   LYS  43          HE1       LYS  43  -8.938  -3.232  -2.371
  322   1HZ   LYS  43          HZ1       LYS  43  -8.484  -5.684  -3.983
  323   2HZ   LYS  43          HZ2       LYS  43  -8.730  -4.144  -4.635
  324   3HZ   LYS  43          HZ3       LYS  43  -9.962  -4.890  -3.746
  325    H    ALA  44           HN       ALA  44  -1.650  -5.330  -2.201
  326    HA   ALA  44           HA       ALA  44  -0.249  -3.505  -4.018
  327   1HB   ALA  44          HB1       ALA  44   0.920  -3.951  -1.942
  328   2HB   ALA  44          HB2       ALA  44   1.797  -4.651  -3.303
  329   3HB   ALA  44          HB3       ALA  44   0.836  -5.687  -2.247
  330    H    ASP  45           HN       ASP  45   0.975  -4.424  -5.753
  331    HA   ASP  45           HA       ASP  45  -0.443  -6.520  -7.117
  332   1HB   ASP  45          HB2       ASP  45   0.544  -4.598  -8.329
  333   2HB   ASP  45          HB1       ASP  45   2.151  -5.141  -7.853
  334    H    THR  46           HN       THR  46   0.520  -8.519  -7.831
  335    HA   THR  46           HA       THR  46   1.552  -9.984  -5.702
  336    HB   THR  46           HB       THR  46   0.287 -11.062  -7.458
  337    HG1  THR  46           HG1      THR  46   2.872 -11.932  -6.842
  338   1HG2  THR  46          HG21      THR  46   1.064  -9.745  -9.363
  339   2HG2  THR  46          HG22      THR  46   1.240 -11.471  -9.678
  340   3HG2  THR  46          HG23      THR  46   2.652 -10.505  -9.251
  341    H    ASP  47           HN       ASP  47   3.246  -8.017  -7.933
  342    HA   ASP  47           HA       ASP  47   5.749  -9.311  -7.986
  343   1HB   ASP  47          HB2       ASP  47   4.697  -7.053  -9.123
  344   2HB   ASP  47          HB1       ASP  47   5.808  -6.367  -7.940
  345    H    ASN  48           HN       ASN  48   4.197  -7.259  -5.633
  346    HA   ASN  48           HA       ASN  48   6.458  -7.639  -3.796
  347   1HB   ASN  48          HB2       ASN  48   6.129  -5.314  -2.975
  348   2HB   ASN  48          HB1       ASN  48   6.659  -5.358  -4.652
  349   1HD2  ASN  48          HD21      ASN  48   4.248  -4.358  -2.476
  350   2HD2  ASN  48          HD22      ASN  48   3.168  -3.659  -3.632
  351    H    PHE  49           HN       PHE  49   3.798  -8.883  -4.201
  352    HA   PHE  49           HA       PHE  49   2.697  -8.479  -1.497
  353   1HB   PHE  49          HB2       PHE  49   1.279  -7.333  -3.170
  354   2HB   PHE  49          HB1       PHE  49   1.140  -8.827  -4.071
  355    HD1  PHE  49           HD1      PHE  49   0.130  -7.063  -1.012
  356    HD2  PHE  49           HD2      PHE  49  -0.483 -10.491  -3.465
  357    HE1  PHE  49           HE1      PHE  49  -1.864  -7.648   0.303
  358    HE2  PHE  49           HE2      PHE  49  -2.480 -11.065  -2.166
  359    HZ   PHE  49           HZ       PHE  49  -3.382  -9.484  -0.550
  360    H    GLU  50           HN       GLU  50   3.438 -10.339  -0.591
  361    HA   GLU  50           HA       GLU  50   3.198 -12.853  -2.075
  362   1HB   GLU  50          HB2       GLU  50   4.546 -12.168   0.536
  363   2HB   GLU  50          HB1       GLU  50   4.384 -13.812  -0.055
  364   1HG   GLU  50          HG2       GLU  50   5.675 -13.196  -2.050
  365   2HG   GLU  50          HG1       GLU  50   5.891 -11.577  -1.387
  366    H    GLN  51           HN       GLN  51   1.095 -13.469  -2.002
  367    HA   GLN  51           HA       GLN  51  -0.726 -14.557  -1.158
  368   1HB   GLN  51          HB2       GLN  51   0.717 -15.850   0.274
  369   2HB   GLN  51          HB1       GLN  51   0.886 -14.508   1.397
  370   1HG   GLN  51          HG2       GLN  51  -1.675 -14.733   1.671
  371   2HG   GLN  51          HG1       GLN  51  -1.437 -16.333   0.969
  372   1HE2  GLN  51          HE21      GLN  51  -2.294 -15.538   3.647
  373   2HE2  GLN  51          HE22      GLN  51  -1.178 -16.269   4.747
  374    H    GLY  52           HN       GLY  52   0.422 -12.259   1.286
  375   1HA   GLY  52          HA2       GLY  52  -1.761 -10.485   0.992
  376   2HA   GLY  52          HA1       GLY  52  -2.028 -11.549   2.372
  377    H    LYS  53           HN       LYS  53   1.111 -10.422   1.268
  378    HA   LYS  53           HA       LYS  53   1.163  -8.408   3.381
  379   1HB   LYS  53          HB2       LYS  53   2.723 -10.817   3.212
  380   2HB   LYS  53          HB1       LYS  53   3.762  -9.439   3.006
  381   1HG   LYS  53          HG2       LYS  53   3.799  -9.927   5.301
  382   2HG   LYS  53          HG1       LYS  53   2.743  -8.522   5.142
  383   1HD   LYS  53          HD2       LYS  53   0.785  -9.917   5.305
  384   2HD   LYS  53          HD1       LYS  53   1.777 -11.376   5.294
  385   1HE   LYS  53          HE2       LYS  53   1.748  -9.245   7.431
  386   2HE   LYS  53          HE1       LYS  53   1.025 -10.848   7.549
  387   1HZ   LYS  53          HZ1       LYS  53   3.149 -10.788   8.663
  388   2HZ   LYS  53          HZ2       LYS  53   3.923 -10.251   7.257
  389   3HZ   LYS  53          HZ3       LYS  53   3.245 -11.806   7.310
  390    H    PHE  54           HN       PHE  54   1.922  -6.467   2.620
  391    HA   PHE  54           HA       PHE  54   3.249  -6.513   0.001
  392   1HB   PHE  54          HB2       PHE  54   2.754  -3.947   0.122
  393   2HB   PHE  54          HB1       PHE  54   1.497  -5.074  -0.346
  394    HD1  PHE  54           HD1      PHE  54  -0.589  -4.531   0.481
  395    HD2  PHE  54           HD2      PHE  54   2.851  -3.721   2.845
  396    HE1  PHE  54           HE1      PHE  54  -2.030  -3.634   2.267
  397    HE2  PHE  54           HE2      PHE  54   1.417  -2.812   4.628
  398    HZ   PHE  54           HZ       PHE  54  -1.116  -2.697   4.225
  399    H    PHE  55           HN       PHE  55   5.167  -5.511  -0.357
  400    HA   PHE  55           HA       PHE  55   6.576  -4.298   1.881
  401   1HB   PHE  55          HB2       PHE  55   8.557  -5.845   1.403
  402   2HB   PHE  55          HB1       PHE  55   7.215  -6.540   2.293
  403    HD1  PHE  55           HD1      PHE  55   8.863  -6.370  -0.981
  404    HD2  PHE  55           HD2      PHE  55   5.978  -8.363   1.422
  405    HE1  PHE  55           HE1      PHE  55   8.723  -8.161  -2.651
  406    HE2  PHE  55           HE2      PHE  55   5.830 -10.166  -0.246
  407    HZ   PHE  55           HZ       PHE  55   7.180 -10.099  -2.252
  408    H    LEU  56           HN       LEU  56   8.692  -3.442   1.236
  409    HA   LEU  56           HA       LEU  56   8.736  -2.405  -1.478
  410   1HB   LEU  56          HB2       LEU  56  10.912  -2.149   0.599
  411   2HB   LEU  56          HB1       LEU  56  10.604  -1.103  -0.769
  412    HG   LEU  56           HG       LEU  56   8.672  -1.328   1.519
  413   1HD1  LEU  56          HD11      LEU  56  10.836  -0.652   2.417
  414   2HD1  LEU  56          HD12      LEU  56   9.693   0.692   2.432
  415   3HD1  LEU  56          HD13      LEU  56  10.952   0.617   1.199
  416   1HD2  LEU  56          HD21      LEU  56   7.952   0.861   0.715
  417   2HD2  LEU  56          HD22      LEU  56   7.814  -0.365  -0.546
  418   3HD2  LEU  56          HD23      LEU  56   9.152   0.784  -0.574
  419    H    ILE  57           HN       ILE  57   9.533  -3.724  -3.072
  420    HA   ILE  57           HA       ILE  57  11.598  -5.652  -2.269
  421    HB   ILE  57           HB       ILE  57   9.641  -6.737  -3.186
  422   1HG1  ILE  57          HG12      ILE  57  10.706  -8.002  -5.048
  423   2HG1  ILE  57          HG11      ILE  57  12.001  -6.810  -5.076
  424   1HG2  ILE  57          HG21      ILE  57   8.782  -4.921  -4.560
  425   2HG2  ILE  57          HG22      ILE  57   8.914  -6.416  -5.485
  426   3HG2  ILE  57          HG23      ILE  57  10.115  -5.144  -5.694
  427   1HD1  ILE  57          HD11      ILE  57  12.655  -8.815  -3.871
  428   2HD1  ILE  57          HD12      ILE  57  11.302  -8.598  -2.760
  429   3HD1  ILE  57          HD13      ILE  57  12.610  -7.416  -2.797
  430    H    SER  58           HN       SER  58  13.565  -5.455  -2.958
  431    HA   SER  58           HA       SER  58  14.295  -3.196  -4.592
  432   1HB   SER  58          HB2       SER  58  15.550  -3.608  -2.553
  433   2HB   SER  58          HB1       SER  58  15.949  -5.239  -3.088
  434    HG   SER  58           HG       SER  58  17.510  -3.343  -3.399
  435    H    ASP  59           HN       ASP  59  15.578  -3.293  -6.432
  436    HA   ASP  59           HA       ASP  59  15.121  -5.284  -8.332
  437   1HB   ASP  59          HB2       ASP  59  15.864  -2.976  -8.843
  438   2HB   ASP  59          HB1       ASP  59  17.443  -3.348  -8.162
  439    H    ASN  60           HN       ASN  60  17.687  -4.869  -5.974
  440    HA   ASN  60           HA       ASN  60  19.259  -7.088  -6.909
  441   1HB   ASN  60          HB2       ASN  60  19.351  -5.469  -4.355
  442   2HB   ASN  60          HB1       ASN  60  20.492  -6.754  -4.735
  443   1HD2  ASN  60          HD21      ASN  60  22.026  -6.430  -6.332
  444   2HD2  ASN  60          HD22      ASN  60  22.378  -4.861  -6.971
  445    H    ASN  61           HN       ASN  61  16.434  -6.784  -5.139
  446    HA   ASN  61           HA       ASN  61  15.190  -8.100  -3.776
  447   1HB   ASN  61          HB2       ASN  61  15.569  -9.514  -5.920
  448   2HB   ASN  61          HB1       ASN  61  16.630 -10.489  -4.908
  449   1HD2  ASN  61          HD21      ASN  61  14.125 -11.204  -6.219
  450   2HD2  ASN  61          HD22      ASN  61  13.057 -11.741  -4.957
  451    H    ARG  62           HN       ARG  62  17.801  -7.205  -2.747
  452    HA   ARG  62           HA       ARG  62  18.601  -9.321  -0.946
  453   1HB   ARG  62          HB2       ARG  62  19.379  -6.405  -1.091
  454   2HB   ARG  62          HB1       ARG  62  20.016  -7.528   0.097
  455   1HG   ARG  62          HG2       ARG  62  20.298  -7.908  -2.873
  456   2HG   ARG  62          HG1       ARG  62  21.499  -7.104  -1.862
  457   1HD   ARG  62          HD2       ARG  62  22.178  -9.383  -2.168
  458   2HD   ARG  62          HD1       ARG  62  21.655  -9.180  -0.498
  459    HE   ARG  62           HE       ARG  62  19.675 -10.406  -1.009
  460   1HH1  ARG  62          HH11      ARG  62  22.123 -10.409  -3.507
  461   2HH1  ARG  62          HH12      ARG  62  21.441 -11.767  -4.361
  462   1HH2  ARG  62          HH21      ARG  62  18.761 -12.192  -2.120
  463   2HH2  ARG  62          HH22      ARG  62  19.525 -12.775  -3.568
  464    H    ASP  63           HN       ASP  63  16.729  -6.367  -0.864
  465    HA   ASP  63           HA       ASP  63  15.761  -7.105   1.805
  466   1HB   ASP  63          HB2       ASP  63  16.694  -4.487   0.755
  467   2HB   ASP  63          HB1       ASP  63  15.302  -4.470   1.832
  468    H    LYS  64           HN       LYS  64  13.710  -7.606   1.841
  469    HA   LYS  64           HA       LYS  64  11.897  -5.939   0.268
  470   1HB   LYS  64          HB2       LYS  64  10.320  -7.888   0.122
  471   2HB   LYS  64          HB1       LYS  64  11.771  -8.031  -0.849
  472   1HG   LYS  64          HG2       LYS  64  11.762 -10.115  -0.011
  473   2HG   LYS  64          HG1       LYS  64  12.580  -9.336   1.344
  474   1HD   LYS  64          HD2       LYS  64  10.879  -9.748   2.732
  475   2HD   LYS  64          HD1       LYS  64   9.691  -9.158   1.562
  476   1HE   LYS  64          HE2       LYS  64   9.427 -11.567   2.218
  477   2HE   LYS  64          HE1       LYS  64   9.587 -11.288   0.487
  478   1HZ   LYS  64          HZ1       LYS  64  11.930 -11.973   2.156
  479   2HZ   LYS  64          HZ2       LYS  64  11.743 -12.124   0.475
  480   3HZ   LYS  64          HZ3       LYS  64  10.921 -13.175   1.516
  481    H    LEU  65           HN       LEU  65  11.154  -4.600   1.699
  482    HA   LEU  65           HA       LEU  65  10.911  -5.494   4.483
  483   1HB   LEU  65          HB2       LEU  65  10.640  -2.630   3.841
  484   2HB   LEU  65          HB1       LEU  65  11.504  -3.404   5.149
  485    HG   LEU  65           HG       LEU  65  12.457  -3.242   2.312
  486   1HD1  LEU  65          HD11      LEU  65  12.400  -1.045   3.348
  487   2HD1  LEU  65          HD12      LEU  65  14.060  -1.598   3.133
  488   3HD1  LEU  65          HD13      LEU  65  13.308  -1.665   4.727
  489   1HD2  LEU  65          HD21      LEU  65  13.345  -5.184   3.445
  490   2HD2  LEU  65          HD22      LEU  65  13.812  -4.195   4.828
  491   3HD2  LEU  65          HD23      LEU  65  14.614  -3.971   3.273
  492    H    TYR  66           HN       TYR  66   8.960  -5.884   5.231
  493    HA   TYR  66           HA       TYR  66   6.646  -5.389   3.678
  494   1HB   TYR  66          HB2       TYR  66   6.871  -6.202   6.586
  495   2HB   TYR  66          HB1       TYR  66   5.415  -6.311   5.605
  496    HD1  TYR  66           HD1      TYR  66   8.824  -7.664   6.061
  497    HD2  TYR  66           HD2      TYR  66   5.058  -8.178   4.133
  498    HE1  TYR  66           HE1      TYR  66   9.487  -9.926   5.377
  499    HE2  TYR  66           HE2      TYR  66   5.723 -10.437   3.443
  500    HH   TYR  66           HH       TYR  66   7.741 -11.748   3.078
  501    H    VAL  67           HN       VAL  67   5.441  -3.644   3.573
  502    HA   VAL  67           HA       VAL  67   6.108  -1.427   5.365
  503    HB   VAL  67           HB       VAL  67   4.967  -0.006   3.651
  504   1HG1  VAL  67          HG11      VAL  67   6.860  -0.109   2.075
  505   2HG1  VAL  67          HG12      VAL  67   7.356  -1.633   2.811
  506   3HG1  VAL  67          HG13      VAL  67   7.365  -0.149   3.764
  507   1HG2  VAL  67          HG21      VAL  67   4.689  -0.964   1.398
  508   2HG2  VAL  67          HG22      VAL  67   3.597  -1.695   2.577
  509   3HG2  VAL  67          HG23      VAL  67   5.039  -2.565   2.052
  510    H    ASN  68           HN       ASN  68   4.388   0.094   5.849
  511    HA   ASN  68           HA       ASN  68   1.719  -1.140   5.986
  512   1HB   ASN  68          HB2       ASN  68   3.169   0.526   8.051
  513   2HB   ASN  68          HB1       ASN  68   1.416   0.371   8.049
  514   1HD2  ASN  68          HD21      ASN  68   3.546  -0.505   9.942
  515   2HD2  ASN  68          HD22      ASN  68   3.269  -2.202  10.175
  516    H    ILE  69           HN       ILE  69   0.604  -0.107   4.427
  517    HA   ILE  69           HA       ILE  69   0.983   2.762   4.091
  518    HB   ILE  69           HB       ILE  69  -1.118   2.179   2.455
  519   1HG1  ILE  69          HG12      ILE  69   0.716  -0.216   2.340
  520   2HG1  ILE  69          HG11      ILE  69  -0.897  -0.242   3.044
  521   1HG2  ILE  69          HG21      ILE  69   0.510   2.232   0.639
  522   2HG2  ILE  69          HG22      ILE  69   1.807   1.938   1.794
  523   3HG2  ILE  69          HG23      ILE  69   0.880   3.437   1.873
  524   1HD1  ILE  69          HD11      ILE  69  -0.258   0.409   0.176
  525   2HD1  ILE  69          HD12      ILE  69  -1.866   0.292   0.889
  526   3HD1  ILE  69          HD13      ILE  69  -0.849  -1.143   0.769
  527    H    ARG  70           HN       ARG  70   0.250   3.418   6.073
  528    HA   ARG  70           HA       ARG  70  -2.567   2.905   6.683
  529   1HB   ARG  70          HB2       ARG  70  -0.840   2.378   8.412
  530   2HB   ARG  70          HB1       ARG  70  -0.392   4.074   8.435
  531   1HG   ARG  70          HG2       ARG  70  -2.381   4.713   9.466
  532   2HG   ARG  70          HG1       ARG  70  -3.191   3.200   9.047
  533   1HD   ARG  70          HD2       ARG  70  -0.863   3.454  10.954
  534   2HD   ARG  70          HD1       ARG  70  -2.555   3.310  11.437
  535    HE   ARG  70           HE       ARG  70  -2.373   1.123  10.035
  536   1HH1  ARG  70          HH11      ARG  70   0.069   2.431  12.184
  537   2HH1  ARG  70          HH12      ARG  70   0.759   0.879  12.553
  538   1HH2  ARG  70          HH21      ARG  70  -1.459  -0.921  10.497
  539   2HH2  ARG  70          HH22      ARG  70  -0.108  -1.029  11.593
  540    HA   PRO  71           HA       PRO  71  -3.496   6.769   4.934
  541   1HB   PRO  71          HB2       PRO  71  -5.856   7.290   6.169
  542   2HB   PRO  71          HB1       PRO  71  -5.681   6.085   4.892
  543   1HG   PRO  71          HG2       PRO  71  -5.692   5.687   7.864
  544   2HG   PRO  71          HG1       PRO  71  -6.567   4.779   6.613
  545   1HD   PRO  71          HD2       PRO  71  -4.296   3.831   7.661
  546   2HD   PRO  71          HD1       PRO  71  -4.659   3.634   5.931
  547    H    MET  72           HN       MET  72  -3.389   8.936   5.323
  548    HA   MET  72           HA       MET  72  -2.037   9.648   7.731
  549   1HB   MET  72          HB2       MET  72  -1.551  10.609   5.450
  550   2HB   MET  72          HB1       MET  72  -3.050  11.520   5.593
  551   1HG   MET  72          HG2       MET  72  -1.157  12.901   6.183
  552   2HG   MET  72          HG1       MET  72  -2.189  12.634   7.588
  553   1HE   MET  72          HE1       MET  72   1.372  12.820   9.193
  554   2HE   MET  72          HE2       MET  72  -0.276  13.448   9.221
  555   3HE   MET  72          HE3       MET  72   0.764  13.759   7.831
  556    H    ASP  73           HN       ASP  73  -3.622   9.136   9.278
  557    HA   ASP  73           HA       ASP  73  -4.917   9.842  10.996
  558   1HB   ASP  73          HB2       ASP  73  -4.994  12.405   9.423
  559   2HB   ASP  73          HB1       ASP  73  -5.903  12.197  10.915
  560    H    ASN  74           HN       ASN  74  -6.271  10.618   7.825
  561    HA   ASN  74           HA       ASN  74  -8.922  10.901   8.648
  562   1HB   ASN  74          HB2       ASN  74  -7.747  10.236   5.961
  563   2HB   ASN  74          HB1       ASN  74  -9.473  10.463   6.209
  564   1HD2  ASN  74          HD21      ASN  74  -6.401  11.984   5.930
  565   2HD2  ASN  74          HD22      ASN  74  -6.970  13.618   5.989
  566    H    SER  75           HN       SER  75 -10.094   9.485   9.626
  567    HA   SER  75           HA       SER  75 -11.610   7.813   9.789
  568   1HB   SER  75          HB2       SER  75 -11.898   7.891   7.374
  569   2HB   SER  75          HB1       SER  75 -10.480   6.877   7.144
  570    HG   SER  75           HG       SER  75 -11.595   5.194   8.207
  571    H    ALA  76           HN       ALA  76 -11.788   5.574  10.374
  572    HA   ALA  76           HA       ALA  76  -9.248   4.476  11.320
  573   1HB   ALA  76          HB1       ALA  76 -10.630   3.033  12.733
  574   2HB   ALA  76          HB2       ALA  76 -12.085   3.706  12.000
  575   3HB   ALA  76          HB3       ALA  76 -11.028   4.734  12.968
  576    H    TRP  77           HN       TRP  77  -8.282   2.976  10.154
  577    HA   TRP  77           HA       TRP  77  -9.925   1.277   8.390
  578   1HB   TRP  77          HB2       TRP  77  -7.008   2.076   8.159
  579   2HB   TRP  77          HB1       TRP  77  -7.808   0.924   7.099
  580    HD1  TRP  77           HD1      TRP  77  -8.957   4.498   8.171
  581    HE1  TRP  77           HE1      TRP  77  -9.406   5.844   6.020
  582    HE3  TRP  77           HE3      TRP  77  -7.585   0.998   4.713
  583    HZ2  TRP  77           HZ2      TRP  77  -9.205   5.468   3.231
  584    HZ3  TRP  77           HZ3      TRP  77  -7.741   1.568   2.331
  585    HH2  TRP  77           HH2      TRP  77  -8.532   3.758   1.604
  586    H    THR  78           HN       THR  78  -9.671  -0.917   8.471
  587    HA   THR  78           HA       THR  78  -8.353  -1.999  10.808
  588    HB   THR  78           HB       THR  78  -9.819  -3.450   8.590
  589    HG1  THR  78           HG1      THR  78 -10.732  -1.824  10.532
  590   1HG2  THR  78          HG21      THR  78  -8.356  -4.903   9.923
  591   2HG2  THR  78          HG22      THR  78 -10.056  -5.246  10.244
  592   3HG2  THR  78          HG23      THR  78  -9.110  -4.310  11.402
  593    H    THR  79           HN       THR  79  -6.272  -2.399  10.769
  594    HA   THR  79           HA       THR  79  -4.856  -2.350   8.252
  595    HB   THR  79           HB       THR  79  -4.028  -1.025  10.104
  596    HG1  THR  79           HG1      THR  79  -2.373  -3.158   9.233
  597   1HG2  THR  79          HG21      THR  79  -4.753  -2.427  11.971
  598   2HG2  THR  79          HG22      THR  79  -3.038  -2.035  12.096
  599   3HG2  THR  79          HG23      THR  79  -3.539  -3.633  11.540
  600    H    ASP  80           HN       ASP  80  -4.578  -4.055   7.109
  601    HA   ASP  80           HA       ASP  80  -3.458  -6.435   8.430
  602   1HB   ASP  80          HB2       ASP  80  -5.632  -6.922   7.295
  603   2HB   ASP  80          HB1       ASP  80  -4.946  -6.334   5.783
  604    H    ASN  81           HN       ASN  81  -1.657  -7.419   7.132
  605    HA   ASN  81           HA       ASN  81  -0.062  -5.205   6.161
  606   1HB   ASN  81          HB2       ASN  81   0.575  -7.424   7.625
  607   2HB   ASN  81          HB1       ASN  81   1.130  -7.885   6.020
  608   1HD2  ASN  81          HD21      ASN  81   2.685  -6.523   4.968
  609   2HD2  ASN  81          HD22      ASN  81   3.727  -5.505   5.894
  610    H    GLY  82           HN       GLY  82  -2.250  -7.135   4.718
  611   1HA   GLY  82          HA2       GLY  82  -0.833  -6.945   2.135
  612   2HA   GLY  82          HA1       GLY  82  -1.959  -8.242   2.513
  613    H    VAL  83           HN       VAL  83  -3.837  -6.473   3.877
  614    HA   VAL  83           HA       VAL  83  -4.690  -4.737   1.670
  615    HB   VAL  83           HB       VAL  83  -7.058  -5.312   2.126
  616   1HG1  VAL  83          HG11      VAL  83  -5.335  -7.637   1.284
  617   2HG1  VAL  83          HG12      VAL  83  -5.897  -6.326   0.247
  618   3HG1  VAL  83          HG13      VAL  83  -7.056  -7.456   0.948
  619   1HG2  VAL  83          HG21      VAL  83  -5.896  -7.559   3.779
  620   2HG2  VAL  83          HG22      VAL  83  -7.594  -7.372   3.342
  621   3HG2  VAL  83          HG23      VAL  83  -6.819  -6.187   4.393
  622    H    PHE  84           HN       PHE  84  -5.882  -2.913   2.304
  623    HA   PHE  84           HA       PHE  84  -5.888  -2.391   5.193
  624   1HB   PHE  84          HB2       PHE  84  -3.966  -1.350   3.510
  625   2HB   PHE  84          HB1       PHE  84  -5.178  -0.075   3.524
  626    HD1  PHE  84           HD1      PHE  84  -5.975   0.747   5.830
  627    HD2  PHE  84           HD2      PHE  84  -2.433  -1.528   5.217
  628    HE1  PHE  84           HE1      PHE  84  -5.092   1.546   7.986
  629    HE2  PHE  84           HE2      PHE  84  -1.546  -0.737   7.366
  630    HZ   PHE  84           HZ       PHE  84  -2.875   0.800   8.753
  631    H    TYR  85           HN       TYR  85  -8.035  -2.189   5.552
  632    HA   TYR  85           HA       TYR  85  -9.505  -0.492   3.672
  633   1HB   TYR  85          HB2       TYR  85 -11.401  -2.000   3.628
  634   2HB   TYR  85          HB1       TYR  85  -9.957  -2.819   3.065
  635    HD1  TYR  85           HD1      TYR  85 -12.752  -3.028   5.205
  636    HD2  TYR  85           HD2      TYR  85  -8.689  -4.243   4.847
  637    HE1  TYR  85           HE1      TYR  85 -13.151  -4.821   6.845
  638    HE2  TYR  85           HE2      TYR  85  -9.079  -6.045   6.482
  639    HH   TYR  85           HH       TYR  85 -10.561  -6.690   8.190
  640    H    LYS  86           HN       LYS  86 -10.859   0.873   4.495
  641    HA   LYS  86           HA       LYS  86 -10.938   1.249   7.323
  642   1HB   LYS  86          HB2       LYS  86 -12.406   3.163   6.797
  643   2HB   LYS  86          HB1       LYS  86 -10.927   3.179   5.847
  644   1HG   LYS  86          HG2       LYS  86 -12.243   2.119   3.983
  645   2HG   LYS  86          HG1       LYS  86 -13.692   2.434   4.940
  646   1HD   LYS  86          HD2       LYS  86 -13.020   4.845   5.000
  647   2HD   LYS  86          HD1       LYS  86 -11.736   4.453   3.855
  648   1HE   LYS  86          HE2       LYS  86 -13.531   5.268   2.559
  649   2HE   LYS  86          HE1       LYS  86 -13.549   3.516   2.348
  650   1HZ   LYS  86          HZ1       LYS  86 -15.309   3.383   4.002
  651   2HZ   LYS  86          HZ2       LYS  86 -15.756   4.378   2.709
  652   3HZ   LYS  86          HZ3       LYS  86 -15.299   5.071   4.186
  653    H    ASN  87           HN       ASN  87 -12.561   0.823   8.733
  654    HA   ASN  87           HA       ASN  87 -14.506  -1.127   7.962
  655   1HB   ASN  87          HB2       ASN  87 -15.265  -1.008  10.283
  656   2HB   ASN  87          HB1       ASN  87 -13.512  -1.102  10.226
  657   1HD2  ASN  87          HD21      ASN  87 -16.254   0.872  10.990
  658   2HD2  ASN  87          HD22      ASN  87 -15.373   2.118  11.808
  659    H    ASP  88           HN       ASP  88 -14.344   2.263   8.035
  660    HA   ASP  88           HA       ASP  88 -17.112   2.877   7.970
  661   1HB   ASP  88          HB2       ASP  88 -15.573   4.618   8.452
  662   2HB   ASP  88          HB1       ASP  88 -14.646   4.325   6.992
  663    H    VAL  89           HN       VAL  89 -18.508   2.877   6.321
  664    HA   VAL  89           HA       VAL  89 -17.534   1.684   3.813
  665    HB   VAL  89           HB       VAL  89 -19.893   1.156   3.307
  666   1HG1  VAL  89          HG11      VAL  89 -18.527  -0.477   4.466
  667   2HG1  VAL  89          HG12      VAL  89 -20.195  -0.562   5.030
  668   3HG1  VAL  89          HG13      VAL  89 -18.967   0.227   6.020
  669   1HG2  VAL  89          HG21      VAL  89 -21.613   1.407   5.054
  670   2HG2  VAL  89          HG22      VAL  89 -21.010   2.966   4.491
  671   3HG2  VAL  89          HG23      VAL  89 -20.465   2.317   6.037
  672    H    GLY  90           HN       GLY  90 -17.292   2.910   2.066
  673   1HA   GLY  90          HA2       GLY  90 -18.789   4.516   0.677
  674   2HA   GLY  90          HA1       GLY  90 -18.520   5.582   2.051
  675    H    SER  91           HN       SER  91 -17.477   7.087   0.667
  676    HA   SER  91           HA       SER  91 -15.108   6.310  -0.766
  677   1HB   SER  91          HB2       SER  91 -15.062   8.823  -1.244
  678   2HB   SER  91          HB1       SER  91 -16.471   7.941  -1.833
  679    HG   SER  91           HG       SER  91 -17.618   9.254  -0.687
  680    H    TRP  92           HN       TRP  92 -13.356   8.305  -0.415
  681    HA   TRP  92           HA       TRP  92 -12.841   8.823   2.364
  682   1HB   TRP  92          HB2       TRP  92 -12.077   6.446   2.020
  683   2HB   TRP  92          HB1       TRP  92 -10.888   7.072   0.882
  684    HD1  TRP  92           HD1      TRP  92 -11.832   7.463   4.624
  685    HE1  TRP  92           HE1      TRP  92  -9.669   8.027   5.912
  686    HE3  TRP  92           HE3      TRP  92  -8.618   7.771   0.689
  687    HZ2  TRP  92           HZ2      TRP  92  -6.966   8.541   5.319
  688    HZ3  TRP  92           HZ3      TRP  92  -6.285   8.312   1.130
  689    HH2  TRP  92           HH2      TRP  92  -5.457   8.681   3.392
  690    H    GLY  93           HN       GLY  93 -11.220   8.510  -0.742
  691   1HA   GLY  93          HA2       GLY  93  -9.684   9.869  -1.819
  692   2HA   GLY  93          HA1       GLY  93 -10.920  11.072  -1.540
  693    H    GLY  94           HN       GLY  94  -7.792   9.895  -0.600
  694   1HA   GLY  94          HA2       GLY  94  -7.090  12.425   0.534
  695   2HA   GLY  94          HA1       GLY  94  -7.291  11.197   1.776
  696    H    THR  95           HN       THR  95  -5.178  10.977   2.407
  697    HA   THR  95           HA       THR  95  -3.366   9.877   0.382
  698    HB   THR  95           HB       THR  95  -1.500  11.074   1.681
  699    HG1  THR  95           HG1      THR  95  -2.135  12.920   2.802
  700   1HG2  THR  95          HG21      THR  95  -3.443  12.658  -0.001
  701   2HG2  THR  95          HG22      THR  95  -2.098  11.682  -0.594
  702   3HG2  THR  95          HG23      THR  95  -1.783  13.135   0.355
  703    H    ILE  96           HN       ILE  96  -2.136   8.188   0.987
  704    HA   ILE  96           HA       ILE  96  -2.160   7.370   3.829
  705    HB   ILE  96           HB       ILE  96  -1.712   5.044   2.921
  706   1HG1  ILE  96          HG12      ILE  96  -2.736   6.249   0.360
  707   2HG1  ILE  96          HG11      ILE  96  -1.037   5.906   0.658
  708   1HG2  ILE  96          HG21      ILE  96  -4.342   6.358   2.248
  709   2HG2  ILE  96          HG22      ILE  96  -3.897   5.606   3.781
  710   3HG2  ILE  96          HG23      ILE  96  -4.077   4.617   2.333
  711   1HD1  ILE  96          HD11      ILE  96  -1.599   3.526   0.925
  712   2HD1  ILE  96          HD12      ILE  96  -2.024   4.156  -0.669
  713   3HD1  ILE  96          HD13      ILE  96  -3.280   3.905   0.545
  714    H    GLY  97           HN       GLY  97  -0.150   6.678   4.714
  715   1HA   GLY  97          HA2       GLY  97   2.132   7.682   3.136
  716   2HA   GLY  97          HA1       GLY  97   2.049   7.661   4.891
  717    H    ILE  98           HN       ILE  98   3.960   6.459   2.808
  718    HA   ILE  98           HA       ILE  98   3.714   3.643   3.538
  719    HB   ILE  98           HB       ILE  98   5.412   5.091   1.516
  720   1HG1  ILE  98          HG12      ILE  98   3.416   2.850   1.317
  721   2HG1  ILE  98          HG11      ILE  98   3.057   4.538   0.989
  722   1HG2  ILE  98          HG21      ILE  98   5.600   2.178   2.293
  723   2HG2  ILE  98          HG22      ILE  98   6.835   3.406   2.575
  724   3HG2  ILE  98          HG23      ILE  98   6.416   2.936   0.927
  725   1HD1  ILE  98          HD11      ILE  98   4.975   2.792  -0.542
  726   2HD1  ILE  98          HD12      ILE  98   4.657   4.496  -0.868
  727   3HD1  ILE  98          HD13      ILE  98   3.372   3.304  -1.068
  728    H    TYR  99           HN       TYR  99   4.679   2.937   5.258
  729    HA   TYR  99           HA       TYR  99   7.422   3.773   5.765
  730   1HB   TYR  99          HB2       TYR  99   6.502   3.343   8.323
  731   2HB   TYR  99          HB1       TYR  99   6.818   4.910   7.597
  732    HD1  TYR  99           HD1      TYR  99   5.002   6.409   7.061
  733    HD2  TYR  99           HD2      TYR  99   4.206   2.473   8.459
  734    HE1  TYR  99           HE1      TYR  99   2.629   6.997   7.374
  735    HE2  TYR  99           HE2      TYR  99   1.847   3.052   8.779
  736    HH   TYR  99           HH       TYR  99   0.488   5.099   9.145
  737    H    VAL 100           HN       VAL 100   8.475   2.237   7.358
  738    HA   VAL 100           HA       VAL 100   8.025  -0.449   6.286
  739    HB   VAL 100           HB       VAL 100  10.209   0.341   8.174
  740   1HG1  VAL 100          HG11      VAL 100  10.031  -1.696   5.962
  741   2HG1  VAL 100          HG12      VAL 100   9.972  -2.018   7.695
  742   3HG1  VAL 100          HG13      VAL 100  11.453  -1.402   6.963
  743   1HG2  VAL 100          HG21      VAL 100  10.190   2.025   6.447
  744   2HG2  VAL 100          HG22      VAL 100  10.214   0.772   5.202
  745   3HG2  VAL 100          HG23      VAL 100  11.597   0.972   6.280
  746    H    ASP 101           HN       ASP 101   7.004  -2.005   7.490
  747    HA   ASP 101           HA       ASP 101   6.156  -1.523  10.156
  748   1HB   ASP 101          HB2       ASP 101   4.970  -3.048   8.597
  749   2HB   ASP 101          HB1       ASP 101   6.328  -4.165   8.683
  750    H    GLY 102           HN       GLY 102   7.804  -1.113  11.568
  751   1HA   GLY 102          HA2       GLY 102   9.113  -2.174  13.283
  752   2HA   GLY 102          HA1       GLY 102   9.598  -3.378  12.107
  753    H    GLN 103           HN       GLN 103   9.924  -0.838  10.270
  754    HA   GLN 103           HA       GLN 103  11.695   0.314   9.432
  755   1HB   GLN 103          HB2       GLN 103  11.710   1.547  11.532
  756   2HB   GLN 103          HB1       GLN 103  12.692   0.298  12.286
  757   1HG   GLN 103          HG2       GLN 103  14.520   0.813  10.737
  758   2HG   GLN 103          HG1       GLN 103  13.527   2.069   9.996
  759   1HE2  GLN 103          HE21      GLN 103  14.942   3.729  10.527
  760   2HE2  GLN 103          HE22      GLN 103  15.161   4.278  12.152
  761    H    GLN 104           HN       GLN 104  13.098  -0.593   8.113
  762    HA   GLN 104           HA       GLN 104  14.446  -3.031   9.018
  763   1HB   GLN 104          HB2       GLN 104  13.447  -2.111   6.353
  764   2HB   GLN 104          HB1       GLN 104  14.675  -3.362   6.444
  765   1HG   GLN 104          HG2       GLN 104  11.961  -3.459   7.738
  766   2HG   GLN 104          HG1       GLN 104  12.444  -4.309   6.272
  767   1HE2  GLN 104          HE21      GLN 104  15.094  -4.963   7.266
  768   2HE2  GLN 104          HE22      GLN 104  14.880  -6.214   8.446
  769    H    THR 105           HN       THR 105  15.129   0.188   8.255
  770    HA   THR 105           HA       THR 105  17.080   1.312   8.593
  771    HB   THR 105           HB       THR 105  18.581  -1.272   8.959
  772    HG1  THR 105           HG1      THR 105  17.543  -1.671  10.773
  773   1HG2  THR 105          HG21      THR 105  19.821   0.043  10.608
  774   2HG2  THR 105          HG22      THR 105  18.765   1.424  10.314
  775   3HG2  THR 105          HG23      THR 105  19.833   0.844   9.037
  776    H    ASN 106           HN       ASN 106  16.256  -0.262   6.083
  777    HA   ASN 106           HA       ASN 106  16.923  -0.706   4.006
  778   1HB   ASN 106          HB2       ASN 106  17.782   1.242   2.817
  779   2HB   ASN 106          HB1       ASN 106  16.425   1.585   3.838
  780   1HD2  ASN 106          HD21      ASN 106  19.854   1.439   4.803
  781   2HD2  ASN 106          HD22      ASN 106  19.944   3.119   5.234
  782    H    THR 107           HN       THR 107  18.139  -2.467   4.037
  783    HA   THR 107           HA       THR 107  21.025  -2.341   4.268
  784    HB   THR 107           HB       THR 107  19.537  -4.687   3.123
  785    HG1  THR 107           HG1      THR 107  18.254  -4.565   4.808
  786   1HG2  THR 107          HG21      THR 107  21.801  -4.496   5.111
  787   2HG2  THR 107          HG22      THR 107  21.979  -4.801   3.384
  788   3HG2  THR 107          HG23      THR 107  21.154  -5.979   4.407
  789    HA   PRO 108           HA       PRO 108  22.703  -1.014   0.489
  790   1HB   PRO 108          HB2       PRO 108  22.768  -3.890  -0.348
  791   2HB   PRO 108          HB1       PRO 108  24.000  -2.637  -0.542
  792   1HG   PRO 108          HG2       PRO 108  23.851  -4.485   1.571
  793   2HG   PRO 108          HG1       PRO 108  24.852  -3.025   1.527
  794   1HD   PRO 108          HD2       PRO 108  22.731  -3.496   3.300
  795   2HD   PRO 108          HD1       PRO 108  23.452  -1.908   2.951
  796    HA   PRO 109           HA       PRO 109  18.488  -1.417  -1.288
  797   1HB   PRO 109          HB2       PRO 109  18.660   1.507  -1.470
  798   2HB   PRO 109          HB1       PRO 109  17.476   0.502  -0.629
  799   1HG   PRO 109          HG2       PRO 109  19.267   1.948   0.731
  800   2HG   PRO 109          HG1       PRO 109  18.780   0.334   1.279
  801   1HD   PRO 109          HD2       PRO 109  21.228   1.128  -0.278
  802   2HD   PRO 109          HD1       PRO 109  21.102   0.103   1.172
  803    H    GLY 110           HN       GLY 110  17.722   0.609  -3.030
  804   1HA   GLY 110          HA2       GLY 110  19.206   1.208  -5.218
  805   2HA   GLY 110          HA1       GLY 110  18.790  -0.494  -5.438
  806    H    ASN 111           HN       ASN 111  17.358  -0.261  -7.116
  807    HA   ASN 111           HA       ASN 111  15.101   1.532  -6.850
  808   1HB   ASN 111          HB2       ASN 111  15.872  -0.543  -8.899
  809   2HB   ASN 111          HB1       ASN 111  14.300   0.250  -8.931
  810   1HD2  ASN 111          HD21      ASN 111  14.706   1.237 -10.896
  811   2HD2  ASN 111          HD22      ASN 111  15.815   2.555 -11.051
  812    H    TYR 112           HN       TYR 112  13.371   1.093  -5.701
  813    HA   TYR 112           HA       TYR 112  12.692  -1.724  -5.203
  814   1HB   TYR 112          HB2       TYR 112  12.193   0.760  -3.581
  815   2HB   TYR 112          HB1       TYR 112  11.245  -0.702  -3.329
  816    HD1  TYR 112           HD1      TYR 112  11.963  -2.115  -1.653
  817    HD2  TYR 112           HD2      TYR 112  14.844   0.280  -3.661
  818    HE1  TYR 112           HE1      TYR 112  13.720  -3.009  -0.192
  819    HE2  TYR 112           HE2      TYR 112  16.611  -0.618  -2.206
  820    HH   TYR 112           HH       TYR 112  16.895  -1.701  -0.097
  821    H    THR 113           HN       THR 113  11.020  -2.501  -6.197
  822    HA   THR 113           HA       THR 113   9.191  -0.626  -7.532
  823    HB   THR 113           HB       THR 113   9.864  -3.489  -8.193
  824    HG1  THR 113           HG1      THR 113  11.298  -1.385  -8.612
  825   1HG2  THR 113          HG21      THR 113   8.663  -3.074 -10.303
  826   2HG2  THR 113          HG22      THR 113   8.218  -1.468  -9.729
  827   3HG2  THR 113          HG23      THR 113   7.596  -2.901  -8.910
  828    H    LEU 114           HN       LEU 114   7.575  -0.369  -6.071
  829    HA   LEU 114           HA       LEU 114   6.139  -2.810  -5.299
  830   1HB   LEU 114          HB2       LEU 114   5.270  -1.461  -3.340
  831   2HB   LEU 114          HB1       LEU 114   6.949  -1.963  -3.270
  832    HG   LEU 114           HG       LEU 114   6.371   0.735  -4.361
  833   1HD1  LEU 114          HD11      LEU 114   6.241   0.048  -1.431
  834   2HD1  LEU 114          HD12      LEU 114   4.922   0.674  -2.422
  835   3HD1  LEU 114          HD13      LEU 114   6.333   1.680  -2.092
  836   1HD2  LEU 114          HD21      LEU 114   8.654  -0.106  -4.295
  837   2HD2  LEU 114          HD22      LEU 114   8.515  -0.381  -2.560
  838   3HD2  LEU 114          HD23      LEU 114   8.461   1.261  -3.199
  839    H    THR 115           HN       THR 115   4.437  -2.980  -6.565
  840    HA   THR 115           HA       THR 115   3.065  -0.565  -7.491
  841    HB   THR 115           HB       THR 115   2.589  -3.430  -8.353
  842    HG1  THR 115           HG1      THR 115   4.151  -1.468  -9.709
  843   1HG2  THR 115          HG21      THR 115   0.770  -1.844  -8.865
  844   2HG2  THR 115          HG22      THR 115   1.574  -2.418 -10.325
  845   3HG2  THR 115          HG23      THR 115   1.924  -0.806  -9.702
  846    H    LEU 116           HN       LEU 116   0.951  -0.124  -7.005
  847    HA   LEU 116           HA       LEU 116  -0.344  -1.882  -5.022
  848   1HB   LEU 116          HB2       LEU 116  -0.502   1.116  -5.309
  849   2HB   LEU 116          HB1       LEU 116  -1.439   0.173  -4.167
  850    HG   LEU 116           HG       LEU 116   1.574   0.403  -4.172
  851   1HD1  LEU 116          HD11      LEU 116   0.527   2.502  -3.548
  852   2HD1  LEU 116          HD12      LEU 116   1.255   1.732  -2.139
  853   3HD1  LEU 116          HD13      LEU 116  -0.491   1.666  -2.377
  854   1HD2  LEU 116          HD21      LEU 116   1.427  -0.704  -1.995
  855   2HD2  LEU 116          HD22      LEU 116   0.796  -1.729  -3.285
  856   3HD2  LEU 116          HD23      LEU 116  -0.315  -0.886  -2.206
  857    H    THR 117           HN       THR 117  -2.254  -2.689  -5.595
  858    HA   THR 117           HA       THR 117  -3.513  -1.642  -8.033
  859    HB   THR 117           HB       THR 117  -3.934  -4.329  -6.707
  860    HG1  THR 117           HG1      THR 117  -2.063  -3.375  -8.564
  861   1HG2  THR 117          HG21      THR 117  -4.951  -4.943  -8.856
  862   2HG2  THR 117          HG22      THR 117  -4.708  -3.298  -9.443
  863   3HG2  THR 117          HG23      THR 117  -5.813  -3.602  -8.104
  864    H    GLY 118           HN       GLY 118  -5.290  -0.481  -7.808
  865   1HA   GLY 118          HA2       GLY 118  -6.493  -0.139  -5.234
  866   2HA   GLY 118          HA1       GLY 118  -6.990   0.634  -6.731
  867    H    GLY 119           HN       GLY 119  -8.801  -0.272  -4.853
  868   1HA   GLY 119          HA2       GLY 119 -10.803  -1.338  -6.234
  869   2HA   GLY 119          HA1       GLY 119  -9.882  -2.783  -5.835
  870    H    TYR 120           HN       TYR 120 -12.439  -2.563  -4.939
  871    HA   TYR 120           HA       TYR 120 -12.306  -1.548  -2.219
  872   1HB   TYR 120          HB2       TYR 120 -14.699  -1.997  -2.114
  873   2HB   TYR 120          HB1       TYR 120 -14.313  -1.064  -3.555
  874    HD1  TYR 120           HD1      TYR 120 -15.462  -4.300  -2.278
  875    HD2  TYR 120           HD2      TYR 120 -14.577  -2.031  -5.770
  876    HE1  TYR 120           HE1      TYR 120 -16.676  -5.939  -3.643
  877    HE2  TYR 120           HE2      TYR 120 -15.787  -3.672  -7.144
  878    HH   TYR 120           HH       TYR 120 -16.530  -5.953  -7.075
  879    H    TRP 121           HN       TRP 121 -13.515  -3.000  -0.604
  880    HA   TRP 121           HA       TRP 121 -12.768  -5.828  -0.904
  881   1HB   TRP 121          HB2       TRP 121 -11.030  -5.115   0.507
  882   2HB   TRP 121          HB1       TRP 121 -12.035  -3.909   1.303
  883    HD1  TRP 121           HD1      TRP 121 -13.950  -4.954   3.000
  884    HE1  TRP 121           HE1      TRP 121 -13.801  -6.963   4.588
  885    HE3  TRP 121           HE3      TRP 121  -9.876  -7.320   0.977
  886    HZ2  TRP 121           HZ2      TRP 121 -12.194  -9.200   4.956
  887    HZ3  TRP 121           HZ3      TRP 121  -9.113  -9.412   2.057
  888    HH2  TRP 121           HH2      TRP 121 -10.252 -10.319   3.982
  889    H    ALA 122           HN       ALA 122 -14.167  -7.266   0.260
  890    HA   ALA 122           HA       ALA 122 -16.493  -6.032   1.556
  891   1HB   ALA 122          HB1       ALA 122 -16.636  -8.339  -0.381
  892   2HB   ALA 122          HB2       ALA 122 -17.133  -6.680  -0.715
  893   3HB   ALA 122          HB3       ALA 122 -17.989  -7.628   0.500
  894    H    LYS 123           HN       LYS 123 -17.218  -7.011   3.335
  895    HA   LYS 123           HA       LYS 123 -17.575  -8.450   5.034
  896   1HB   LYS 123          HB2       LYS 123 -16.107 -10.471   3.341
  897   2HB   LYS 123          HB1       LYS 123 -16.959 -10.827   4.838
  898   1HG   LYS 123          HG2       LYS 123 -18.132  -9.898   2.229
  899   2HG   LYS 123          HG1       LYS 123 -18.401 -11.435   3.052
  900   1HD   LYS 123          HD2       LYS 123 -19.578 -10.313   4.845
  901   2HD   LYS 123          HD1       LYS 123 -19.210  -8.738   4.140
  902   1HE   LYS 123          HE2       LYS 123 -20.477  -9.465   2.100
  903   2HE   LYS 123          HE1       LYS 123 -20.984 -10.891   3.004
  904   1HZ   LYS 123          HZ1       LYS 123 -22.663  -9.168   3.089
  905   2HZ   LYS 123          HZ2       LYS 123 -21.552  -8.068   3.745
  906   3HZ   LYS 123          HZ3       LYS 123 -22.025  -9.431   4.638
  907    H    ASP 124           HN       ASP 124 -15.410 -10.591   5.687
  908    HA   ASP 124           HA       ASP 124 -13.241  -8.807   6.447
  909   1HB   ASP 124          HB2       ASP 124 -13.413  -9.158   8.797
  910   2HB   ASP 124          HB1       ASP 124 -15.005  -8.657   8.243
  911    H    ASN 125           HN       ASN 125 -11.398  -9.764   6.119
  912    HA   ASN 125           HA       ASN 125  -9.677 -11.223   6.162
  913   1HB   ASN 125          HB2       ASN 125 -10.234 -11.551   8.454
  914   2HB   ASN 125          HB1       ASN 125 -11.498 -12.700   8.042
  915   1HD2  ASN 125          HD21      ASN 125 -10.961 -14.798   7.562
  916   2HD2  ASN 125          HD22      ASN 125  -9.368 -15.438   7.797
  917    H    LYS 126           HN       LYS 126 -12.753 -12.416   5.205
  918    HA   LYS 126           HA       LYS 126 -11.936 -14.939   4.191
  919   1HB   LYS 126          HB2       LYS 126 -14.134 -15.035   3.200
  920   2HB   LYS 126          HB1       LYS 126 -14.267 -14.349   4.812
  921   1HG   LYS 126          HG2       LYS 126 -15.533 -12.798   3.826
  922   2HG   LYS 126          HG1       LYS 126 -14.003 -12.106   3.285
  923   1HD   LYS 126          HD2       LYS 126 -14.158 -13.387   1.204
  924   2HD   LYS 126          HD1       LYS 126 -15.682 -14.090   1.746
  925   1HE   LYS 126          HE2       LYS 126 -16.644 -11.815   1.845
  926   2HE   LYS 126          HE1       LYS 126 -15.133 -11.178   1.194
  927   1HZ   LYS 126          HZ1       LYS 126 -17.034 -13.027  -0.148
  928   2HZ   LYS 126          HZ2       LYS 126 -15.501 -12.657  -0.765
  929   3HZ   LYS 126          HZ3       LYS 126 -16.666 -11.433  -0.596
  930    H    GLN 127           HN       GLN 127 -11.107 -11.947   3.228
  931    HA   GLN 127           HA       GLN 127 -10.096 -11.063   1.415
  932   1HB   GLN 127          HB2       GLN 127  -8.920 -13.194   1.176
  933   2HB   GLN 127          HB1       GLN 127 -10.279 -13.864   0.284
  934   1HG   GLN 127          HG2       GLN 127  -9.922 -12.157  -1.463
  935   2HG   GLN 127          HG1       GLN 127  -8.502 -11.601  -0.581
  936   1HE2  GLN 127          HE21      GLN 127  -8.692 -12.683  -3.275
  937   2HE2  GLN 127          HE22      GLN 127  -7.636 -14.067  -3.303
  938    H    GLY 128           HN       GLY 128 -12.134  -9.858   1.249
  939   1HA   GLY 128          HA2       GLY 128 -13.691 -10.725  -1.079
  940   2HA   GLY 128          HA1       GLY 128 -14.272  -9.631   0.163
  941    H    PHE 129           HN       PHE 129 -11.062  -9.334  -1.243
  942    HA   PHE 129           HA       PHE 129 -11.853  -6.660  -2.036
  943   1HB   PHE 129          HB2       PHE 129  -9.448  -6.242  -2.433
  944   2HB   PHE 129          HB1       PHE 129  -9.796  -6.758  -0.802
  945    HD1  PHE 129           HD1      PHE 129  -8.813  -8.743   0.091
  946    HD2  PHE 129           HD2      PHE 129  -8.339  -7.765  -4.023
  947    HE1  PHE 129           HE1      PHE 129  -7.113 -10.507  -0.125
  948    HE2  PHE 129           HE2      PHE 129  -6.630  -9.520  -4.243
  949    HZ   PHE 129           HZ       PHE 129  -5.877 -10.760  -2.239
  950    H    THR 130           HN       THR 130 -12.333  -6.081  -4.018
  951    HA   THR 130           HA       THR 130 -11.479  -7.805  -6.250
  952    HB   THR 130           HB       THR 130 -13.863  -5.938  -6.103
  953    HG1  THR 130           HG1      THR 130 -13.575  -8.758  -5.869
  954   1HG2  THR 130          HG21      THR 130 -12.974  -6.130  -8.379
  955   2HG2  THR 130          HG22      THR 130 -14.534  -6.939  -8.237
  956   3HG2  THR 130          HG23      THR 130 -13.046  -7.889  -8.265
  957    HA   PRO 131           HA       PRO 131  -8.941  -4.342  -7.544
  958   1HB   PRO 131          HB2       PRO 131  -8.670  -5.147 -10.163
  959   2HB   PRO 131          HB1       PRO 131  -7.686  -5.747  -8.824
  960   1HG   PRO 131          HG2       PRO 131 -10.077  -6.987 -10.127
  961   2HG   PRO 131          HG1       PRO 131  -8.576  -7.753  -9.576
  962   1HD   PRO 131          HD2       PRO 131 -10.846  -7.905  -8.153
  963   2HD   PRO 131          HD1       PRO 131  -9.259  -7.788  -7.365
  964    H    SER 132           HN       SER 132  -9.712  -2.383  -7.979
  965    HA   SER 132           HA       SER 132 -11.428  -1.895 -10.247
  966   1HB   SER 132          HB2       SER 132 -12.440  -1.357  -7.439
  967   2HB   SER 132          HB1       SER 132 -13.236  -0.838  -8.923
  968    HG   SER 132           HG       SER 132 -12.749  -3.459  -9.083
  969    H    GLY 133           HN       GLY 133 -10.768  -0.050 -11.123
  970   1HA   GLY 133          HA2       GLY 133 -10.387   2.372 -10.747
  971   2HA   GLY 133          HA1       GLY 133  -9.412   1.903  -9.361
  972    H    THR 134           HN       THR 134  -7.282   2.013  -9.719
  973    HA   THR 134           HA       THR 134  -6.311   1.101 -12.343
  974    HB   THR 134           HB       THR 134  -4.450   2.813 -12.101
  975    HG1  THR 134           HG1      THR 134  -4.479   4.048 -10.397
  976   1HG2  THR 134          HG21      THR 134  -7.257   3.845 -12.498
  977   2HG2  THR 134          HG22      THR 134  -6.241   3.093 -13.728
  978   3HG2  THR 134          HG23      THR 134  -5.783   4.649 -13.035
  979    H    THR 135           HN       THR 135  -3.798   0.794 -12.161
  980    HA   THR 135           HA       THR 135  -3.093  -0.164  -9.480
  981    HB   THR 135           HB       THR 135  -3.504  -2.101 -10.910
  982    HG1  THR 135           HG1      THR 135  -1.347  -3.054 -10.713
  983   1HG2  THR 135          HG21      THR 135  -1.319  -1.038 -12.699
  984   2HG2  THR 135          HG22      THR 135  -3.036  -1.111 -13.095
  985   3HG2  THR 135          HG23      THR 135  -2.122  -2.602 -12.856
  986    H    GLY 136           HN       GLY 136  -1.728   1.293  -8.726
  987   1HA   GLY 136          HA2       GLY 136  -0.007   2.734 -10.629
  988   2HA   GLY 136          HA1       GLY 136  -0.512   3.328  -9.053
  989    H    THR 137           HN       THR 137   2.184   2.950 -10.319
  990    HA   THR 137           HA       THR 137   3.334   0.976  -8.488
  991    HB   THR 137           HB       THR 137   4.625   2.364 -10.850
  992    HG1  THR 137           HG1      THR 137   3.394   0.913 -11.844
  993   1HG2  THR 137          HG21      THR 137   5.588   0.074  -9.130
  994   2HG2  THR 137          HG22      THR 137   6.253   1.705  -9.151
  995   3HG2  THR 137          HG23      THR 137   6.394   0.677 -10.577
  996    H    THR 138           HN       THR 138   4.062   1.728  -6.623
  997    HA   THR 138           HA       THR 138   4.985   4.473  -6.379
  998    HB   THR 138           HB       THR 138   5.064   2.299  -4.275
  999    HG1  THR 138           HG1      THR 138   2.923   3.356  -5.401
 1000   1HG2  THR 138          HG21      THR 138   6.439   4.266  -3.805
 1001   2HG2  THR 138          HG22      THR 138   5.048   4.198  -2.722
 1002   3HG2  THR 138          HG23      THR 138   5.048   5.314  -4.087
 1003    H    LYS 139           HN       LYS 139   6.996   4.905  -7.052
 1004    HA   LYS 139           HA       LYS 139   8.959   2.728  -7.005
 1005   1HB   LYS 139          HB2       LYS 139   8.508   3.904  -9.167
 1006   2HB   LYS 139          HB1       LYS 139   9.130   5.379  -8.441
 1007   1HG   LYS 139          HG2       LYS 139  11.307   4.365  -8.157
 1008   2HG   LYS 139          HG1       LYS 139  10.698   2.831  -8.780
 1009   1HD   LYS 139          HD2       LYS 139  10.869   5.432 -10.304
 1010   2HD   LYS 139          HD1       LYS 139  11.936   4.039 -10.500
 1011   1HE   LYS 139          HE2       LYS 139  10.041   2.681 -11.222
 1012   2HE   LYS 139          HE1       LYS 139   8.962   4.059 -11.003
 1013   1HZ   LYS 139          HZ1       LYS 139  10.264   5.251 -12.691
 1014   2HZ   LYS 139          HZ2       LYS 139   9.543   3.845 -13.304
 1015   3HZ   LYS 139          HZ3       LYS 139  11.201   3.858 -12.944
 1016    H    LEU 140           HN       LEU 140  10.042   2.635  -5.275
 1017    HA   LEU 140           HA       LEU 140  10.876   5.098  -3.940
 1018   1HB   LEU 140          HB2       LEU 140   9.727   3.713  -2.428
 1019   2HB   LEU 140          HB1       LEU 140  10.521   2.263  -3.012
 1020    HG   LEU 140           HG       LEU 140  12.623   3.029  -2.020
 1021   1HD1  LEU 140          HD11      LEU 140  12.296   5.425  -2.091
 1022   2HD1  LEU 140          HD12      LEU 140  12.592   4.919  -0.427
 1023   3HD1  LEU 140          HD13      LEU 140  10.953   5.303  -0.955
 1024   1HD2  LEU 140          HD21      LEU 140  11.171   1.551  -0.763
 1025   2HD2  LEU 140          HD22      LEU 140  10.301   2.938  -0.106
 1026   3HD2  LEU 140          HD23      LEU 140  11.993   2.677   0.319
 1027    H    THR 141           HN       THR 141  12.638   5.695  -5.070
 1028    HA   THR 141           HA       THR 141  14.796   3.756  -5.468
 1029    HB   THR 141           HB       THR 141  14.665   6.598  -6.501
 1030    HG1  THR 141           HG1      THR 141  13.800   5.727  -8.401
 1031   1HG2  THR 141          HG21      THR 141  16.255   4.178  -7.371
 1032   2HG2  THR 141          HG22      THR 141  16.887   5.599  -6.540
 1033   3HG2  THR 141          HG23      THR 141  16.260   5.744  -8.183
 1034    H    VAL 142           HN       VAL 142  16.821   4.057  -4.509
 1035    HA   VAL 142           HA       VAL 142  16.910   5.879  -2.260
 1036    HB   VAL 142           HB       VAL 142  17.877   3.631  -2.047
 1037   1HG1  VAL 142          HG11      VAL 142  19.879   4.576  -4.094
 1038   2HG1  VAL 142          HG12      VAL 142  18.686   3.294  -4.304
 1039   3HG1  VAL 142          HG13      VAL 142  20.008   3.089  -3.154
 1040   1HG2  VAL 142          HG21      VAL 142  20.030   4.280  -1.040
 1041   2HG2  VAL 142          HG22      VAL 142  18.715   5.370  -0.596
 1042   3HG2  VAL 142          HG23      VAL 142  19.892   5.859  -1.814
 1043    H    THR 143           HN       THR 143  18.239   7.664  -2.068
 1044    HA   THR 143           HA       THR 143  18.666   9.173  -4.391
 1045    HB   THR 143           HB       THR 143  20.180  10.488  -2.593
 1046    HG1  THR 143           HG1      THR 143  20.025   8.962  -0.951
 1047   1HG2  THR 143          HG21      THR 143  18.137  11.693  -1.945
 1048   2HG2  THR 143          HG22      THR 143  17.158  10.392  -2.624
 1049   3HG2  THR 143          HG23      THR 143  18.182  11.371  -3.677
  Start of MODEL    4
    1    H    GLU   1           H        GLU   1 -22.357   3.836  -8.588
    2    HA   GLU   1           HA       GLU   1 -23.015   2.132 -10.917
    3   1HB   GLU   1          HB2       GLU   1 -22.264   4.481 -11.449
    4   2HB   GLU   1          HB1       GLU   1 -20.766   4.131 -10.600
    5   1HG   GLU   1          HG2       GLU   1 -20.352   3.868 -12.916
    6   2HG   GLU   1          HG1       GLU   1 -20.389   2.256 -12.201
    7    H    GLU   2           HN       GLU   2 -20.036   3.172  -9.347
    8    HA   GLU   2           HA       GLU   2 -19.558   0.833  -7.860
    9   1HB   GLU   2          HB2       GLU   2 -19.242  -0.182 -10.098
   10   2HB   GLU   2          HB1       GLU   2 -18.033   1.037 -10.475
   11   1HG   GLU   2          HG2       GLU   2 -16.983  -1.059  -9.858
   12   2HG   GLU   2          HG1       GLU   2 -16.612   0.198  -8.682
   13    H    CYS   3           HN       CYS   3 -17.462   0.939  -6.815
   14    HA   CYS   3           HA       CYS   3 -16.577   3.703  -6.585
   15   1HB   CYS   3          HB2       CYS   3 -17.087   2.454  -4.541
   16   2HB   CYS   3          HB1       CYS   3 -15.862   1.262  -4.949
   17    H    GLN   4           HN       GLN   4 -15.094   4.315  -7.973
   18    HA   GLN   4           HA       GLN   4 -12.953   2.463  -8.725
   19   1HB   GLN   4          HB2       GLN   4 -14.051   3.605 -10.574
   20   2HB   GLN   4          HB1       GLN   4 -13.733   5.169  -9.831
   21   1HG   GLN   4          HG2       GLN   4 -11.308   4.711 -10.038
   22   2HG   GLN   4          HG1       GLN   4 -11.698   3.233 -10.911
   23   1HE2  GLN   4          HE21      GLN   4 -13.963   4.451 -12.298
   24   2HE2  GLN   4          HE22      GLN   4 -13.274   5.485 -13.507
   25    H    VAL   5           HN       VAL   5 -10.950   2.698  -7.923
   26    HA   VAL   5           HA       VAL   5 -10.518   4.952  -6.077
   27    HB   VAL   5           HB       VAL   5  -9.116   2.267  -6.157
   28   1HG1  VAL   5          HG11      VAL   5  -9.009   4.472  -4.111
   29   2HG1  VAL   5          HG12      VAL   5  -7.722   4.028  -5.231
   30   3HG1  VAL   5          HG13      VAL   5  -8.229   2.898  -3.975
   31   1HG2  VAL   5          HG21      VAL   5 -11.253   3.265  -4.279
   32   2HG2  VAL   5          HG22      VAL   5 -10.396   1.731  -4.144
   33   3HG2  VAL   5          HG23      VAL   5 -11.458   2.031  -5.519
   34    H    ARG   6           HN       ARG   6  -8.817   6.322  -6.421
   35    HA   ARG   6           HA       ARG   6  -7.332   5.923  -8.898
   36   1HB   ARG   6          HB2       ARG   6  -8.325   8.092  -8.628
   37   2HB   ARG   6          HB1       ARG   6  -7.548   8.314  -7.063
   38   1HG   ARG   6          HG2       ARG   6  -6.174   9.566  -8.387
   39   2HG   ARG   6          HG1       ARG   6  -5.356   8.008  -8.490
   40   1HD   ARG   6          HD2       ARG   6  -7.237   9.219 -10.512
   41   2HD   ARG   6          HD1       ARG   6  -5.503   8.970 -10.692
   42    HE   ARG   6           HE       ARG   6  -7.402   6.722 -10.433
   43   1HH1  ARG   6          HH11      ARG   6  -4.761   8.335 -12.091
   44   2HH1  ARG   6          HH12      ARG   6  -4.483   7.010 -13.188
   45   1HH2  ARG   6          HH21      ARG   6  -7.029   4.989 -11.857
   46   2HH2  ARG   6          HH22      ARG   6  -5.785   5.111 -13.065
   47    H    VAL   7           HN       VAL   7  -5.740   4.504  -8.546
   48    HA   VAL   7           HA       VAL   7  -3.589   5.414  -6.759
   49    HB   VAL   7           HB       VAL   7  -4.415   2.536  -7.250
   50   1HG1  VAL   7          HG11      VAL   7  -2.504   1.900  -5.858
   51   2HG1  VAL   7          HG12      VAL   7  -2.006   3.588  -5.760
   52   3HG1  VAL   7          HG13      VAL   7  -1.975   2.750  -7.311
   53   1HG2  VAL   7          HG21      VAL   7  -4.682   2.456  -4.816
   54   2HG2  VAL   7          HG22      VAL   7  -5.726   3.683  -5.535
   55   3HG2  VAL   7          HG23      VAL   7  -4.243   4.161  -4.710
   56    H    GLY   8           HN       GLY   8  -1.956   6.049  -7.983
   57   1HA   GLY   8          HA2       GLY   8  -1.479   4.620 -10.517
   58   2HA   GLY   8          HA1       GLY   8  -1.408   6.373 -10.407
   59    H    ASP   9           HN       ASP   9   0.712   6.567 -11.016
   60    HA   ASP   9           HA       ASP   9   2.733   5.042  -9.561
   61   1HB   ASP   9          HB2       ASP   9   3.289   4.947 -11.780
   62   2HB   ASP   9          HB1       ASP   9   2.676   6.560 -12.128
   63    H    LEU  10           HN       LEU  10   4.283   5.903  -8.315
   64    HA   LEU  10           HA       LEU  10   4.586   8.760  -8.025
   65   1HB   LEU  10          HB2       LEU  10   4.304   8.632  -5.529
   66   2HB   LEU  10          HB1       LEU  10   2.822   8.511  -6.458
   67    HG   LEU  10           HG       LEU  10   4.043   5.921  -5.805
   68   1HD1  LEU  10          HD11      LEU  10   2.903   7.665  -3.619
   69   2HD1  LEU  10          HD12      LEU  10   4.586   7.161  -3.761
   70   3HD1  LEU  10          HD13      LEU  10   3.328   5.960  -3.469
   71   1HD2  LEU  10          HD21      LEU  10   1.732   5.367  -5.286
   72   2HD2  LEU  10          HD22      LEU  10   1.841   6.176  -6.850
   73   3HD2  LEU  10          HD23      LEU  10   1.276   7.064  -5.435
   74    H    THR  11           HN       THR  11   6.672   9.158  -7.815
   75    HA   THR  11           HA       THR  11   8.407   6.984  -6.836
   76    HB   THR  11           HB       THR  11   9.118   9.156  -8.819
   77    HG1  THR  11           HG1      THR  11   7.945   6.663  -9.106
   78   1HG2  THR  11          HG21      THR  11  11.041   8.327  -7.553
   79   2HG2  THR  11          HG22      THR  11  11.114   7.784  -9.229
   80   3HG2  THR  11          HG23      THR  11  10.606   6.667  -7.963
   81    H    VAL  12           HN       VAL  12   9.278   7.413  -4.917
   82    HA   VAL  12           HA       VAL  12   9.919  10.220  -4.280
   83    HB   VAL  12           HB       VAL  12   9.117   8.123  -2.258
   84   1HG1  VAL  12          HG11      VAL  12   8.951  10.048  -0.731
   85   2HG1  VAL  12          HG12      VAL  12   9.555  11.098  -2.014
   86   3HG1  VAL  12          HG13      VAL  12  10.586   9.827  -1.357
   87   1HG2  VAL  12          HG21      VAL  12   7.198   8.684  -3.659
   88   2HG2  VAL  12          HG22      VAL  12   7.479  10.401  -3.370
   89   3HG2  VAL  12          HG23      VAL  12   7.005   9.350  -2.038
   90    H    ALA  13           HN       ALA  13  12.014  10.525  -4.158
   91    HA   ALA  13           HA       ALA  13  13.816   8.272  -3.954
   92   1HB   ALA  13          HB1       ALA  13  14.231  10.056  -5.575
   93   2HB   ALA  13          HB2       ALA  13  15.566   9.891  -4.433
   94   3HB   ALA  13          HB3       ALA  13  14.414  11.213  -4.255
   95    H    LYS  14           HN       LYS  14  14.221   7.477  -2.023
   96    HA   LYS  14           HA       LYS  14  15.604   8.957  -0.069
   97   1HB   LYS  14          HB2       LYS  14  13.840   8.339   1.792
   98   2HB   LYS  14          HB1       LYS  14  13.716   9.851   0.917
   99   1HG   LYS  14          HG2       LYS  14  11.545   8.906   1.069
  100   2HG   LYS  14          HG1       LYS  14  12.079   8.762  -0.605
  101   1HD   LYS  14          HD2       LYS  14  12.840   6.406   0.037
  102   2HD   LYS  14          HD1       LYS  14  11.856   6.624   1.487
  103   1HE   LYS  14          HE2       LYS  14  10.877   6.908  -1.342
  104   2HE   LYS  14          HE1       LYS  14  10.634   5.484  -0.324
  105   1HZ   LYS  14          HZ1       LYS  14   9.419   6.902   1.243
  106   2HZ   LYS  14          HZ2       LYS  14   8.688   6.875  -0.279
  107   3HZ   LYS  14          HZ3       LYS  14   9.594   8.219   0.195
  108    H    THR  15           HN       THR  15  15.801   7.523   2.022
  109    HA   THR  15           HA       THR  15  16.354   4.810   1.060
  110    HB   THR  15           HB       THR  15  17.763   4.627   3.109
  111    HG1  THR  15           HG1      THR  15  17.377   7.432   3.411
  112   1HG2  THR  15          HG21      THR  15  18.762   5.323   0.991
  113   2HG2  THR  15          HG22      THR  15  19.543   6.126   2.353
  114   3HG2  THR  15          HG23      THR  15  18.383   7.006   1.357
  115    H    ARG  16           HN       ARG  16  16.187   3.111   2.881
  116    HA   ARG  16           HA       ARG  16  13.544   3.243   4.071
  117   1HB   ARG  16          HB2       ARG  16  15.634   1.077   4.398
  118   2HB   ARG  16          HB1       ARG  16  13.906   0.953   4.740
  119   1HG   ARG  16          HG2       ARG  16  13.410   0.467   2.621
  120   2HG   ARG  16          HG1       ARG  16  14.488   1.710   1.985
  121   1HD   ARG  16          HD2       ARG  16  16.233   0.284   1.763
  122   2HD   ARG  16          HD1       ARG  16  15.773  -0.675   3.154
  123    HE   ARG  16           HE       ARG  16  14.514  -0.866   0.513
  124   1HH1  ARG  16          HH11      ARG  16  15.552  -2.324   3.516
  125   2HH1  ARG  16          HH12      ARG  16  14.979  -3.905   3.108
  126   1HH2  ARG  16          HH21      ARG  16  13.719  -2.968  -0.025
  127   2HH2  ARG  16          HH22      ARG  16  13.945  -4.273   1.090
  128    H    GLY  17           HN       GLY  17  16.592   4.278   4.816
  129   1HA   GLY  17          HA2       GLY  17  16.408   3.921   7.698
  130   2HA   GLY  17          HA1       GLY  17  17.726   4.683   6.820
  131    H    GLN  18           HN       GLN  18  15.748   6.318   5.281
  132    HA   GLN  18           HA       GLN  18  15.441   8.538   7.024
  133   1HB   GLN  18          HB2       GLN  18  15.591   8.690   4.528
  134   2HB   GLN  18          HB1       GLN  18  13.979   7.995   4.430
  135   1HG   GLN  18          HG2       GLN  18  13.857  10.380   4.174
  136   2HG   GLN  18          HG1       GLN  18  13.095   9.907   5.690
  137   1HE2  GLN  18          HE21      GLN  18  15.793  11.515   4.217
  138   2HE2  GLN  18          HE22      GLN  18  16.377  12.292   5.655
  139    H    LEU  19           HN       LEU  19  13.536   5.782   6.195
  140    HA   LEU  19           HA       LEU  19  11.134   6.596   7.527
  141   1HB   LEU  19          HB2       LEU  19  12.096   3.780   6.969
  142   2HB   LEU  19          HB1       LEU  19  10.450   4.286   7.302
  143    HG   LEU  19           HG       LEU  19  11.926   5.230   4.852
  144   1HD1  LEU  19          HD11      LEU  19  10.847   3.448   3.613
  145   2HD1  LEU  19          HD12      LEU  19  10.140   2.814   5.100
  146   3HD1  LEU  19          HD13      LEU  19  11.887   2.773   4.866
  147   1HD2  LEU  19          HD21      LEU  19   9.964   6.510   5.458
  148   2HD2  LEU  19          HD22      LEU  19   9.010   5.034   5.589
  149   3HD2  LEU  19          HD23      LEU  19   9.629   5.547   4.020
  150    H    THR  20           HN       THR  20  10.381   5.520   9.542
  151    HA   THR  20           HA       THR  20  12.381   4.420  11.304
  152    HB   THR  20           HB       THR  20  11.022   6.988  12.164
  153    HG1  THR  20           HG1      THR  20  13.253   6.598  10.607
  154   1HG2  THR  20          HG21      THR  20  13.324   5.395  13.313
  155   2HG2  THR  20          HG22      THR  20  11.697   5.510  13.987
  156   3HG2  THR  20          HG23      THR  20  12.736   6.934  13.942
  157    H    ASP  21           HN       ASP  21  10.596   2.933  10.575
  158    HA   ASP  21           HA       ASP  21   8.724   1.721  10.856
  159   1HB   ASP  21          HB2       ASP  21   9.520   1.535  13.190
  160   2HB   ASP  21          HB1       ASP  21   8.601   2.982  13.600
  161    H    ALA  22           HN       ALA  22   7.594   4.362  12.917
  162    HA   ALA  22           HA       ALA  22   5.316   4.676  11.146
  163   1HB   ALA  22          HB1       ALA  22   4.912   4.510  13.549
  164   2HB   ALA  22          HB2       ALA  22   4.365   6.063  12.915
  165   3HB   ALA  22          HB3       ALA  22   5.878   5.960  13.816
  166    H    ALA  23           HN       ALA  23   6.725   5.558   9.450
  167    HA   ALA  23           HA       ALA  23   6.683   8.465   9.571
  168   1HB   ALA  23          HB1       ALA  23   8.955   8.716   8.734
  169   2HB   ALA  23          HB2       ALA  23   9.188   6.970   8.791
  170   3HB   ALA  23          HB3       ALA  23   8.965   7.876  10.286
  171    HA   PRO  24           HA       PRO  24   5.166   7.009   5.567
  172   1HB   PRO  24          HB2       PRO  24   3.268   8.864   5.245
  173   2HB   PRO  24          HB1       PRO  24   3.063   7.518   6.374
  174   1HG   PRO  24          HG2       PRO  24   3.772  10.367   6.931
  175   2HG   PRO  24          HG1       PRO  24   2.727   9.269   7.849
  176   1HD   PRO  24          HD2       PRO  24   5.371   9.855   8.462
  177   2HD   PRO  24          HD1       PRO  24   4.473   8.439   9.041
  178    H    ILE  25           HN       ILE  25   6.704   7.446   4.078
  179    HA   ILE  25           HA       ILE  25   7.048  10.271   3.298
  180    HB   ILE  25           HB       ILE  25   9.071   8.113   2.712
  181   1HG1  ILE  25          HG12      ILE  25   8.872   9.901   5.143
  182   2HG1  ILE  25          HG11      ILE  25   8.755   8.142   5.128
  183   1HG2  ILE  25          HG21      ILE  25   9.282  11.119   2.927
  184   2HG2  ILE  25          HG22      ILE  25   9.241  10.190   1.428
  185   3HG2  ILE  25          HG23      ILE  25  10.602  10.017   2.536
  186   1HD1  ILE  25          HD11      ILE  25  11.200   9.768   4.445
  187   2HD1  ILE  25          HD12      ILE  25  11.093   8.008   4.410
  188   3HD1  ILE  25          HD13      ILE  25  10.923   8.871   5.939
  189    H    GLY  26           HN       GLY  26   5.053   8.266   2.464
  190   1HA   GLY  26          HA2       GLY  26   5.273   8.949  -0.358
  191   2HA   GLY  26          HA1       GLY  26   5.073   7.244   0.019
  192    HA   PRO  27           HA       PRO  27   0.950   9.277   1.614
  193   1HB   PRO  27          HB2       PRO  27   0.621  11.913   0.862
  194   2HB   PRO  27          HB1       PRO  27   1.143  11.378   2.463
  195   1HG   PRO  27          HG2       PRO  27   2.787  12.352   0.157
  196   2HG   PRO  27          HG1       PRO  27   2.963  12.700   1.887
  197   1HD   PRO  27          HD2       PRO  27   4.556  10.930   0.654
  198   2HD   PRO  27          HD1       PRO  27   3.997  10.670   2.318
  199    H    VAL  28           HN       VAL  28   0.176   7.943   0.003
  200    HA   VAL  28           HA       VAL  28  -0.071   8.838  -2.731
  201    HB   VAL  28           HB       VAL  28  -1.428   6.485  -1.393
  202   1HG1  VAL  28          HG11      VAL  28  -2.444   7.114  -3.507
  203   2HG1  VAL  28          HG12      VAL  28  -1.575   5.587  -3.672
  204   3HG1  VAL  28          HG13      VAL  28  -0.866   7.076  -4.296
  205   1HG2  VAL  28          HG21      VAL  28   0.403   5.115  -2.279
  206   2HG2  VAL  28          HG22      VAL  28   0.985   6.310  -1.119
  207   3HG2  VAL  28          HG23      VAL  28   1.215   6.574  -2.847
  208    H    THR  29           HN       THR  29  -1.700  10.058  -3.505
  209    HA   THR  29           HA       THR  29  -3.904  10.753  -1.802
  210    HB   THR  29           HB       THR  29  -3.390  11.598  -4.658
  211    HG1  THR  29           HG1      THR  29  -1.927  12.088  -2.472
  212   1HG2  THR  29          HG21      THR  29  -4.667  13.574  -3.987
  213   2HG2  THR  29          HG22      THR  29  -4.919  12.860  -2.396
  214   3HG2  THR  29          HG23      THR  29  -5.611  12.097  -3.825
  215    H    VAL  30           HN       VAL  30  -5.210   8.969  -1.631
  216    HA   VAL  30           HA       VAL  30  -6.162   7.677  -4.072
  217    HB   VAL  30           HB       VAL  30  -6.331   6.962  -1.155
  218   1HG1  VAL  30          HG11      VAL  30  -7.757   5.070  -1.714
  219   2HG1  VAL  30          HG12      VAL  30  -7.858   5.616  -3.387
  220   3HG1  VAL  30          HG13      VAL  30  -8.569   6.588  -2.100
  221   1HG2  VAL  30          HG21      VAL  30  -5.369   5.472  -3.607
  222   2HG2  VAL  30          HG22      VAL  30  -5.281   4.893  -1.943
  223   3HG2  VAL  30          HG23      VAL  30  -4.342   6.303  -2.438
  224    H    GLN  31           HN       GLN  31  -7.818   8.547  -5.012
  225    HA   GLN  31           HA       GLN  31  -9.962   9.743  -3.426
  226   1HB   GLN  31          HB2       GLN  31  -9.512   9.838  -6.417
  227   2HB   GLN  31          HB1       GLN  31 -10.702  10.765  -5.508
  228   1HG   GLN  31          HG2       GLN  31  -8.914  11.941  -4.347
  229   2HG   GLN  31          HG1       GLN  31  -7.713  10.996  -5.223
  230   1HE2  GLN  31          HE21      GLN  31  -9.274  11.094  -7.719
  231   2HE2  GLN  31          HE22      GLN  31  -9.049  12.698  -8.336
  232    H    ALA  32           HN       ALA  32 -11.775   8.656  -3.111
  233    HA   ALA  32           HA       ALA  32 -12.199   6.161  -4.578
  234   1HB   ALA  32          HB1       ALA  32 -12.132   6.043  -2.126
  235   2HB   ALA  32          HB2       ALA  32 -13.696   5.543  -2.771
  236   3HB   ALA  32          HB3       ALA  32 -13.510   7.141  -2.045
  237    H    LEU  33           HN       LEU  33 -13.165   6.773  -6.449
  238    HA   LEU  33           HA       LEU  33 -15.333   8.711  -6.430
  239   1HB   LEU  33          HB2       LEU  33 -13.649   8.825  -8.196
  240   2HB   LEU  33          HB1       LEU  33 -14.017   7.181  -8.678
  241    HG   LEU  33           HG       LEU  33 -16.332   7.959  -9.268
  242   1HD1  LEU  33          HD11      LEU  33 -15.096  10.678  -8.864
  243   2HD1  LEU  33          HD12      LEU  33 -16.405   9.974  -7.914
  244   3HD1  LEU  33          HD13      LEU  33 -16.660  10.360  -9.615
  245   1HD2  LEU  33          HD21      LEU  33 -15.639   8.980 -11.377
  246   2HD2  LEU  33          HD22      LEU  33 -14.610   7.611 -10.955
  247   3HD2  LEU  33          HD23      LEU  33 -14.029   9.258 -10.714
  248    H    GLY  34           HN       GLY  34 -17.309   8.010  -5.908
  249   1HA   GLY  34          HA2       GLY  34 -19.297   6.893  -6.598
  250   2HA   GLY  34          HA1       GLY  34 -18.310   5.631  -7.319
  251    H    CYS  35           HN       CYS  35 -17.095   6.411  -4.327
  252    HA   CYS  35           HA       CYS  35 -18.154   3.986  -3.160
  253   1HB   CYS  35          HB2       CYS  35 -15.877   5.737  -2.677
  254   2HB   CYS  35          HB1       CYS  35 -16.689   5.265  -1.189
  255    H    ASN  36           HN       ASN  36 -20.272   4.307  -2.708
  256    HA   ASN  36           HA       ASN  36 -20.968   6.564  -0.959
  257   1HB   ASN  36          HB2       ASN  36 -22.670   4.725  -2.657
  258   2HB   ASN  36          HB1       ASN  36 -23.351   5.857  -1.494
  259   1HD2  ASN  36          HD21      ASN  36 -24.446   6.927  -3.158
  260   2HD2  ASN  36          HD22      ASN  36 -23.620   8.008  -4.234
  261    H    ALA  37           HN       ALA  37 -20.959   3.073  -1.202
  262    HA   ALA  37           HA       ALA  37 -21.304   2.898   1.697
  263   1HB   ALA  37          HB1       ALA  37 -22.988   1.146   1.512
  264   2HB   ALA  37          HB2       ALA  37 -22.976   1.301  -0.245
  265   3HB   ALA  37          HB3       ALA  37 -23.558   2.634   0.754
  266    H    ARG  38           HN       ARG  38 -18.998   2.596   0.071
  267    HA   ARG  38           HA       ARG  38 -18.567  -0.314   0.184
  268   1HB   ARG  38          HB2       ARG  38 -18.619   0.725  -2.123
  269   2HB   ARG  38          HB1       ARG  38 -17.161   1.602  -1.667
  270   1HG   ARG  38          HG2       ARG  38 -16.360  -0.235  -2.831
  271   2HG   ARG  38          HG1       ARG  38 -16.174  -0.701  -1.139
  272   1HD   ARG  38          HD2       ARG  38 -17.135  -2.606  -1.968
  273   2HD   ARG  38          HD1       ARG  38 -18.585  -1.710  -1.513
  274    HE   ARG  38           HE       ARG  38 -17.887  -1.087  -4.173
  275   1HH1  ARG  38          HH11      ARG  38 -19.307  -3.671  -2.262
  276   2HH1  ARG  38          HH12      ARG  38 -20.090  -4.402  -3.631
  277   1HH2  ARG  38          HH21      ARG  38 -18.902  -2.061  -5.964
  278   2HH2  ARG  38          HH22      ARG  38 -19.870  -3.492  -5.720
  279    H    GLN  39           HN       GLN  39 -16.623  -1.073   0.988
  280    HA   GLN  39           HA       GLN  39 -14.985   0.822   2.471
  281   1HB   GLN  39          HB2       GLN  39 -14.914  -2.204   2.331
  282   2HB   GLN  39          HB1       GLN  39 -13.936  -1.217   3.409
  283   1HG   GLN  39          HG2       GLN  39 -15.854  -0.500   4.615
  284   2HG   GLN  39          HG1       GLN  39 -16.941  -1.214   3.428
  285   1HE2  GLN  39          HE21      GLN  39 -15.343  -3.635   3.168
  286   2HE2  GLN  39          HE22      GLN  39 -15.627  -4.555   4.602
  287    H    VAL  40           HN       VAL  40 -13.035   1.484   1.753
  288    HA   VAL  40           HA       VAL  40 -12.088   0.450  -0.816
  289    HB   VAL  40           HB       VAL  40 -11.258   2.901   0.754
  290   1HG1  VAL  40          HG11      VAL  40  -9.904   3.501  -1.201
  291   2HG1  VAL  40          HG12      VAL  40 -10.306   1.956  -1.950
  292   3HG1  VAL  40          HG13      VAL  40  -9.349   1.996  -0.469
  293   1HG2  VAL  40          HG21      VAL  40 -12.761   2.606  -1.843
  294   2HG2  VAL  40          HG22      VAL  40 -12.273   4.132  -1.105
  295   3HG2  VAL  40          HG23      VAL  40 -13.446   3.096  -0.293
  296    H    ALA  41           HN       ALA  41 -10.291  -0.767  -0.988
  297    HA   ALA  41           HA       ALA  41  -8.699  -1.138   1.430
  298   1HB   ALA  41          HB1       ALA  41 -10.306  -2.947   1.325
  299   2HB   ALA  41          HB2       ALA  41  -8.678  -3.552   1.013
  300   3HB   ALA  41          HB3       ALA  41  -9.806  -3.321  -0.325
  301    H    LEU  42           HN       LEU  42  -6.579  -1.566   1.123
  302    HA   LEU  42           HA       LEU  42  -5.568  -1.082  -1.581
  303   1HB   LEU  42          HB2       LEU  42  -4.064  -1.030   1.036
  304   2HB   LEU  42          HB1       LEU  42  -3.535  -0.364  -0.500
  305    HG   LEU  42           HG       LEU  42  -5.901   0.635   1.085
  306   1HD1  LEU  42          HD11      LEU  42  -4.495   2.558   1.633
  307   2HD1  LEU  42          HD12      LEU  42  -3.131   1.807   0.805
  308   3HD1  LEU  42          HD13      LEU  42  -3.798   1.064   2.259
  309   1HD2  LEU  42          HD21      LEU  42  -4.505   1.776  -1.337
  310   2HD2  LEU  42          HD22      LEU  42  -5.821   2.541  -0.446
  311   3HD2  LEU  42          HD23      LEU  42  -6.104   1.031  -1.314
  312    H    LYS  43           HN       LYS  43  -4.104  -2.445  -2.547
  313    HA   LYS  43           HA       LYS  43  -3.265  -4.881  -1.171
  314   1HB   LYS  43          HB2       LYS  43  -4.653  -4.943  -3.867
  315   2HB   LYS  43          HB1       LYS  43  -3.882  -6.312  -3.086
  316   1HG   LYS  43          HG2       LYS  43  -6.131  -6.654  -2.674
  317   2HG   LYS  43          HG1       LYS  43  -5.558  -5.895  -1.187
  318   1HD   LYS  43          HD2       LYS  43  -6.290  -3.692  -2.209
  319   2HD   LYS  43          HD1       LYS  43  -7.128  -4.658  -3.430
  320   1HE   LYS  43          HE2       LYS  43  -8.474  -3.927  -1.401
  321   2HE   LYS  43          HE1       LYS  43  -8.534  -5.636  -1.845
  322   1HZ   LYS  43          HZ1       LYS  43  -8.212  -5.205   0.564
  323   2HZ   LYS  43          HZ2       LYS  43  -6.691  -4.547   0.200
  324   3HZ   LYS  43          HZ3       LYS  43  -7.015  -6.174  -0.136
  325    H    ALA  44           HN       ALA  44  -1.424  -5.814  -2.095
  326    HA   ALA  44           HA       ALA  44  -0.103  -4.165  -4.123
  327   1HB   ALA  44          HB1       ALA  44   1.929  -5.463  -3.482
  328   2HB   ALA  44          HB2       ALA  44   0.969  -6.228  -2.213
  329   3HB   ALA  44          HB3       ALA  44   1.245  -4.485  -2.184
  330    H    ASP  45           HN       ASP  45   1.029  -5.304  -5.831
  331    HA   ASP  45           HA       ASP  45  -0.537  -7.511  -6.885
  332   1HB   ASP  45          HB2       ASP  45   0.266  -5.626  -8.335
  333   2HB   ASP  45          HB1       ASP  45   1.917  -6.162  -8.050
  334    H    THR  46           HN       THR  46   0.630  -9.518  -7.652
  335    HA   THR  46           HA       THR  46   1.927 -10.724  -5.484
  336    HB   THR  46           HB       THR  46   0.693 -12.047  -7.099
  337    HG1  THR  46           HG1      THR  46   3.441 -12.619  -6.719
  338   1HG2  THR  46          HG21      THR  46   1.599 -12.528  -9.323
  339   2HG2  THR  46          HG22      THR  46   2.914 -11.388  -9.037
  340   3HG2  THR  46          HG23      THR  46   1.250 -10.810  -9.131
  341    H    ASP  47           HN       ASP  47   3.188  -8.655  -7.805
  342    HA   ASP  47           HA       ASP  47   5.867  -9.334  -7.998
  343   1HB   ASP  47          HB2       ASP  47   5.250  -7.538  -9.309
  344   2HB   ASP  47          HB1       ASP  47   4.268  -6.821  -8.044
  345    H    ASN  48           HN       ASN  48   4.126  -7.761  -5.349
  346    HA   ASN  48           HA       ASN  48   6.428  -8.245  -3.605
  347   1HB   ASN  48          HB2       ASN  48   6.286  -6.001  -2.617
  348   2HB   ASN  48          HB1       ASN  48   6.647  -5.884  -4.336
  349   1HD2  ASN  48          HD21      ASN  48   5.014  -5.242  -5.763
  350   2HD2  ASN  48          HD22      ASN  48   3.654  -4.323  -5.198
  351    H    PHE  49           HN       PHE  49   3.695  -9.360  -4.036
  352    HA   PHE  49           HA       PHE  49   2.598  -8.947  -1.328
  353   1HB   PHE  49          HB2       PHE  49   1.238  -7.892  -3.158
  354   2HB   PHE  49          HB1       PHE  49   1.017  -9.489  -3.843
  355    HD1  PHE  49           HD1      PHE  49   0.296  -7.403  -0.885
  356    HD2  PHE  49           HD2      PHE  49  -0.701 -10.893  -3.100
  357    HE1  PHE  49           HE1      PHE  49  -1.664  -7.754   0.561
  358    HE2  PHE  49           HE2      PHE  49  -2.666 -11.244  -1.669
  359    HZ   PHE  49           HZ       PHE  49  -3.321  -9.517  -0.044
  360    H    GLU  50           HN       GLU  50   3.108 -10.780  -0.274
  361    HA   GLU  50           HA       GLU  50   2.653 -13.333  -1.664
  362   1HB   GLU  50          HB2       GLU  50   4.550 -12.615   0.570
  363   2HB   GLU  50          HB1       GLU  50   4.181 -14.277   0.129
  364   1HG   GLU  50          HG2       GLU  50   5.385 -12.211  -1.703
  365   2HG   GLU  50          HG1       GLU  50   6.265 -13.502  -0.880
  366    H    GLN  51           HN       GLN  51   0.713 -14.051  -1.165
  367    HA   GLN  51           HA       GLN  51  -1.021 -14.912   0.024
  368   1HB   GLN  51          HB2       GLN  51   0.542 -15.945   1.559
  369   2HB   GLN  51          HB1       GLN  51   0.756 -14.430   2.425
  370   1HG   GLN  51          HG2       GLN  51  -1.726 -14.539   2.941
  371   2HG   GLN  51          HG1       GLN  51  -1.672 -16.196   2.346
  372   1HE2  GLN  51          HE21      GLN  51  -2.239 -15.078   5.017
  373   2HE2  GLN  51          HE22      GLN  51  -1.128 -15.865   6.093
  374    H    GLY  52           HN       GLY  52   0.380 -12.246   1.879
  375   1HA   GLY  52          HA2       GLY  52  -1.717 -10.437   1.454
  376   2HA   GLY  52          HA1       GLY  52  -2.021 -11.296   2.963
  377    H    LYS  53           HN       LYS  53   1.118 -10.451   1.619
  378    HA   LYS  53           HA       LYS  53   1.413  -8.329   3.613
  379   1HB   LYS  53          HB2       LYS  53   2.922 -10.780   3.235
  380   2HB   LYS  53          HB1       LYS  53   3.934  -9.380   3.033
  381   1HG   LYS  53          HG2       LYS  53   4.148 -10.004   5.287
  382   2HG   LYS  53          HG1       LYS  53   3.076  -8.603   5.293
  383   1HD   LYS  53          HD2       LYS  53   1.204  -9.872   5.788
  384   2HD   LYS  53          HD1       LYS  53   1.922 -11.357   5.160
  385   1HE   LYS  53          HE2       LYS  53   1.784 -11.451   7.579
  386   2HE   LYS  53          HE1       LYS  53   3.468 -11.400   7.068
  387   1HZ   LYS  53          HZ1       LYS  53   3.186  -9.949   8.919
  388   2HZ   LYS  53          HZ2       LYS  53   1.874  -9.163   8.199
  389   3HZ   LYS  53          HZ3       LYS  53   3.433  -8.982   7.552
  390    H    PHE  54           HN       PHE  54   2.087  -6.416   2.661
  391    HA   PHE  54           HA       PHE  54   3.307  -6.652  -0.002
  392   1HB   PHE  54          HB2       PHE  54   2.778  -4.119  -0.143
  393   2HB   PHE  54          HB1       PHE  54   1.496  -5.285  -0.397
  394    HD1  PHE  54           HD1      PHE  54  -0.504  -4.654   0.397
  395    HD2  PHE  54           HD2      PHE  54   2.973  -3.526   2.571
  396    HE1  PHE  54           HE1      PHE  54  -1.916  -3.497   2.051
  397    HE2  PHE  54           HE2      PHE  54   1.560  -2.378   4.229
  398    HZ   PHE  54           HZ       PHE  54  -0.883  -2.357   3.969
  399    H    PHE  55           HN       PHE  55   5.258  -5.804  -0.434
  400    HA   PHE  55           HA       PHE  55   6.677  -4.437   1.715
  401   1HB   PHE  55          HB2       PHE  55   8.616  -6.047   1.427
  402   2HB   PHE  55          HB1       PHE  55   7.216  -6.665   2.278
  403    HD1  PHE  55           HD1      PHE  55   9.014  -6.707  -0.944
  404    HD2  PHE  55           HD2      PHE  55   6.038  -8.550   1.477
  405    HE1  PHE  55           HE1      PHE  55   8.934  -8.609  -2.502
  406    HE2  PHE  55           HE2      PHE  55   5.958 -10.459  -0.077
  407    HZ   PHE  55           HZ       PHE  55   7.406 -10.493  -2.065
  408    H    LEU  56           HN       LEU  56   8.854  -3.786   1.065
  409    HA   LEU  56           HA       LEU  56   8.846  -2.575  -1.553
  410   1HB   LEU  56          HB2       LEU  56  11.095  -2.665   0.462
  411   2HB   LEU  56          HB1       LEU  56  10.894  -1.515  -0.843
  412    HG   LEU  56           HG       LEU  56   8.941  -1.693   1.440
  413   1HD1  LEU  56          HD11      LEU  56  10.138   0.156   2.482
  414   2HD1  LEU  56          HD12      LEU  56  11.383   0.064   1.235
  415   3HD1  LEU  56          HD13      LEU  56  11.164  -1.275   2.363
  416   1HD2  LEU  56          HD21      LEU  56   9.616   0.521  -0.488
  417   2HD2  LEU  56          HD22      LEU  56   8.379   0.564   0.768
  418   3HD2  LEU  56          HD23      LEU  56   8.210  -0.538  -0.598
  419    H    ILE  57           HN       ILE  57   9.256  -3.942  -3.243
  420    HA   ILE  57           HA       ILE  57  11.408  -5.907  -2.867
  421    HB   ILE  57           HB       ILE  57   9.130  -6.828  -3.436
  422   1HG1  ILE  57          HG12      ILE  57   9.958  -8.355  -5.203
  423   2HG1  ILE  57          HG11      ILE  57  11.343  -7.295  -5.441
  424   1HG2  ILE  57          HG21      ILE  57   8.316  -6.630  -5.718
  425   2HG2  ILE  57          HG22      ILE  57   9.623  -5.507  -6.094
  426   3HG2  ILE  57          HG23      ILE  57   8.382  -5.057  -4.925
  427   1HD1  ILE  57          HD11      ILE  57  12.069  -7.734  -3.152
  428   2HD1  ILE  57          HD12      ILE  57  11.928  -9.223  -4.089
  429   3HD1  ILE  57          HD13      ILE  57  10.680  -8.794  -2.918
  430    H    SER  58           HN       SER  58  13.125  -5.899  -4.244
  431    HA   SER  58           HA       SER  58  13.491  -3.574  -5.896
  432   1HB   SER  58          HB2       SER  58  15.763  -4.877  -6.273
  433   2HB   SER  58          HB1       SER  58  15.446  -4.056  -4.744
  434    HG   SER  58           HG       SER  58  15.077  -5.953  -3.769
  435    H    ASP  59           HN       ASP  59  14.407  -3.864  -8.120
  436    HA   ASP  59           HA       ASP  59  12.709  -5.466  -9.728
  437   1HB   ASP  59          HB2       ASP  59  15.373  -4.357 -10.623
  438   2HB   ASP  59          HB1       ASP  59  13.932  -4.637 -11.593
  439    H    ASN  60           HN       ASN  60  15.821  -5.893  -8.281
  440    HA   ASN  60           HA       ASN  60  16.450  -8.349  -9.644
  441   1HB   ASN  60          HB2       ASN  60  18.174  -6.772  -8.749
  442   2HB   ASN  60          HB1       ASN  60  17.663  -7.198  -7.120
  443   1HD2  ASN  60          HD21      ASN  60  19.310  -8.232  -9.976
  444   2HD2  ASN  60          HD22      ASN  60  20.070  -9.633  -9.279
  445    H    ASN  61           HN       ASN  61  14.595  -7.401  -6.940
  446    HA   ASN  61           HA       ASN  61  13.270  -8.507  -5.474
  447   1HB   ASN  61          HB2       ASN  61  13.937 -10.979  -7.084
  448   2HB   ASN  61          HB1       ASN  61  12.624 -10.827  -5.925
  449   1HD2  ASN  61          HD21      ASN  61  10.792  -9.634  -6.484
  450   2HD2  ASN  61          HD22      ASN  61  10.463  -9.161  -8.115
  451    H    ARG  62           HN       ARG  62  16.152  -8.213  -5.007
  452    HA   ARG  62           HA       ARG  62  16.896 -10.639  -3.594
  453   1HB   ARG  62          HB2       ARG  62  19.052  -9.579  -3.224
  454   2HB   ARG  62          HB1       ARG  62  18.603  -9.463  -4.919
  455   1HG   ARG  62          HG2       ARG  62  18.005  -7.154  -4.658
  456   2HG   ARG  62          HG1       ARG  62  18.243  -7.248  -2.913
  457   1HD   ARG  62          HD2       ARG  62  20.652  -7.978  -3.543
  458   2HD   ARG  62          HD1       ARG  62  20.276  -7.260  -5.108
  459    HE   ARG  62           HE       ARG  62  19.710  -5.572  -2.819
  460   1HH1  ARG  62          HH11      ARG  62  22.010  -6.467  -5.302
  461   2HH1  ARG  62          HH12      ARG  62  23.007  -5.059  -5.077
  462   1HH2  ARG  62          HH21      ARG  62  20.989  -3.699  -2.542
  463   2HH2  ARG  62          HH22      ARG  62  22.391  -3.455  -3.540
  464    H    ASP  63           HN       ASP  63  16.251  -7.226  -2.786
  465    HA   ASP  63           HA       ASP  63  16.162  -7.995   0.056
  466   1HB   ASP  63          HB2       ASP  63  16.162  -5.156  -0.951
  467   2HB   ASP  63          HB1       ASP  63  16.561  -5.739   0.654
  468    H    LYS  64           HN       LYS  64  14.334  -7.625   1.252
  469    HA   LYS  64           HA       LYS  64  12.175  -6.105   0.014
  470   1HB   LYS  64          HB2       LYS  64  10.502  -7.795   0.690
  471   2HB   LYS  64          HB1       LYS  64  11.628  -8.409  -0.507
  472   1HG   LYS  64          HG2       LYS  64  11.506 -10.186   0.921
  473   2HG   LYS  64          HG1       LYS  64  12.892  -9.329   1.594
  474   1HD   LYS  64          HD2       LYS  64  11.393  -8.256   3.234
  475   2HD   LYS  64          HD1       LYS  64  10.045  -9.191   2.586
  476   1HE   LYS  64          HE2       LYS  64  12.539 -10.308   3.866
  477   2HE   LYS  64          HE1       LYS  64  10.943 -10.224   4.607
  478   1HZ   LYS  64          HZ1       LYS  64  11.814 -11.906   2.329
  479   2HZ   LYS  64          HZ2       LYS  64  10.175 -11.643   2.677
  480   3HZ   LYS  64          HZ3       LYS  64  11.173 -12.404   3.821
  481    H    LEU  65           HN       LEU  65  10.676  -5.234   1.508
  482    HA   LEU  65           HA       LEU  65  11.107  -5.530   4.360
  483   1HB   LEU  65          HB2       LEU  65  12.557  -3.613   3.148
  484   2HB   LEU  65          HB1       LEU  65  11.042  -2.756   3.332
  485    HG   LEU  65           HG       LEU  65  12.807  -3.828   5.504
  486   1HD1  LEU  65          HD11      LEU  65  12.818  -1.466   6.198
  487   2HD1  LEU  65          HD12      LEU  65  11.868  -1.063   4.769
  488   3HD1  LEU  65          HD13      LEU  65  13.500  -1.709   4.590
  489   1HD2  LEU  65          HD21      LEU  65  10.508  -4.306   6.131
  490   2HD2  LEU  65          HD22      LEU  65  10.045  -2.644   5.762
  491   3HD2  LEU  65          HD23      LEU  65  11.148  -2.976   7.097
  492    H    TYR  66           HN       TYR  66   9.056  -5.680   5.144
  493    HA   TYR  66           HA       TYR  66   6.824  -5.084   3.475
  494   1HB   TYR  66          HB2       TYR  66   6.590  -5.578   6.436
  495   2HB   TYR  66          HB1       TYR  66   5.463  -5.998   5.157
  496    HD1  TYR  66           HD1      TYR  66   8.889  -6.822   6.393
  497    HD2  TYR  66           HD2      TYR  66   5.419  -8.146   4.313
  498    HE1  TYR  66           HE1      TYR  66   9.830  -9.089   6.276
  499    HE2  TYR  66           HE2      TYR  66   6.361 -10.416   4.183
  500    HH   TYR  66           HH       TYR  66   8.551 -11.512   4.263
  501    H    VAL  67           HN       VAL  67   5.394  -3.417   3.562
  502    HA   VAL  67           HA       VAL  67   6.156  -1.182   5.319
  503    HB   VAL  67           HB       VAL  67   5.203   0.323   3.549
  504   1HG1  VAL  67          HG11      VAL  67   7.597   0.036   3.854
  505   2HG1  VAL  67          HG12      VAL  67   7.202   0.243   2.149
  506   3HG1  VAL  67          HG13      VAL  67   7.580  -1.361   2.779
  507   1HG2  VAL  67          HG21      VAL  67   3.873  -1.340   2.347
  508   2HG2  VAL  67          HG22      VAL  67   5.347  -2.180   1.863
  509   3HG2  VAL  67          HG23      VAL  67   5.023  -0.550   1.270
  510    H    ASN  68           HN       ASN  68   4.279   0.456   5.409
  511    HA   ASN  68           HA       ASN  68   1.675  -0.904   5.522
  512   1HB   ASN  68          HB2       ASN  68   3.120   0.492   7.708
  513   2HB   ASN  68          HB1       ASN  68   1.410   0.864   7.550
  514   1HD2  ASN  68          HD21      ASN  68   2.745  -2.281   6.740
  515   2HD2  ASN  68          HD22      ASN  68   2.035  -3.119   8.077
  516    H    ILE  69           HN       ILE  69   0.545   0.102   3.937
  517    HA   ILE  69           HA       ILE  69   0.806   2.976   3.610
  518    HB   ILE  69           HB       ILE  69  -1.373   2.277   2.087
  519   1HG1  ILE  69          HG12      ILE  69   0.600  -0.015   2.020
  520   2HG1  ILE  69          HG11      ILE  69  -1.066  -0.103   2.580
  521   1HG2  ILE  69          HG21      ILE  69   0.211   2.377   0.182
  522   2HG2  ILE  69          HG22      ILE  69   1.543   2.322   1.335
  523   3HG2  ILE  69          HG23      ILE  69   0.427   3.685   1.344
  524   1HD1  ILE  69          HD11      ILE  69  -0.181   0.505  -0.231
  525   2HD1  ILE  69          HD12      ILE  69  -1.850   0.391   0.326
  526   3HD1  ILE  69          HD13      ILE  69  -0.811  -1.036   0.348
  527    H    ARG  70           HN       ARG  70   0.133   3.727   5.549
  528    HA   ARG  70           HA       ARG  70  -2.541   2.985   6.501
  529   1HB   ARG  70          HB2       ARG  70  -0.793   2.604   8.112
  530   2HB   ARG  70          HB1       ARG  70  -0.154   4.223   7.876
  531   1HG   ARG  70          HG2       ARG  70  -2.293   5.113   8.817
  532   2HG   ARG  70          HG1       ARG  70  -2.731   3.449   9.216
  533   1HD   ARG  70          HD2       ARG  70  -0.714   3.238  10.574
  534   2HD   ARG  70          HD1       ARG  70  -0.261   4.893  10.167
  535    HE   ARG  70           HE       ARG  70  -2.615   4.142  11.787
  536   1HH1  ARG  70          HH11      ARG  70  -0.151   6.452  10.840
  537   2HH1  ARG  70          HH12      ARG  70  -0.485   7.536  12.157
  538   1HH2  ARG  70          HH21      ARG  70  -3.031   5.566  13.530
  539   2HH2  ARG  70          HH22      ARG  70  -2.111   7.031  13.677
  540    HA   PRO  71           HA       PRO  71  -4.369   6.834   5.264
  541   1HB   PRO  71          HB2       PRO  71  -5.781   6.968   7.764
  542   2HB   PRO  71          HB1       PRO  71  -6.403   6.579   6.167
  543   1HG   PRO  71          HG2       PRO  71  -5.740   4.801   8.364
  544   2HG   PRO  71          HG1       PRO  71  -6.673   4.472   6.892
  545   1HD   PRO  71          HD2       PRO  71  -4.170   3.468   7.398
  546   2HD   PRO  71          HD1       PRO  71  -4.855   3.688   5.777
  547    H    MET  72           HN       MET  72  -3.056   8.521   5.327
  548    HA   MET  72           HA       MET  72  -1.654   9.214   7.748
  549   1HB   MET  72          HB2       MET  72  -0.476   9.318   5.604
  550   2HB   MET  72          HB1       MET  72  -1.625  10.507   5.009
  551   1HG   MET  72          HG2       MET  72  -0.881  12.089   6.707
  552   2HG   MET  72          HG1       MET  72   0.255  10.895   7.333
  553   1HE   MET  72          HE1       MET  72   2.616  13.518   5.647
  554   2HE   MET  72          HE2       MET  72   2.212  12.659   7.133
  555   3HE   MET  72          HE3       MET  72   1.102  13.863   6.481
  556    H    ASP  73           HN       ASP  73  -3.089   9.958   9.180
  557    HA   ASP  73           HA       ASP  73  -4.116  11.607  10.359
  558   1HB   ASP  73          HB2       ASP  73  -2.473  13.087   9.094
  559   2HB   ASP  73          HB1       ASP  73  -3.777  13.420   7.964
  560    H    ASN  74           HN       ASN  74  -5.429   9.834   8.220
  561    HA   ASN  74           HA       ASN  74  -7.966  11.316   8.154
  562   1HB   ASN  74          HB2       ASN  74  -6.626   9.861   5.905
  563   2HB   ASN  74          HB1       ASN  74  -8.379   9.988   5.949
  564   1HD2  ASN  74          HD21      ASN  74  -5.389  11.672   5.500
  565   2HD2  ASN  74          HD22      ASN  74  -6.079  13.155   4.924
  566    H    SER  75           HN       SER  75  -8.324  10.076  10.131
  567    HA   SER  75           HA       SER  75  -9.712   8.632  11.175
  568   1HB   SER  75          HB2       SER  75 -11.094   8.901   9.084
  569   2HB   SER  75          HB1       SER  75 -10.330   7.441   8.462
  570    HG   SER  75           HG       SER  75 -12.229   6.820   9.417
  571    H    ALA  76           HN       ALA  76 -10.273   6.009  10.956
  572    HA   ALA  76           HA       ALA  76  -7.617   4.735  11.057
  573   1HB   ALA  76          HB1       ALA  76  -8.425   3.358  12.892
  574   2HB   ALA  76          HB2       ALA  76 -10.002   4.146  12.810
  575   3HB   ALA  76          HB3       ALA  76  -8.578   5.067  13.296
  576    H    TRP  77           HN       TRP  77  -7.422   2.697  10.200
  577    HA   TRP  77           HA       TRP  77  -9.778   1.629   8.782
  578   1HB   TRP  77          HB2       TRP  77  -6.931   1.922   7.856
  579   2HB   TRP  77          HB1       TRP  77  -8.015   0.754   7.119
  580    HD1  TRP  77           HD1      TRP  77  -9.398   4.202   8.061
  581    HE1  TRP  77           HE1      TRP  77  -9.925   5.484   5.888
  582    HE3  TRP  77           HE3      TRP  77  -7.282   0.997   4.697
  583    HZ2  TRP  77           HZ2      TRP  77  -9.479   5.176   3.122
  584    HZ3  TRP  77           HZ3      TRP  77  -7.372   1.560   2.311
  585    HH2  TRP  77           HH2      TRP  77  -8.442   3.615   1.545
  586    H    THR  78           HN       THR  78  -9.683  -0.700   8.354
  587    HA   THR  78           HA       THR  78  -8.496  -2.230  10.474
  588    HB   THR  78           HB       THR  78  -9.771  -3.234   7.914
  589    HG1  THR  78           HG1      THR  78 -11.031  -2.973  10.453
  590   1HG2  THR  78          HG21      THR  78  -9.343  -4.573  10.590
  591   2HG2  THR  78          HG22      THR  78  -8.445  -4.916   9.112
  592   3HG2  THR  78          HG23      THR  78 -10.169  -5.281   9.201
  593    H    THR  79           HN       THR  79  -6.366  -2.492  10.479
  594    HA   THR  79           HA       THR  79  -4.920  -2.282   7.961
  595    HB   THR  79           HB       THR  79  -4.132  -0.748   9.560
  596    HG1  THR  79           HG1      THR  79  -2.521  -2.255   8.456
  597   1HG2  THR  79          HG21      THR  79  -3.364  -1.366  11.812
  598   2HG2  THR  79          HG22      THR  79  -3.886  -3.027  11.530
  599   3HG2  THR  79          HG23      THR  79  -5.075  -1.724  11.581
  600    H    ASP  80           HN       ASP  80  -4.673  -4.139   6.949
  601    HA   ASP  80           HA       ASP  80  -3.312  -6.287   8.434
  602   1HB   ASP  80          HB2       ASP  80  -5.318  -7.071   7.261
  603   2HB   ASP  80          HB1       ASP  80  -4.740  -6.362   5.760
  604    H    ASN  81           HN       ASN  81  -1.448  -7.262   7.231
  605    HA   ASN  81           HA       ASN  81   0.263  -5.128   6.347
  606   1HB   ASN  81          HB2       ASN  81   0.773  -7.377   7.698
  607   2HB   ASN  81          HB1       ASN  81   1.089  -7.982   6.079
  608   1HD2  ASN  81          HD21      ASN  81   2.154  -5.387   5.135
  609   2HD2  ASN  81          HD22      ASN  81   3.702  -5.222   5.880
  610    H    GLY  82           HN       GLY  82  -1.998  -7.000   4.784
  611   1HA   GLY  82          HA2       GLY  82  -0.629  -6.598   2.200
  612   2HA   GLY  82          HA1       GLY  82  -1.590  -8.028   2.537
  613    H    VAL  83           HN       VAL  83  -3.708  -6.574   3.937
  614    HA   VAL  83           HA       VAL  83  -4.749  -4.978   1.693
  615    HB   VAL  83           HB       VAL  83  -6.991  -5.699   2.132
  616   1HG1  VAL  83          HG11      VAL  83  -6.838  -8.077   1.537
  617   2HG1  VAL  83          HG12      VAL  83  -5.136  -8.078   1.994
  618   3HG1  VAL  83          HG13      VAL  83  -5.681  -7.099   0.635
  619   1HG2  VAL  83          HG21      VAL  83  -7.542  -7.402   3.805
  620   2HG2  VAL  83          HG22      VAL  83  -6.876  -5.949   4.551
  621   3HG2  VAL  83          HG23      VAL  83  -5.873  -7.387   4.373
  622    H    PHE  84           HN       PHE  84  -6.029  -3.150   2.215
  623    HA   PHE  84           HA       PHE  84  -6.022  -2.369   5.039
  624   1HB   PHE  84          HB2       PHE  84  -4.106  -1.466   3.233
  625   2HB   PHE  84          HB1       PHE  84  -5.290  -0.168   3.263
  626    HD1  PHE  84           HD1      PHE  84  -6.002   0.645   5.639
  627    HD2  PHE  84           HD2      PHE  84  -2.450  -1.544   4.807
  628    HE1  PHE  84           HE1      PHE  84  -4.998   1.489   7.717
  629    HE2  PHE  84           HE2      PHE  84  -1.439  -0.701   6.886
  630    HZ   PHE  84           HZ       PHE  84  -2.716   0.818   8.345
  631    H    TYR  85           HN       TYR  85  -8.236  -2.282   5.252
  632    HA   TYR  85           HA       TYR  85  -9.617  -0.408   3.457
  633   1HB   TYR  85          HB2       TYR  85 -11.610  -1.794   3.392
  634   2HB   TYR  85          HB1       TYR  85 -10.254  -2.701   2.748
  635    HD1  TYR  85           HD1      TYR  85 -13.071  -2.927   4.772
  636    HD2  TYR  85           HD2      TYR  85  -8.987  -4.124   4.630
  637    HE1  TYR  85           HE1      TYR  85 -13.546  -4.736   6.379
  638    HE2  TYR  85           HE2      TYR  85  -9.454  -5.939   6.222
  639    HH   TYR  85           HH       TYR  85 -12.641  -6.857   7.105
  640    H    LYS  86           HN       LYS  86 -11.225   0.860   4.432
  641    HA   LYS  86           HA       LYS  86 -11.040   0.953   7.301
  642   1HB   LYS  86          HB2       LYS  86 -12.174   2.986   7.256
  643   2HB   LYS  86          HB1       LYS  86 -11.192   3.017   5.808
  644   1HG   LYS  86          HG2       LYS  86 -13.996   2.078   5.574
  645   2HG   LYS  86          HG1       LYS  86 -13.714   3.795   5.839
  646   1HD   LYS  86          HD2       LYS  86 -12.065   3.601   3.858
  647   2HD   LYS  86          HD1       LYS  86 -12.903   2.083   3.515
  648   1HE   LYS  86          HE2       LYS  86 -15.052   3.321   3.485
  649   2HE   LYS  86          HE1       LYS  86 -14.160   4.826   3.730
  650   1HZ   LYS  86          HZ1       LYS  86 -14.715   4.524   1.431
  651   2HZ   LYS  86          HZ2       LYS  86 -13.946   3.020   1.388
  652   3HZ   LYS  86          HZ3       LYS  86 -13.034   4.426   1.622
  653    H    ASN  87           HN       ASN  87 -12.782   0.778   8.721
  654    HA   ASN  87           HA       ASN  87 -14.513  -1.427   8.083
  655   1HB   ASN  87          HB2       ASN  87 -13.406  -1.109  10.298
  656   2HB   ASN  87          HB1       ASN  87 -14.424   0.302  10.567
  657   1HD2  ASN  87          HD21      ASN  87 -15.369  -0.594  12.389
  658   2HD2  ASN  87          HD22      ASN  87 -16.515  -1.892  12.298
  659    H    ASP  88           HN       ASP  88 -14.688   1.919   7.816
  660    HA   ASP  88           HA       ASP  88 -17.574   2.117   8.002
  661   1HB   ASP  88          HB2       ASP  88 -15.523   4.138   7.057
  662   2HB   ASP  88          HB1       ASP  88 -17.228   4.464   7.346
  663    H    VAL  89           HN       VAL  89 -18.967   2.430   6.251
  664    HA   VAL  89           HA       VAL  89 -17.804   1.680   3.659
  665    HB   VAL  89           HB       VAL  89 -20.134   1.131   2.959
  666   1HG1  VAL  89          HG11      VAL  89 -20.274  -0.958   4.250
  667   2HG1  VAL  89          HG12      VAL  89 -19.080  -0.320   5.381
  668   3HG1  VAL  89          HG13      VAL  89 -18.634  -0.613   3.700
  669   1HG2  VAL  89          HG21      VAL  89 -21.863   0.871   4.663
  670   2HG2  VAL  89          HG22      VAL  89 -21.338   2.551   4.558
  671   3HG2  VAL  89          HG23      VAL  89 -20.778   1.532   5.884
  672    H    GLY  90           HN       GLY  90 -17.588   3.167   2.155
  673   1HA   GLY  90          HA2       GLY  90 -19.168   4.836   0.948
  674   2HA   GLY  90          HA1       GLY  90 -19.037   5.699   2.474
  675    H    SER  91           HN       SER  91 -18.028   7.475   1.647
  676    HA   SER  91           HA       SER  91 -15.794   7.325  -0.103
  677   1HB   SER  91          HB2       SER  91 -15.728   9.830   0.431
  678   2HB   SER  91          HB1       SER  91 -17.205   9.214  -0.316
  679    HG   SER  91           HG       SER  91 -17.555  10.611   1.530
  680    H    TRP  92           HN       TRP  92 -13.883   8.808   0.541
  681    HA   TRP  92           HA       TRP  92 -13.012   8.996   3.211
  682   1HB   TRP  92          HB2       TRP  92 -12.707   6.537   2.908
  683   2HB   TRP  92          HB1       TRP  92 -11.606   6.888   1.571
  684    HD1  TRP  92           HD1      TRP  92 -11.842   7.253   5.405
  685    HE1  TRP  92           HE1      TRP  92  -9.452   7.606   6.315
  686    HE3  TRP  92           HE3      TRP  92  -9.369   7.617   0.978
  687    HZ2  TRP  92           HZ2      TRP  92  -6.855   8.004   5.246
  688    HZ3  TRP  92           HZ3      TRP  92  -6.966   7.990   1.004
  689    HH2  TRP  92           HH2      TRP  92  -5.714   8.169   3.087
  690    H    GLY  93           HN       GLY  93 -11.771   8.399  -0.011
  691   1HA   GLY  93          HA2       GLY  93 -10.033   9.428  -1.179
  692   2HA   GLY  93          HA1       GLY  93 -11.215  10.705  -1.116
  693    H    GLY  94           HN       GLY  94  -8.115   9.621  -0.101
  694   1HA   GLY  94          HA2       GLY  94  -7.246  12.241   0.404
  695   2HA   GLY  94          HA1       GLY  94  -7.532  11.439   1.943
  696    H    THR  95           HN       THR  95  -5.341  11.508   2.506
  697    HA   THR  95           HA       THR  95  -3.464  10.215   0.676
  698    HB   THR  95           HB       THR  95  -1.778  11.239   2.379
  699    HG1  THR  95           HG1      THR  95  -2.574  12.854   3.631
  700   1HG2  THR  95          HG21      THR  95  -1.817  13.369   1.156
  701   2HG2  THR  95          HG22      THR  95  -3.417  12.975   0.527
  702   3HG2  THR  95          HG23      THR  95  -2.023  11.997   0.069
  703    H    ILE  96           HN       ILE  96  -2.664   8.292   1.058
  704    HA   ILE  96           HA       ILE  96  -2.455   7.354   3.844
  705    HB   ILE  96           HB       ILE  96  -2.203   5.017   2.697
  706   1HG1  ILE  96          HG12      ILE  96  -2.367   6.163   0.386
  707   2HG1  ILE  96          HG11      ILE  96  -3.241   4.661   0.649
  708   1HG2  ILE  96          HG21      ILE  96  -4.862   6.379   3.044
  709   2HG2  ILE  96          HG22      ILE  96  -3.947   5.488   4.261
  710   3HG2  ILE  96          HG23      ILE  96  -4.640   4.638   2.880
  711   1HD1  ILE  96          HD11      ILE  96  -4.450   7.407   0.795
  712   2HD1  ILE  96          HD12      ILE  96  -5.301   5.874   0.961
  713   3HD1  ILE  96          HD13      ILE  96  -4.559   6.309  -0.579
  714    H    GLY  97           HN       GLY  97  -0.406   6.788   4.521
  715   1HA   GLY  97          HA2       GLY  97   1.682   7.497   2.564
  716   2HA   GLY  97          HA1       GLY  97   1.804   7.748   4.300
  717    H    ILE  98           HN       ILE  98   3.629   6.342   2.499
  718    HA   ILE  98           HA       ILE  98   3.427   3.593   3.384
  719    HB   ILE  98           HB       ILE  98   5.425   5.042   1.657
  720   1HG1  ILE  98          HG12      ILE  98   4.761   2.992   0.168
  721   2HG1  ILE  98          HG11      ILE  98   3.379   2.888   1.262
  722   1HG2  ILE  98          HG21      ILE  98   6.717   3.558   3.097
  723   2HG2  ILE  98          HG22      ILE  98   6.692   2.961   1.436
  724   3HG2  ILE  98          HG23      ILE  98   5.669   2.208   2.660
  725   1HD1  ILE  98          HD11      ILE  98   4.118   5.286  -0.392
  726   2HD1  ILE  98          HD12      ILE  98   2.717   5.139   0.673
  727   3HD1  ILE  98          HD13      ILE  98   2.846   4.120  -0.761
  728    H    TYR  99           HN       TYR  99   3.872   3.226   5.418
  729    HA   TYR  99           HA       TYR  99   6.227   4.413   6.692
  730   1HB   TYR  99          HB2       TYR  99   4.170   2.537   7.897
  731   2HB   TYR  99          HB1       TYR  99   5.365   3.488   8.758
  732    HD1  TYR  99           HD1      TYR  99   4.687   5.436   9.773
  733    HD2  TYR  99           HD2      TYR  99   2.391   3.956   6.524
  734    HE1  TYR  99           HE1      TYR  99   2.987   7.146  10.213
  735    HE2  TYR  99           HE2      TYR  99   0.685   5.676   6.940
  736    HH   TYR  99           HH       TYR  99   1.198   8.283   9.167
  737    H    VAL 100           HN       VAL 100   7.855   2.965   7.539
  738    HA   VAL 100           HA       VAL 100   7.984   0.379   6.208
  739    HB   VAL 100           HB       VAL 100  10.076   1.567   6.264
  740   1HG1  VAL 100          HG11      VAL 100   9.633   3.003   8.191
  741   2HG1  VAL 100          HG12      VAL 100  11.186   2.184   8.351
  742   3HG1  VAL 100          HG13      VAL 100   9.789   1.615   9.266
  743   1HG2  VAL 100          HG21      VAL 100  10.127  -0.677   8.273
  744   2HG2  VAL 100          HG22      VAL 100  11.512  -0.047   7.380
  745   3HG2  VAL 100          HG23      VAL 100  10.199  -0.850   6.520
  746    H    ASP 101           HN       ASP 101   7.279  -1.476   7.163
  747    HA   ASP 101           HA       ASP 101   6.383  -1.307   9.914
  748   1HB   ASP 101          HB2       ASP 101   5.054  -2.515   8.127
  749   2HB   ASP 101          HB1       ASP 101   6.311  -3.753   8.143
  750    H    GLY 102           HN       GLY 102   8.093  -1.245  11.260
  751   1HA   GLY 102          HA2       GLY 102   9.845  -2.104  12.489
  752   2HA   GLY 102          HA1       GLY 102   9.709  -3.597  11.567
  753    H    GLN 103           HN       GLN 103  10.908  -0.277  11.426
  754    HA   GLN 103           HA       GLN 103  12.260  -0.073   9.135
  755   1HB   GLN 103          HB2       GLN 103  13.903   1.325  10.314
  756   2HB   GLN 103          HB1       GLN 103  12.253   1.654  10.826
  757   1HG   GLN 103          HG2       GLN 103  12.832  -0.069  12.713
  758   2HG   GLN 103          HG1       GLN 103  14.490   0.380  12.317
  759   1HE2  GLN 103          HE21      GLN 103  11.495   1.389  13.692
  760   2HE2  GLN 103          HE22      GLN 103  12.065   2.880  14.368
  761    H    GLN 104           HN       GLN 104  13.639  -1.221   8.033
  762    HA   GLN 104           HA       GLN 104  15.175  -3.328   9.323
  763   1HB   GLN 104          HB2       GLN 104  14.310  -2.746   6.522
  764   2HB   GLN 104          HB1       GLN 104  15.688  -3.798   6.758
  765   1HG   GLN 104          HG2       GLN 104  13.000  -4.240   8.026
  766   2HG   GLN 104          HG1       GLN 104  13.504  -4.961   6.500
  767   1HE2  GLN 104          HE21      GLN 104  13.316  -7.035   7.287
  768   2HE2  GLN 104          HE22      GLN 104  14.431  -7.700   8.433
  769    H    THR 105           HN       THR 105  15.763  -0.339   9.300
  770    HA   THR 105           HA       THR 105  17.626   0.905   9.613
  771    HB   THR 105           HB       THR 105  19.246  -1.610   9.218
  772    HG1  THR 105           HG1      THR 105  18.760  -2.141  11.328
  773   1HG2  THR 105          HG21      THR 105  20.715  -0.565  10.883
  774   2HG2  THR 105          HG22      THR 105  19.638   0.831  10.957
  775   3HG2  THR 105          HG23      THR 105  20.513   0.470   9.470
  776    H    ASN 106           HN       ASN 106  16.780  -0.289   6.775
  777    HA   ASN 106           HA       ASN 106  17.255   0.098   4.608
  778   1HB   ASN 106          HB2       ASN 106  17.458   2.453   5.313
  779   2HB   ASN 106          HB1       ASN 106  19.166   2.197   5.649
  780   1HD2  ASN 106          HD21      ASN 106  20.615   2.230   3.996
  781   2HD2  ASN 106          HD22      ASN 106  20.183   2.563   2.352
  782    H    THR 107           HN       THR 107  18.121  -1.960   4.410
  783    HA   THR 107           HA       THR 107  20.981  -2.330   4.507
  784    HB   THR 107           HB       THR 107  19.561  -4.253   5.013
  785    HG1  THR 107           HG1      THR 107  20.700  -4.780   2.455
  786   1HG2  THR 107          HG21      THR 107  18.512  -3.993   2.193
  787   2HG2  THR 107          HG22      THR 107  17.605  -3.662   3.669
  788   3HG2  THR 107          HG23      THR 107  18.145  -5.304   3.314
  789    HA   PRO 108           HA       PRO 108  22.479  -0.517   0.837
  790   1HB   PRO 108          HB2       PRO 108  22.963  -3.341  -0.044
  791   2HB   PRO 108          HB1       PRO 108  24.023  -1.932  -0.165
  792   1HG   PRO 108          HG2       PRO 108  24.216  -3.802   1.819
  793   2HG   PRO 108          HG1       PRO 108  24.741  -2.120   1.990
  794   1HD   PRO 108          HD2       PRO 108  22.569  -3.466   3.337
  795   2HD   PRO 108          HD1       PRO 108  23.141  -1.801   3.559
  796    HA   PRO 109           HA       PRO 109  18.722  -1.435  -1.568
  797   1HB   PRO 109          HB2       PRO 109  17.622   0.968  -1.496
  798   2HB   PRO 109          HB1       PRO 109  17.684  -0.011  -0.031
  799   1HG   PRO 109          HG2       PRO 109  19.440   2.269  -0.846
  800   2HG   PRO 109          HG1       PRO 109  18.716   1.921   0.736
  801   1HD   PRO 109          HD2       PRO 109  21.313   1.265  -0.012
  802   2HD   PRO 109          HD1       PRO 109  20.402   0.520   1.320
  803    H    GLY 110           HN       GLY 110  17.755   0.454  -3.273
  804   1HA   GLY 110          HA2       GLY 110  19.612   1.821  -4.860
  805   2HA   GLY 110          HA1       GLY 110  19.393   0.204  -5.526
  806    H    ASN 111           HN       ASN 111  17.196  -0.480  -5.991
  807    HA   ASN 111           HA       ASN 111  15.254   1.693  -6.275
  808   1HB   ASN 111          HB2       ASN 111  16.475   1.424  -8.454
  809   2HB   ASN 111          HB1       ASN 111  15.890  -0.240  -8.510
  810   1HD2  ASN 111          HD21      ASN 111  13.884  -0.652  -9.207
  811   2HD2  ASN 111          HD22      ASN 111  12.754   0.562  -9.707
  812    H    TYR 112           HN       TYR 112  13.403   1.065  -5.408
  813    HA   TYR 112           HA       TYR 112  12.794  -1.814  -5.413
  814   1HB   TYR 112          HB2       TYR 112  12.197   0.259  -3.297
  815   2HB   TYR 112          HB1       TYR 112  11.468  -1.347  -3.317
  816    HD1  TYR 112           HD1      TYR 112  13.162  -3.362  -3.412
  817    HD2  TYR 112           HD2      TYR 112  14.201   0.581  -2.209
  818    HE1  TYR 112           HE1      TYR 112  15.088  -4.245  -2.186
  819    HE2  TYR 112           HE2      TYR 112  16.139  -0.293  -0.991
  820    HH   TYR 112           HH       TYR 112  16.893  -2.407   0.031
  821    H    THR 113           HN       THR 113  11.025  -2.419  -6.348
  822    HA   THR 113           HA       THR 113   9.211  -0.338  -7.366
  823    HB   THR 113           HB       THR 113  10.002  -2.944  -8.677
  824    HG1  THR 113           HG1      THR 113  11.497  -1.841  -9.738
  825   1HG2  THR 113          HG21      THR 113   8.388  -0.628  -9.749
  826   2HG2  THR 113          HG22      THR 113   7.737  -2.191  -9.257
  827   3HG2  THR 113          HG23      THR 113   8.829  -2.084 -10.638
  828    H    LEU 114           HN       LEU 114   7.593  -0.560  -5.887
  829    HA   LEU 114           HA       LEU 114   6.515  -3.248  -5.469
  830   1HB   LEU 114          HB2       LEU 114   5.140  -1.850  -3.668
  831   2HB   LEU 114          HB1       LEU 114   6.719  -2.535  -3.334
  832    HG   LEU 114           HG       LEU 114   6.535   0.267  -4.355
  833   1HD1  LEU 114          HD11      LEU 114   6.147  -0.565  -1.481
  834   2HD1  LEU 114          HD12      LEU 114   4.916   0.153  -2.520
  835   3HD1  LEU 114          HD13      LEU 114   6.340   1.089  -2.065
  836   1HD2  LEU 114          HD21      LEU 114   8.720  -0.820  -4.145
  837   2HD2  LEU 114          HD22      LEU 114   8.404  -1.107  -2.435
  838   3HD2  LEU 114          HD23      LEU 114   8.555   0.541  -3.038
  839    H    THR 115           HN       THR 115   5.210  -3.645  -7.076
  840    HA   THR 115           HA       THR 115   3.470  -1.714  -8.264
  841    HB   THR 115           HB       THR 115   3.217  -4.717  -8.465
  842    HG1  THR 115           HG1      THR 115   5.366  -4.254  -8.932
  843   1HG2  THR 115          HG21      THR 115   2.397  -4.199 -10.727
  844   2HG2  THR 115          HG22      THR 115   2.593  -2.476 -10.401
  845   3HG2  THR 115          HG23      THR 115   1.413  -3.418  -9.489
  846    H    LEU 116           HN       LEU 116   1.623  -1.005  -7.416
  847    HA   LEU 116           HA       LEU 116   0.303  -2.673  -5.384
  848   1HB   LEU 116          HB2       LEU 116   0.336   0.332  -5.680
  849   2HB   LEU 116          HB1       LEU 116  -0.624  -0.538  -4.498
  850    HG   LEU 116           HG       LEU 116   2.393  -0.450  -4.631
  851   1HD1  LEU 116          HD11      LEU 116   1.410   1.622  -3.836
  852   2HD1  LEU 116          HD12      LEU 116   2.190   0.759  -2.510
  853   3HD1  LEU 116          HD13      LEU 116   0.433   0.731  -2.669
  854   1HD2  LEU 116          HD21      LEU 116   1.613  -2.621  -3.841
  855   2HD2  LEU 116          HD22      LEU 116   0.570  -1.828  -2.661
  856   3HD2  LEU 116          HD23      LEU 116   2.322  -1.690  -2.521
  857    H    THR 117           HN       THR 117  -1.796  -3.152  -5.574
  858    HA   THR 117           HA       THR 117  -3.326  -1.917  -7.769
  859    HB   THR 117           HB       THR 117  -3.389  -4.860  -7.033
  860    HG1  THR 117           HG1      THR 117  -1.517  -3.830  -8.324
  861   1HG2  THR 117          HG21      THR 117  -4.784  -5.083  -9.040
  862   2HG2  THR 117          HG22      THR 117  -4.736  -3.334  -9.267
  863   3HG2  THR 117          HG23      THR 117  -5.533  -4.018  -7.850
  864    H    GLY 118           HN       GLY 118  -4.861  -0.780  -6.707
  865   1HA   GLY 118          HA2       GLY 118  -5.735  -1.659  -4.065
  866   2HA   GLY 118          HA1       GLY 118  -6.063  -0.098  -4.807
  867    H    GLY 119           HN       GLY 119  -8.261  -0.413  -4.102
  868   1HA   GLY 119          HA2       GLY 119 -10.077  -0.682  -5.972
  869   2HA   GLY 119          HA1       GLY 119  -9.764  -2.380  -5.644
  870    H    TYR 120           HN       TYR 120 -12.042  -2.401  -5.093
  871    HA   TYR 120           HA       TYR 120 -12.589  -1.218  -2.471
  872   1HB   TYR 120          HB2       TYR 120 -14.958  -1.695  -2.934
  873   2HB   TYR 120          HB1       TYR 120 -14.243  -0.668  -4.167
  874    HD1  TYR 120           HD1      TYR 120 -15.742  -3.918  -3.444
  875    HD2  TYR 120           HD2      TYR 120 -13.854  -1.536  -6.427
  876    HE1  TYR 120           HE1      TYR 120 -16.551  -5.456  -5.184
  877    HE2  TYR 120           HE2      TYR 120 -14.658  -3.068  -8.171
  878    HH   TYR 120           HH       TYR 120 -17.059  -5.343  -7.654
  879    H    TRP 121           HN       TRP 121 -13.219  -2.427  -0.760
  880    HA   TRP 121           HA       TRP 121 -12.763  -5.315  -0.980
  881   1HB   TRP 121          HB2       TRP 121 -11.420  -4.227   0.724
  882   2HB   TRP 121          HB1       TRP 121 -12.852  -3.481   1.425
  883    HD1  TRP 121           HD1      TRP 121 -14.649  -5.232   2.536
  884    HE1  TRP 121           HE1      TRP 121 -14.227  -7.402   3.835
  885    HE3  TRP 121           HE3      TRP 121  -9.885  -6.186   0.988
  886    HZ2  TRP 121           HZ2      TRP 121 -12.163  -9.260   4.150
  887    HZ3  TRP 121           HZ3      TRP 121  -8.757  -8.201   1.872
  888    HH2  TRP 121           HH2      TRP 121  -9.879  -9.695   3.405
  889    H    ALA 122           HN       ALA 122 -14.457  -6.723  -0.712
  890    HA   ALA 122           HA       ALA 122 -16.942  -5.654   0.381
  891   1HB   ALA 122          HB1       ALA 122 -18.262  -6.459  -1.485
  892   2HB   ALA 122          HB2       ALA 122 -16.801  -7.055  -2.274
  893   3HB   ALA 122          HB3       ALA 122 -17.039  -5.320  -2.052
  894    H    LYS 123           HN       LYS 123 -15.498  -7.232   1.817
  895    HA   LYS 123           HA       LYS 123 -17.266  -9.453   2.260
  896   1HB   LYS 123          HB2       LYS 123 -14.345  -9.948   1.611
  897   2HB   LYS 123          HB1       LYS 123 -15.328 -11.096   2.501
  898   1HG   LYS 123          HG2       LYS 123 -15.911 -10.145  -0.295
  899   2HG   LYS 123          HG1       LYS 123 -15.084 -11.648   0.111
  900   1HD   LYS 123          HD2       LYS 123 -17.026 -12.542   1.134
  901   2HD   LYS 123          HD1       LYS 123 -17.838 -10.975   1.119
  902   1HE   LYS 123          HE2       LYS 123 -18.707 -12.441  -0.631
  903   2HE   LYS 123          HE1       LYS 123 -17.919 -11.021  -1.315
  904   1HZ   LYS 123          HZ1       LYS 123 -16.733 -13.741  -1.103
  905   2HZ   LYS 123          HZ2       LYS 123 -15.955 -12.379  -1.746
  906   3HZ   LYS 123          HZ3       LYS 123 -17.321 -13.017  -2.519
  907    H    ASP 124           HN       ASP 124 -15.037 -10.622   3.991
  908    HA   ASP 124           HA       ASP 124 -14.332  -8.422   5.708
  909   1HB   ASP 124          HB2       ASP 124 -15.258  -9.552   7.763
  910   2HB   ASP 124          HB1       ASP 124 -16.469  -8.887   6.675
  911    H    ASN 125           HN       ASN 125 -12.304  -8.641   5.770
  912    HA   ASN 125           HA       ASN 125 -10.238  -9.346   6.300
  913   1HB   ASN 125          HB2       ASN 125 -11.674 -11.486   7.842
  914   2HB   ASN 125          HB1       ASN 125  -9.954 -11.134   7.946
  915   1HD2  ASN 125          HD21      ASN 125 -12.263 -10.974   9.870
  916   2HD2  ASN 125          HD22      ASN 125 -12.143  -9.384  10.547
  917    H    LYS 126           HN       LYS 126 -12.331 -11.921   5.083
  918    HA   LYS 126           HA       LYS 126 -10.451 -13.907   4.842
  919   1HB   LYS 126          HB2       LYS 126 -11.921 -14.988   3.212
  920   2HB   LYS 126          HB1       LYS 126 -12.819 -14.359   4.584
  921   1HG   LYS 126          HG2       LYS 126 -13.744 -12.615   3.315
  922   2HG   LYS 126          HG1       LYS 126 -12.574 -12.828   2.017
  923   1HD   LYS 126          HD2       LYS 126 -14.460 -13.795   1.124
  924   2HD   LYS 126          HD1       LYS 126 -13.604 -15.182   1.787
  925   1HE   LYS 126          HE2       LYS 126 -15.799 -13.713   3.241
  926   2HE   LYS 126          HE1       LYS 126 -16.075 -15.129   2.231
  927   1HZ   LYS 126          HZ1       LYS 126 -15.931 -15.875   4.443
  928   2HZ   LYS 126          HZ2       LYS 126 -14.531 -14.977   4.757
  929   3HZ   LYS 126          HZ3       LYS 126 -14.462 -16.319   3.715
  930    H    GLN 127           HN       GLN 127 -11.352 -11.557   2.335
  931    HA   GLN 127           HA       GLN 127  -9.109 -10.847   1.176
  932   1HB   GLN 127          HB2       GLN 127  -8.544 -13.359   1.062
  933   2HB   GLN 127          HB1       GLN 127  -9.735 -13.445  -0.232
  934   1HG   GLN 127          HG2       GLN 127  -8.414 -11.689  -1.438
  935   2HG   GLN 127          HG1       GLN 127  -7.177 -11.858  -0.195
  936   1HE2  GLN 127          HE21      GLN 127  -7.103 -12.384  -3.085
  937   2HE2  GLN 127          HE22      GLN 127  -6.594 -14.027  -3.251
  938    H    GLY 128           HN       GLY 128 -12.101 -10.555   1.216
  939   1HA   GLY 128          HA2       GLY 128 -12.914 -10.848  -1.532
  940   2HA   GLY 128          HA1       GLY 128 -13.883 -10.199  -0.217
  941    H    PHE 129           HN       PHE 129 -11.466  -9.473  -2.630
  942    HA   PHE 129           HA       PHE 129 -12.333  -6.685  -2.506
  943   1HB   PHE 129          HB2       PHE 129 -10.024  -5.884  -2.727
  944   2HB   PHE 129          HB1       PHE 129 -10.257  -6.767  -1.227
  945    HD1  PHE 129           HD1      PHE 129  -8.912  -8.628  -0.701
  946    HD2  PHE 129           HD2      PHE 129  -8.876  -7.034  -4.648
  947    HE1  PHE 129           HE1      PHE 129  -7.004 -10.073  -1.260
  948    HE2  PHE 129           HE2      PHE 129  -6.959  -8.471  -5.210
  949    HZ   PHE 129           HZ       PHE 129  -5.957  -9.925  -3.473
  950    H    THR 130           HN       THR 130 -12.029  -5.546  -4.506
  951    HA   THR 130           HA       THR 130 -11.045  -7.131  -6.765
  952    HB   THR 130           HB       THR 130 -13.710  -5.695  -6.759
  953    HG1  THR 130           HG1      THR 130 -13.826  -7.771  -5.834
  954   1HG2  THR 130          HG21      THR 130 -13.917  -6.541  -9.082
  955   2HG2  THR 130          HG22      THR 130 -12.238  -7.077  -9.009
  956   3HG2  THR 130          HG23      THR 130 -12.621  -5.359  -8.898
  957    HA   PRO 131           HA       PRO 131  -8.779  -3.344  -7.487
  958   1HB   PRO 131          HB2       PRO 131  -8.543  -4.569 -10.187
  959   2HB   PRO 131          HB1       PRO 131  -7.278  -3.963  -9.112
  960   1HG   PRO 131          HG2       PRO 131  -7.653  -6.579  -9.435
  961   2HG   PRO 131          HG1       PRO 131  -7.241  -5.904  -7.847
  962   1HD   PRO 131          HD2       PRO 131  -9.882  -6.853  -8.882
  963   2HD   PRO 131          HD1       PRO 131  -9.177  -7.023  -7.260
  964    H    SER 132           HN       SER 132  -9.443  -1.408  -8.212
  965    HA   SER 132           HA       SER 132 -11.216  -1.207 -10.491
  966   1HB   SER 132          HB2       SER 132 -12.754  -1.667  -8.625
  967   2HB   SER 132          HB1       SER 132 -12.096  -0.283  -7.760
  968    HG   SER 132           HG       SER 132 -13.780   0.605  -8.732
  969    H    GLY 133           HN       GLY 133  -9.945   0.182 -11.600
  970   1HA   GLY 133          HA2       GLY 133  -9.341   2.363 -12.194
  971   2HA   GLY 133          HA1       GLY 133  -9.822   2.900 -10.599
  972    H    THR 134           HN       THR 134  -7.876   0.348 -10.035
  973    HA   THR 134           HA       THR 134  -5.699   2.206  -9.409
  974    HB   THR 134           HB       THR 134  -5.204   0.487  -7.625
  975    HG1  THR 134           HG1      THR 134  -6.486  -1.166  -8.759
  976   1HG2  THR 134          HG21      THR 134  -7.928   1.793  -7.577
  977   2HG2  THR 134          HG22      THR 134  -6.407   2.554  -7.109
  978   3HG2  THR 134          HG23      THR 134  -7.044   1.205  -6.169
  979    H    THR 135           HN       THR 135  -4.093   1.945 -10.887
  980    HA   THR 135           HA       THR 135  -2.715  -0.612 -10.548
  981    HB   THR 135           HB       THR 135  -2.633   0.875 -13.187
  982    HG1  THR 135           HG1      THR 135  -4.556  -0.793 -12.240
  983   1HG2  THR 135          HG21      THR 135  -1.589  -1.172 -14.006
  984   2HG2  THR 135          HG22      THR 135  -1.743  -1.904 -12.409
  985   3HG2  THR 135          HG23      THR 135  -0.680  -0.516 -12.644
  986    H    GLY 136           HN       GLY 136  -1.277   0.204  -9.091
  987   1HA   GLY 136          HA2       GLY 136   0.030   2.745  -9.820
  988   2HA   GLY 136          HA1       GLY 136  -0.389   2.311  -8.172
  989    H    THR 137           HN       THR 137   2.141   3.093  -9.003
  990    HA   THR 137           HA       THR 137   3.603   0.735  -8.109
  991    HB   THR 137           HB       THR 137   4.629   2.449 -10.381
  992    HG1  THR 137           HG1      THR 137   2.880   0.366 -10.407
  993   1HG2  THR 137          HG21      THR 137   5.606  -0.172  -9.232
  994   2HG2  THR 137          HG22      THR 137   6.358   1.402  -8.982
  995   3HG2  THR 137          HG23      THR 137   6.321   0.691 -10.595
  996    H    THR 138           HN       THR 138   4.125   1.538  -6.139
  997    HA   THR 138           HA       THR 138   5.097   4.233  -5.831
  998    HB   THR 138           HB       THR 138   5.179   1.940  -3.848
  999    HG1  THR 138           HG1      THR 138   3.161   3.664  -4.681
 1000   1HG2  THR 138          HG21      THR 138   5.365   3.703  -2.166
 1001   2HG2  THR 138          HG22      THR 138   5.364   4.928  -3.435
 1002   3HG2  THR 138          HG23      THR 138   6.704   3.788  -3.309
 1003    H    LYS 139           HN       LYS 139   7.040   4.705  -6.633
 1004    HA   LYS 139           HA       LYS 139   9.042   2.585  -6.748
 1005   1HB   LYS 139          HB2       LYS 139   8.501   3.969  -8.781
 1006   2HB   LYS 139          HB1       LYS 139   9.202   5.349  -7.949
 1007   1HG   LYS 139          HG2       LYS 139  10.787   4.339  -9.507
 1008   2HG   LYS 139          HG1       LYS 139  11.353   4.228  -7.842
 1009   1HD   LYS 139          HD2       LYS 139  11.733   2.145  -9.081
 1010   2HD   LYS 139          HD1       LYS 139  10.633   1.914  -7.724
 1011   1HE   LYS 139          HE2       LYS 139   9.796   0.710  -9.629
 1012   2HE   LYS 139          HE1       LYS 139   8.729   2.067  -9.287
 1013   1HZ   LYS 139          HZ1       LYS 139   9.126   1.854 -11.644
 1014   2HZ   LYS 139          HZ2       LYS 139  10.798   1.978 -11.415
 1015   3HZ   LYS 139          HZ3       LYS 139   9.799   3.303 -11.079
 1016    H    LEU 140           HN       LEU 140  10.187   2.383  -5.002
 1017    HA   LEU 140           HA       LEU 140  11.076   4.766  -3.565
 1018   1HB   LEU 140          HB2       LEU 140  10.330   3.409  -1.911
 1019   2HB   LEU 140          HB1       LEU 140  10.600   1.938  -2.822
 1020    HG   LEU 140           HG       LEU 140  13.068   2.208  -2.323
 1021   1HD1  LEU 140          HD11      LEU 140  13.675   3.649  -0.438
 1022   2HD1  LEU 140          HD12      LEU 140  12.048   4.333  -0.453
 1023   3HD1  LEU 140          HD13      LEU 140  13.118   4.568  -1.836
 1024   1HD2  LEU 140          HD21      LEU 140  12.875   1.436   0.000
 1025   2HD2  LEU 140          HD22      LEU 140  11.720   0.644  -1.073
 1026   3HD2  LEU 140          HD23      LEU 140  11.181   1.931   0.006
 1027    H    THR 141           HN       THR 141  12.820   5.580  -4.508
 1028    HA   THR 141           HA       THR 141  15.015   3.745  -5.209
 1029    HB   THR 141           HB       THR 141  14.548   6.466  -6.437
 1030    HG1  THR 141           HG1      THR 141  13.860   3.936  -7.580
 1031   1HG2  THR 141          HG21      THR 141  16.045   5.619  -8.187
 1032   2HG2  THR 141          HG22      THR 141  16.199   4.092  -7.316
 1033   3HG2  THR 141          HG23      THR 141  16.826   5.580  -6.604
 1034    H    VAL 142           HN       VAL 142  17.033   4.239  -4.434
 1035    HA   VAL 142           HA       VAL 142  17.141   6.174  -2.294
 1036    HB   VAL 142           HB       VAL 142  18.220   3.980  -2.031
 1037   1HG1  VAL 142          HG11      VAL 142  20.087   4.934  -4.201
 1038   2HG1  VAL 142          HG12      VAL 142  18.943   3.595  -4.311
 1039   3HG1  VAL 142          HG13      VAL 142  20.320   3.489  -3.214
 1040   1HG2  VAL 142          HG21      VAL 142  20.182   6.268  -1.996
 1041   2HG2  VAL 142          HG22      VAL 142  20.352   4.747  -1.118
 1042   3HG2  VAL 142          HG23      VAL 142  19.041   5.856  -0.717
 1043    H    THR 143           HN       THR 143  18.508   7.956  -2.183
 1044    HA   THR 143           HA       THR 143  20.115   8.677  -4.488
 1045    HB   THR 143           HB       THR 143  17.995  10.552  -3.399
 1046    HG1  THR 143           HG1      THR 143  17.889   8.662  -5.304
 1047   1HG2  THR 143          HG21      THR 143  20.042  11.712  -4.098
 1048   2HG2  THR 143          HG22      THR 143  18.711  12.048  -5.204
 1049   3HG2  THR 143          HG23      THR 143  19.970  10.900  -5.661
  Start of MODEL    5
    1    H    GLU   1           H        GLU   1 -22.223   8.539 -10.406
    2    HA   GLU   1           HA       GLU   1 -23.340   6.445 -10.001
    3   1HB   GLU   1          HB2       GLU   1 -23.254   5.588 -12.321
    4   2HB   GLU   1          HB1       GLU   1 -23.382   7.339 -12.253
    5   1HG   GLU   1          HG2       GLU   1 -21.058   7.591 -12.775
    6   2HG   GLU   1          HG1       GLU   1 -20.801   5.852 -12.661
    7    H    GLU   2           HN       GLU   2 -19.877   6.178 -10.352
    8    HA   GLU   2           HA       GLU   2 -20.069   3.284  -9.855
    9   1HB   GLU   2          HB2       GLU   2 -19.658   3.671 -12.237
   10   2HB   GLU   2          HB1       GLU   2 -18.274   4.678 -11.847
   11   1HG   GLU   2          HG2       GLU   2 -17.070   2.793 -10.997
   12   2HG   GLU   2          HG1       GLU   2 -18.486   1.756 -11.176
   13    H    CYS   3           HN       CYS   3 -18.571   2.446  -8.480
   14    HA   CYS   3           HA       CYS   3 -17.051   4.316  -6.887
   15   1HB   CYS   3          HB2       CYS   3 -18.214   2.466  -5.776
   16   2HB   CYS   3          HB1       CYS   3 -17.312   1.303  -6.738
   17    H    GLN   4           HN       GLN   4 -15.362   5.088  -8.038
   18    HA   GLN   4           HA       GLN   4 -13.444   3.121  -9.102
   19   1HB   GLN   4          HB2       GLN   4 -13.943   5.986  -9.905
   20   2HB   GLN   4          HB1       GLN   4 -12.569   5.046 -10.465
   21   1HG   GLN   4          HG2       GLN   4 -14.188   3.409 -11.424
   22   2HG   GLN   4          HG1       GLN   4 -15.478   4.539 -11.008
   23   1HE2  GLN   4          HE21      GLN   4 -15.644   6.481 -12.133
   24   2HE2  GLN   4          HE22      GLN   4 -14.824   6.757 -13.634
   25    H    VAL   5           HN       VAL   5 -11.460   3.063  -8.188
   26    HA   VAL   5           HA       VAL   5 -11.010   5.042  -6.052
   27    HB   VAL   5           HB       VAL   5  -9.791   2.284  -6.291
   28   1HG1  VAL   5          HG11      VAL   5  -8.441   3.841  -5.002
   29   2HG1  VAL   5          HG12      VAL   5  -9.166   2.625  -3.947
   30   3HG1  VAL   5          HG13      VAL   5  -9.839   4.254  -4.010
   31   1HG2  VAL   5          HG21      VAL   5 -12.127   3.212  -4.624
   32   2HG2  VAL   5          HG22      VAL   5 -11.337   1.642  -4.477
   33   3HG2  VAL   5          HG23      VAL   5 -12.181   2.069  -5.966
   34    H    ARG   6           HN       ARG   6  -9.613   6.563  -6.651
   35    HA   ARG   6           HA       ARG   6  -7.772   6.023  -8.812
   36   1HB   ARG   6          HB2       ARG   6  -8.209   8.553  -7.229
   37   2HB   ARG   6          HB1       ARG   6  -7.214   8.406  -8.672
   38   1HG   ARG   6          HG2       ARG   6  -9.284   7.665  -9.891
   39   2HG   ARG   6          HG1       ARG   6 -10.197   8.130  -8.453
   40   1HD   ARG   6          HD2       ARG   6 -10.230   9.946 -10.029
   41   2HD   ARG   6          HD1       ARG   6  -9.248  10.403  -8.637
   42    HE   ARG   6           HE       ARG   6  -7.443   9.380 -10.405
   43   1HH1  ARG   6          HH11      ARG   6  -9.848  11.920 -10.537
   44   2HH1  ARG   6          HH12      ARG   6  -9.016  12.825 -11.769
   45   1HH2  ARG   6          HH21      ARG   6  -6.336  10.557 -12.002
   46   2HH2  ARG   6          HH22      ARG   6  -7.003  12.045 -12.605
   47    H    VAL   7           HN       VAL   7  -6.324   4.596  -7.947
   48    HA   VAL   7           HA       VAL   7  -4.507   5.685  -5.917
   49    HB   VAL   7           HB       VAL   7  -4.715   2.883  -7.070
   50   1HG1  VAL   7          HG11      VAL   7  -2.380   3.459  -6.584
   51   2HG1  VAL   7          HG12      VAL   7  -2.991   2.259  -5.444
   52   3HG1  VAL   7          HG13      VAL   7  -2.835   3.945  -4.952
   53   1HG2  VAL   7          HG21      VAL   7  -5.285   3.958  -4.306
   54   2HG2  VAL   7          HG22      VAL   7  -5.366   2.263  -4.791
   55   3HG2  VAL   7          HG23      VAL   7  -6.484   3.435  -5.490
   56    H    GLY   8           HN       GLY   8  -2.808   6.767  -6.676
   57   1HA   GLY   8          HA2       GLY   8  -2.142   6.457  -9.512
   58   2HA   GLY   8          HA1       GLY   8  -1.749   7.843  -8.506
   59    H    ASP   9           HN       ASP   9   0.160   6.869 -10.092
   60    HA   ASP   9           HA       ASP   9   1.821   5.018  -8.595
   61   1HB   ASP   9          HB2       ASP   9   3.337   5.149 -10.509
   62   2HB   ASP   9          HB1       ASP   9   1.692   4.827 -11.049
   63    H    LEU  10           HN       LEU  10   3.979   5.533  -7.974
   64    HA   LEU  10           HA       LEU  10   4.474   8.385  -7.454
   65   1HB   LEU  10          HB2       LEU  10   4.656   6.147  -5.433
   66   2HB   LEU  10          HB1       LEU  10   5.181   7.795  -5.156
   67    HG   LEU  10           HG       LEU  10   2.326   6.983  -5.711
   68   1HD1  LEU  10          HD11      LEU  10   3.680   7.684  -3.110
   69   2HD1  LEU  10          HD12      LEU  10   3.115   6.082  -3.585
   70   3HD1  LEU  10          HD13      LEU  10   1.955   7.387  -3.333
   71   1HD2  LEU  10          HD21      LEU  10   3.528   9.590  -4.784
   72   2HD2  LEU  10          HD22      LEU  10   1.804   9.245  -4.934
   73   3HD2  LEU  10          HD23      LEU  10   2.826   9.274  -6.372
   74    H    THR  11           HN       THR  11   6.640   8.952  -7.504
   75    HA   THR  11           HA       THR  11   8.597   6.764  -7.455
   76    HB   THR  11           HB       THR  11   8.803   9.141  -9.316
   77    HG1  THR  11           HG1      THR  11   7.283   7.015  -9.582
   78   1HG2  THR  11          HG21      THR  11  10.415   6.593  -9.112
   79   2HG2  THR  11          HG22      THR  11  10.957   8.198  -8.623
   80   3HG2  THR  11          HG23      THR  11  10.637   7.855 -10.323
   81    H    VAL  12           HN       VAL  12   9.898   7.061  -5.764
   82    HA   VAL  12           HA       VAL  12  10.544   9.824  -4.965
   83    HB   VAL  12           HB       VAL  12   9.956   7.620  -2.985
   84   1HG1  VAL  12          HG11      VAL  12   9.939   9.438  -1.357
   85   2HG1  VAL  12          HG12      VAL  12  10.318  10.590  -2.638
   86   3HG1  VAL  12          HG13      VAL  12  11.486   9.343  -2.199
   87   1HG2  VAL  12          HG21      VAL  12   8.172   9.904  -3.821
   88   2HG2  VAL  12          HG22      VAL  12   7.854   8.777  -2.503
   89   3HG2  VAL  12          HG23      VAL  12   7.903   8.197  -4.168
   90    H    ALA  13           HN       ALA  13  12.655  10.172  -4.641
   91    HA   ALA  13           HA       ALA  13  14.444   7.846  -4.559
   92   1HB   ALA  13          HB1       ALA  13  16.225   9.393  -5.158
   93   2HB   ALA  13          HB2       ALA  13  15.102  10.749  -5.056
   94   3HB   ALA  13          HB3       ALA  13  14.886   9.515  -6.298
   95    H    LYS  14           HN       LYS  14  14.569   7.189  -2.465
   96    HA   LYS  14           HA       LYS  14  16.040   8.776  -0.614
   97   1HB   LYS  14          HB2       LYS  14  13.484   9.513  -0.501
   98   2HB   LYS  14          HB1       LYS  14  13.335   8.053   0.464
   99   1HG   LYS  14          HG2       LYS  14  13.624   9.876   1.951
  100   2HG   LYS  14          HG1       LYS  14  15.122   8.944   1.956
  101   1HD   LYS  14          HD2       LYS  14  15.618  11.318   1.897
  102   2HD   LYS  14          HD1       LYS  14  16.109  10.559   0.382
  103   1HE   LYS  14          HE2       LYS  14  14.039  11.355  -0.674
  104   2HE   LYS  14          HE1       LYS  14  13.568  12.122   0.842
  105   1HZ   LYS  14          HZ1       LYS  14  14.569  13.681  -0.728
  106   2HZ   LYS  14          HZ2       LYS  14  16.009  12.798  -0.720
  107   3HZ   LYS  14          HZ3       LYS  14  15.475  13.566   0.698
  108    H    THR  15           HN       THR  15  16.232   7.615   1.521
  109    HA   THR  15           HA       THR  15  16.709   4.808   0.981
  110    HB   THR  15           HB       THR  15  17.917   4.823   3.112
  111    HG1  THR  15           HG1      THR  15  18.045   7.038   4.138
  112   1HG2  THR  15          HG21      THR  15  18.536   7.280   1.458
  113   2HG2  THR  15          HG22      THR  15  19.091   5.644   1.114
  114   3HG2  THR  15          HG23      THR  15  19.644   6.473   2.566
  115    H    ARG  16           HN       ARG  16  16.189   3.203   2.749
  116    HA   ARG  16           HA       ARG  16  13.466   3.622   3.715
  117   1HB   ARG  16          HB2       ARG  16  15.181   1.147   4.051
  118   2HB   ARG  16          HB1       ARG  16  13.455   1.286   4.386
  119   1HG   ARG  16          HG2       ARG  16  13.448   0.222   2.356
  120   2HG   ARG  16          HG1       ARG  16  13.299   1.909   1.861
  121   1HD   ARG  16          HD2       ARG  16  15.838   1.894   1.661
  122   2HD   ARG  16          HD1       ARG  16  15.729   0.142   1.780
  123    HE   ARG  16           HE       ARG  16  14.956   0.078  -0.374
  124   1HH1  ARG  16          HH11      ARG  16  14.673   3.326   0.854
  125   2HH1  ARG  16          HH12      ARG  16  14.406   4.050  -0.697
  126   1HH2  ARG  16          HH21      ARG  16  14.571   1.016  -2.447
  127   2HH2  ARG  16          HH22      ARG  16  14.306   2.720  -2.576
  128    H    GLY  17           HN       GLY  17  16.665   3.962   4.724
  129   1HA   GLY  17          HA2       GLY  17  16.358   3.667   7.524
  130   2HA   GLY  17          HA1       GLY  17  17.582   4.642   6.718
  131    H    GLN  18           HN       GLN  18  15.647   6.257   5.280
  132    HA   GLN  18           HA       GLN  18  15.047   8.274   7.139
  133   1HB   GLN  18          HB2       GLN  18  15.262   8.682   4.714
  134   2HB   GLN  18          HB1       GLN  18  13.786   7.766   4.436
  135   1HG   GLN  18          HG2       GLN  18  13.367  10.150   4.349
  136   2HG   GLN  18          HG1       GLN  18  12.513   9.410   5.702
  137   1HE2  GLN  18          HE21      GLN  18  13.203   9.855   7.808
  138   2HE2  GLN  18          HE22      GLN  18  14.247  11.188   8.180
  139    H    LEU  19           HN       LEU  19  13.224   5.566   5.880
  140    HA   LEU  19           HA       LEU  19  10.739   6.146   7.075
  141   1HB   LEU  19          HB2       LEU  19  12.006   3.515   6.301
  142   2HB   LEU  19          HB1       LEU  19  10.354   3.672   6.872
  143    HG   LEU  19           HG       LEU  19  11.309   5.150   4.430
  144   1HD1  LEU  19          HD11      LEU  19  10.372   3.312   3.097
  145   2HD1  LEU  19          HD12      LEU  19  10.110   2.382   4.574
  146   3HD1  LEU  19          HD13      LEU  19  11.750   2.781   4.062
  147   1HD2  LEU  19          HD21      LEU  19   8.921   5.118   3.896
  148   2HD2  LEU  19          HD22      LEU  19   9.219   5.893   5.452
  149   3HD2  LEU  19          HD23      LEU  19   8.594   4.243   5.393
  150    H    THR  20           HN       THR  20  10.961   6.769   9.177
  151    HA   THR  20           HA       THR  20  12.230   4.936  11.064
  152    HB   THR  20           HB       THR  20  11.051   7.638  11.708
  153    HG1  THR  20           HG1      THR  20  12.844   7.410   9.950
  154   1HG2  THR  20          HG21      THR  20  12.705   7.586  13.526
  155   2HG2  THR  20          HG22      THR  20  13.248   6.000  12.983
  156   3HG2  THR  20          HG23      THR  20  11.613   6.203  13.610
  157    H    ASP  21           HN       ASP  21  10.514   3.402  10.660
  158    HA   ASP  21           HA       ASP  21   8.498   2.401  10.825
  159   1HB   ASP  21          HB2       ASP  21   8.950   2.556  13.243
  160   2HB   ASP  21          HB1       ASP  21   8.172   4.137  13.288
  161    H    ALA  22           HN       ALA  22   7.062   5.199  12.338
  162    HA   ALA  22           HA       ALA  22   5.285   5.482  10.074
  163   1HB   ALA  22          HB1       ALA  22   4.055   7.054  11.465
  164   2HB   ALA  22          HB2       ALA  22   5.329   6.993  12.683
  165   3HB   ALA  22          HB3       ALA  22   4.368   5.553  12.337
  166    H    ALA  23           HN       ALA  23   7.033   6.160   8.642
  167    HA   ALA  23           HA       ALA  23   7.243   9.089   8.691
  168   1HB   ALA  23          HB1       ALA  23   9.426   8.150   9.303
  169   2HB   ALA  23          HB2       ALA  23   9.485   8.965   7.739
  170   3HB   ALA  23          HB3       ALA  23   9.431   7.204   7.815
  171    HA   PRO  24           HA       PRO  24   5.168   7.835   4.858
  172   1HB   PRO  24          HB2       PRO  24   3.865  10.185   4.477
  173   2HB   PRO  24          HB1       PRO  24   3.285   8.932   5.576
  174   1HG   PRO  24          HG2       PRO  24   4.765  11.455   6.181
  175   2HG   PRO  24          HG1       PRO  24   3.427  10.696   7.064
  176   1HD   PRO  24          HD2       PRO  24   6.048  10.496   7.829
  177   2HD   PRO  24          HD1       PRO  24   4.826   9.268   8.195
  178    H    ILE  25           HN       ILE  25   7.007   7.731   3.565
  179    HA   ILE  25           HA       ILE  25   8.216  10.210   2.643
  180    HB   ILE  25           HB       ILE  25   8.808   7.383   1.751
  181   1HG1  ILE  25          HG12      ILE  25   9.988   9.116   3.919
  182   2HG1  ILE  25          HG11      ILE  25   9.200   7.551   4.111
  183   1HG2  ILE  25          HG21      ILE  25   9.565   9.069   0.161
  184   2HG2  ILE  25          HG22      ILE  25  10.942   8.337   0.990
  185   3HG2  ILE  25          HG23      ILE  25  10.382   9.945   1.458
  186   1HD1  ILE  25          HD11      ILE  25  11.043   6.480   2.919
  187   2HD1  ILE  25          HD12      ILE  25  11.611   7.356   4.340
  188   3HD1  ILE  25          HD13      ILE  25  11.834   8.046   2.732
  189    H    GLY  26           HN       GLY  26   5.980   7.798   1.508
  190   1HA   GLY  26          HA2       GLY  26   5.521   9.497  -0.853
  191   2HA   GLY  26          HA1       GLY  26   5.533   7.745  -0.981
  192    HA   PRO  27           HA       PRO  27   1.451   8.839   1.520
  193   1HB   PRO  27          HB2       PRO  27   0.884  11.553   1.387
  194   2HB   PRO  27          HB1       PRO  27   1.508  10.717   2.813
  195   1HG   PRO  27          HG2       PRO  27   2.968  12.321   0.756
  196   2HG   PRO  27          HG1       PRO  27   3.222  12.248   2.509
  197   1HD   PRO  27          HD2       PRO  27   4.857  10.963   0.815
  198   2HD   PRO  27          HD1       PRO  27   4.402  10.254   2.379
  199    H    VAL  28           HN       VAL  28   0.379   7.944  -0.155
  200    HA   VAL  28           HA       VAL  28   0.120   9.416  -2.657
  201    HB   VAL  28           HB       VAL  28   0.703   7.072  -2.870
  202   1HG1  VAL  28          HG11      VAL  28  -0.233   6.188  -0.829
  203   2HG1  VAL  28          HG12      VAL  28  -0.855   5.288  -2.213
  204   3HG1  VAL  28          HG13      VAL  28  -1.869   6.490  -1.415
  205   1HG2  VAL  28          HG21      VAL  28  -0.660   8.035  -4.629
  206   2HG2  VAL  28          HG22      VAL  28  -2.129   7.592  -3.760
  207   3HG2  VAL  28          HG23      VAL  28  -1.067   6.335  -4.396
  208    H    THR  29           HN       THR  29  -1.659  10.475  -3.234
  209    HA   THR  29           HA       THR  29  -3.877  10.611  -1.428
  210    HB   THR  29           HB       THR  29  -3.526  12.005  -4.082
  211    HG1  THR  29           HG1      THR  29  -2.626  13.714  -2.696
  212   1HG2  THR  29          HG21      THR  29  -4.946  13.704  -3.036
  213   2HG2  THR  29          HG22      THR  29  -5.060  12.703  -1.589
  214   3HG2  THR  29          HG23      THR  29  -5.750  12.135  -3.108
  215    H    VAL  30           HN       VAL  30  -5.066   8.764  -1.574
  216    HA   VAL  30           HA       VAL  30  -5.895   7.759  -4.178
  217    HB   VAL  30           HB       VAL  30  -6.356   6.768  -1.360
  218   1HG1  VAL  30          HG11      VAL  30  -7.459   4.814  -2.351
  219   2HG1  VAL  30          HG12      VAL  30  -7.367   5.567  -3.944
  220   3HG1  VAL  30          HG13      VAL  30  -8.356   6.296  -2.679
  221   1HG2  VAL  30          HG21      VAL  30  -4.821   5.655  -3.717
  222   2HG2  VAL  30          HG22      VAL  30  -5.027   4.843  -2.166
  223   3HG2  VAL  30          HG23      VAL  30  -4.129   6.360  -2.256
  224    H    GLN  31           HN       GLN  31  -7.593   8.602  -5.120
  225    HA   GLN  31           HA       GLN  31  -9.620   9.953  -3.481
  226   1HB   GLN  31          HB2       GLN  31  -8.249  11.115  -5.354
  227   2HB   GLN  31          HB1       GLN  31  -9.304  10.246  -6.458
  228   1HG   GLN  31          HG2       GLN  31 -10.338  12.060  -4.301
  229   2HG   GLN  31          HG1       GLN  31  -9.926  12.628  -5.917
  230   1HE2  GLN  31          HE21      GLN  31 -11.172  11.965  -7.671
  231   2HE2  GLN  31          HE22      GLN  31 -12.770  11.332  -7.454
  232    H    ALA  32           HN       ALA  32 -11.313   8.690  -3.077
  233    HA   ALA  32           HA       ALA  32 -12.028   6.558  -4.928
  234   1HB   ALA  32          HB1       ALA  32 -11.840   6.039  -2.534
  235   2HB   ALA  32          HB2       ALA  32 -13.466   5.737  -3.149
  236   3HB   ALA  32          HB3       ALA  32 -13.140   7.183  -2.193
  237    H    LEU  33           HN       LEU  33 -13.233   7.203  -6.563
  238    HA   LEU  33           HA       LEU  33 -15.098   9.387  -6.394
  239   1HB   LEU  33          HB2       LEU  33 -13.794   8.894  -8.443
  240   2HB   LEU  33          HB1       LEU  33 -14.629   7.362  -8.589
  241    HG   LEU  33           HG       LEU  33 -16.774   8.625  -8.829
  242   1HD1  LEU  33          HD11      LEU  33 -16.079  10.703  -7.760
  243   2HD1  LEU  33          HD12      LEU  33 -16.666  10.994  -9.398
  244   3HD1  LEU  33          HD13      LEU  33 -14.933  11.003  -9.066
  245   1HD2  LEU  33          HD21      LEU  33 -15.586   7.734 -10.762
  246   2HD2  LEU  33          HD22      LEU  33 -14.633   9.216 -10.868
  247   3HD2  LEU  33          HD23      LEU  33 -16.374   9.264 -11.148
  248    H    GLY  34           HN       GLY  34 -17.099   9.212  -5.660
  249   1HA   GLY  34          HA2       GLY  34 -19.212   8.369  -5.317
  250   2HA   GLY  34          HA1       GLY  34 -18.830   7.091  -6.457
  251    H    CYS  35           HN       CYS  35 -18.942   5.157  -5.643
  252    HA   CYS  35           HA       CYS  35 -18.811   3.364  -4.278
  253   1HB   CYS  35          HB2       CYS  35 -17.123   5.100  -2.460
  254   2HB   CYS  35          HB1       CYS  35 -17.247   3.344  -2.410
  255    H    ASN  36           HN       ASN  36 -19.039   6.217  -2.142
  256    HA   ASN  36           HA       ASN  36 -20.698   7.017  -0.844
  257   1HB   ASN  36          HB2       ASN  36 -22.350   4.981  -2.321
  258   2HB   ASN  36          HB1       ASN  36 -23.027   6.126  -1.168
  259   1HD2  ASN  36          HD21      ASN  36 -23.534   5.827  -4.018
  260   2HD2  ASN  36          HD22      ASN  36 -23.156   7.354  -4.736
  261    H    ALA  37           HN       ALA  37 -20.802   3.463  -0.900
  262    HA   ALA  37           HA       ALA  37 -20.501   3.402   1.976
  263   1HB   ALA  37          HB1       ALA  37 -22.927   2.150   0.675
  264   2HB   ALA  37          HB2       ALA  37 -22.937   3.548   1.752
  265   3HB   ALA  37          HB3       ALA  37 -22.450   1.967   2.363
  266    H    ARG  38           HN       ARG  38 -18.499   2.552   1.162
  267    HA   ARG  38           HA       ARG  38 -18.575  -0.317   0.799
  268   1HB   ARG  38          HB2       ARG  38 -18.827   0.879  -1.479
  269   2HB   ARG  38          HB1       ARG  38 -17.144   1.335  -1.267
  270   1HG   ARG  38          HG2       ARG  38 -17.510  -0.664  -2.690
  271   2HG   ARG  38          HG1       ARG  38 -16.440  -0.929  -1.316
  272   1HD   ARG  38          HD2       ARG  38 -18.114  -2.756  -1.756
  273   2HD   ARG  38          HD1       ARG  38 -18.110  -2.107  -0.119
  274    HE   ARG  38           HE       ARG  38 -20.130  -0.869  -0.704
  275   1HH1  ARG  38          HH11      ARG  38 -19.185  -3.434  -2.890
  276   2HH1  ARG  38          HH12      ARG  38 -20.802  -3.780  -3.406
  277   1HH2  ARG  38          HH21      ARG  38 -22.274  -1.325  -1.352
  278   2HH2  ARG  38          HH22      ARG  38 -22.566  -2.555  -2.552
  279    H    GLN  39           HN       GLN  39 -16.635  -1.310   1.372
  280    HA   GLN  39           HA       GLN  39 -14.726   0.313   2.815
  281   1HB   GLN  39          HB2       GLN  39 -14.933  -2.663   2.316
  282   2HB   GLN  39          HB1       GLN  39 -13.671  -1.922   3.292
  283   1HG   GLN  39          HG2       GLN  39 -15.150  -1.300   4.966
  284   2HG   GLN  39          HG1       GLN  39 -16.555  -1.448   3.915
  285   1HE2  GLN  39          HE21      GLN  39 -17.604  -2.750   5.400
  286   2HE2  GLN  39          HE22      GLN  39 -17.171  -4.404   5.654
  287    H    VAL  40           HN       VAL  40 -13.096   1.289   1.790
  288    HA   VAL  40           HA       VAL  40 -12.095   0.305  -0.743
  289    HB   VAL  40           HB       VAL  40 -11.118   2.621   0.943
  290   1HG1  VAL  40          HG11      VAL  40 -10.547   1.896  -1.929
  291   2HG1  VAL  40          HG12      VAL  40  -9.405   1.823  -0.585
  292   3HG1  VAL  40          HG13      VAL  40 -10.033   3.381  -1.128
  293   1HG2  VAL  40          HG21      VAL  40 -12.969   2.604  -1.442
  294   2HG2  VAL  40          HG22      VAL  40 -12.349   4.041  -0.631
  295   3HG2  VAL  40          HG23      VAL  40 -13.432   2.945   0.227
  296    H    ALA  41           HN       ALA  41 -10.361  -1.002  -0.968
  297    HA   ALA  41           HA       ALA  41  -8.727  -1.556   1.392
  298   1HB   ALA  41          HB1       ALA  41 -10.433  -3.307   1.016
  299   2HB   ALA  41          HB2       ALA  41  -8.786  -3.914   0.811
  300   3HB   ALA  41          HB3       ALA  41  -9.785  -3.559  -0.604
  301    H    LEU  42           HN       LEU  42  -6.575  -1.768   1.020
  302    HA   LEU  42           HA       LEU  42  -5.651  -1.316  -1.730
  303   1HB   LEU  42          HB2       LEU  42  -3.943  -1.214   0.744
  304   2HB   LEU  42          HB1       LEU  42  -3.660  -0.452  -0.813
  305    HG   LEU  42           HG       LEU  42  -5.827   0.338   1.127
  306   1HD1  LEU  42          HD11      LEU  42  -3.169   1.629   0.526
  307   2HD1  LEU  42          HD12      LEU  42  -3.641   0.850   2.036
  308   3HD1  LEU  42          HD13      LEU  42  -4.443   2.332   1.520
  309   1HD2  LEU  42          HD21      LEU  42  -4.848   1.687  -1.390
  310   2HD2  LEU  42          HD22      LEU  42  -6.104   2.287  -0.307
  311   3HD2  LEU  42          HD23      LEU  42  -6.366   0.805  -1.226
  312    H    LYS  43           HN       LYS  43  -4.654  -2.888  -2.821
  313    HA   LYS  43           HA       LYS  43  -3.592  -5.177  -1.307
  314   1HB   LYS  43          HB2       LYS  43  -5.022  -5.150  -3.966
  315   2HB   LYS  43          HB1       LYS  43  -4.012  -6.495  -3.466
  316   1HG   LYS  43          HG2       LYS  43  -6.250  -7.072  -2.959
  317   2HG   LYS  43          HG1       LYS  43  -5.451  -6.701  -1.433
  318   1HD   LYS  43          HD2       LYS  43  -6.422  -4.280  -2.024
  319   2HD   LYS  43          HD1       LYS  43  -7.624  -5.284  -2.842
  320   1HE   LYS  43          HE2       LYS  43  -6.795  -5.436   0.046
  321   2HE   LYS  43          HE1       LYS  43  -8.332  -4.839  -0.581
  322   1HZ   LYS  43          HZ1       LYS  43  -7.315  -7.618  -0.782
  323   2HZ   LYS  43          HZ2       LYS  43  -8.765  -7.065  -1.456
  324   3HZ   LYS  43          HZ3       LYS  43  -8.565  -7.080   0.223
  325    H    ALA  44           HN       ALA  44  -1.692  -6.114  -2.129
  326    HA   ALA  44           HA       ALA  44  -0.110  -4.197  -3.664
  327   1HB   ALA  44          HB1       ALA  44   0.818  -4.738  -1.523
  328   2HB   ALA  44          HB2       ALA  44   1.835  -5.450  -2.777
  329   3HB   ALA  44          HB3       ALA  44   0.714  -6.462  -1.867
  330    H    ASP  45           HN       ASP  45   1.246  -4.901  -5.325
  331    HA   ASP  45           HA       ASP  45   0.064  -6.875  -7.032
  332   1HB   ASP  45          HB2       ASP  45   1.054  -4.787  -7.912
  333   2HB   ASP  45          HB1       ASP  45   2.633  -5.298  -7.324
  334    H    THR  46           HN       THR  46   1.093  -8.775  -7.817
  335    HA   THR  46           HA       THR  46   2.029 -10.376  -5.743
  336    HB   THR  46           HB       THR  46   0.846 -11.263  -7.687
  337    HG1  THR  46           HG1      THR  46   3.366 -12.299  -6.952
  338   1HG2  THR  46          HG21      THR  46   1.889  -9.924  -9.445
  339   2HG2  THR  46          HG22      THR  46   2.030 -11.646  -9.802
  340   3HG2  THR  46          HG23      THR  46   3.422 -10.757  -9.183
  341    H    ASP  47           HN       ASP  47   3.870  -8.267  -7.766
  342    HA   ASP  47           HA       ASP  47   6.359  -9.642  -7.571
  343   1HB   ASP  47          HB2       ASP  47   5.904  -7.841  -9.234
  344   2HB   ASP  47          HB1       ASP  47   5.896  -6.668  -7.920
  345    H    ASN  48           HN       ASN  48   4.605  -7.462  -5.495
  346    HA   ASN  48           HA       ASN  48   6.754  -7.675  -3.493
  347   1HB   ASN  48          HB2       ASN  48   6.145  -5.435  -2.674
  348   2HB   ASN  48          HB1       ASN  48   6.647  -5.361  -4.358
  349   1HD2  ASN  48          HD21      ASN  48   4.107  -4.885  -2.116
  350   2HD2  ASN  48          HD22      ASN  48   2.954  -4.233  -3.225
  351    H    PHE  49           HN       PHE  49   4.224  -9.188  -4.108
  352    HA   PHE  49           HA       PHE  49   3.073  -9.158  -1.404
  353   1HB   PHE  49          HB2       PHE  49   1.606  -7.820  -2.874
  354   2HB   PHE  49          HB1       PHE  49   1.489  -9.171  -3.977
  355    HD1  PHE  49           HD1      PHE  49   0.368  -7.791  -0.773
  356    HD2  PHE  49           HD2      PHE  49   0.069 -11.052  -3.500
  357    HE1  PHE  49           HE1      PHE  49  -1.703  -8.520   0.318
  358    HE2  PHE  49           HE2      PHE  49  -1.996 -11.794  -2.387
  359    HZ   PHE  49           HZ       PHE  49  -2.888 -10.515  -0.476
  360    H    GLU  50           HN       GLU  50   3.703 -11.140  -0.732
  361    HA   GLU  50           HA       GLU  50   3.333 -13.392  -2.585
  362   1HB   GLU  50          HB2       GLU  50   5.050 -13.188  -0.107
  363   2HB   GLU  50          HB1       GLU  50   4.866 -14.637  -1.085
  364   1HG   GLU  50          HG2       GLU  50   5.759 -13.340  -3.024
  365   2HG   GLU  50          HG1       GLU  50   6.116 -12.030  -1.899
  366    H    GLN  51           HN       GLN  51   1.395 -14.236  -2.320
  367    HA   GLN  51           HA       GLN  51  -0.284 -15.456  -1.415
  368   1HB   GLN  51          HB2       GLN  51   1.413 -16.685  -0.151
  369   2HB   GLN  51          HB1       GLN  51   1.376 -15.457   1.108
  370   1HG   GLN  51          HG2       GLN  51  -0.858 -16.034   1.707
  371   2HG   GLN  51          HG1       GLN  51  -1.006 -17.110   0.321
  372   1HE2  GLN  51          HE21      GLN  51   0.391 -16.674   3.478
  373   2HE2  GLN  51          HE22      GLN  51   0.820 -18.339   3.731
  374    H    GLY  52           HN       GLY  52   0.884 -13.089   0.985
  375   1HA   GLY  52          HA2       GLY  52  -1.416 -11.496   0.883
  376   2HA   GLY  52          HA1       GLY  52  -1.621 -12.652   2.193
  377    H    LYS  53           HN       LYS  53   1.502 -11.385   1.270
  378    HA   LYS  53           HA       LYS  53   1.424  -9.432   3.457
  379   1HB   LYS  53          HB2       LYS  53   3.755 -11.253   2.840
  380   2HB   LYS  53          HB1       LYS  53   3.723 -10.007   4.074
  381   1HG   LYS  53          HG2       LYS  53   1.945 -12.438   4.076
  382   2HG   LYS  53          HG1       LYS  53   3.467 -12.309   4.957
  383   1HD   LYS  53          HD2       LYS  53   2.566 -10.420   6.232
  384   2HD   LYS  53          HD1       LYS  53   1.050 -10.539   5.339
  385   1HE   LYS  53          HE2       LYS  53   0.686 -12.776   6.230
  386   2HE   LYS  53          HE1       LYS  53   2.221 -12.699   7.091
  387   1HZ   LYS  53          HZ1       LYS  53   1.363 -10.866   8.405
  388   2HZ   LYS  53          HZ2       LYS  53   0.348 -12.216   8.543
  389   3HZ   LYS  53          HZ3       LYS  53  -0.109 -10.914   7.565
  390    H    PHE  54           HN       PHE  54   2.268  -7.479   2.852
  391    HA   PHE  54           HA       PHE  54   3.624  -7.443   0.260
  392   1HB   PHE  54          HB2       PHE  54   2.873  -5.023   0.131
  393   2HB   PHE  54          HB1       PHE  54   1.653  -6.267  -0.059
  394    HD1  PHE  54           HD1      PHE  54  -0.287  -5.182   0.506
  395    HD2  PHE  54           HD2      PHE  54   3.052  -4.921   3.127
  396    HE1  PHE  54           HE1      PHE  54  -1.701  -4.069   2.183
  397    HE2  PHE  54           HE2      PHE  54   1.642  -3.816   4.814
  398    HZ   PHE  54           HZ       PHE  54  -0.737  -3.388   4.342
  399    H    PHE  55           HN       PHE  55   5.329  -6.087  -0.121
  400    HA   PHE  55           HA       PHE  55   6.629  -4.702   2.054
  401   1HB   PHE  55          HB2       PHE  55   8.752  -6.096   1.690
  402   2HB   PHE  55          HB1       PHE  55   7.464  -6.846   2.626
  403    HD1  PHE  55           HD1      PHE  55   8.903  -6.682  -0.806
  404    HD2  PHE  55           HD2      PHE  55   6.609  -8.915   2.004
  405    HE1  PHE  55           HE1      PHE  55   8.905  -8.607  -2.336
  406    HE2  PHE  55           HE2      PHE  55   6.609 -10.842   0.474
  407    HZ   PHE  55           HZ       PHE  55   7.758 -10.688  -1.702
  408    H    LEU  56           HN       LEU  56   8.759  -3.796   1.278
  409    HA   LEU  56           HA       LEU  56   8.579  -2.875  -1.462
  410   1HB   LEU  56          HB2       LEU  56  10.948  -2.426   0.332
  411   2HB   LEU  56          HB1       LEU  56  10.315  -1.390  -0.926
  412    HG   LEU  56           HG       LEU  56   8.976  -1.849   1.739
  413   1HD1  LEU  56          HD11      LEU  56  10.638   0.468   0.761
  414   2HD1  LEU  56          HD12      LEU  56  11.097  -0.689   2.010
  415   3HD1  LEU  56          HD13      LEU  56   9.744   0.410   2.280
  416   1HD2  LEU  56          HD21      LEU  56   8.419   0.113  -0.482
  417   2HD2  LEU  56          HD22      LEU  56   7.628   0.097   1.093
  418   3HD2  LEU  56          HD23      LEU  56   7.407  -1.254  -0.016
  419    H    ILE  57           HN       ILE  57   9.360  -4.148  -3.091
  420    HA   ILE  57           HA       ILE  57  11.539  -5.990  -2.380
  421    HB   ILE  57           HB       ILE  57   9.568  -7.173  -3.139
  422   1HG1  ILE  57          HG12      ILE  57  10.569  -8.458  -5.005
  423   2HG1  ILE  57          HG11      ILE  57  11.786  -7.199  -5.193
  424   1HG2  ILE  57          HG21      ILE  57   8.715  -6.947  -5.423
  425   2HG2  ILE  57          HG22      ILE  57   9.814  -5.593  -5.687
  426   3HG2  ILE  57          HG23      ILE  57   8.526  -5.462  -4.490
  427   1HD1  ILE  57          HD11      ILE  57  11.391  -8.930  -2.762
  428   2HD1  ILE  57          HD12      ILE  57  12.602  -7.659  -2.935
  429   3HD1  ILE  57          HD13      ILE  57  12.671  -9.090  -3.965
  430    H    SER  58           HN       SER  58  13.446  -5.426  -2.996
  431    HA   SER  58           HA       SER  58  14.063  -3.316  -4.738
  432   1HB   SER  58          HB2       SER  58  16.393  -4.305  -4.612
  433   2HB   SER  58          HB1       SER  58  15.634  -3.982  -3.049
  434    HG   SER  58           HG       SER  58  15.061  -6.470  -4.025
  435    H    ASP  59           HN       ASP  59  14.984  -3.298  -6.812
  436    HA   ASP  59           HA       ASP  59  13.967  -5.195  -8.670
  437   1HB   ASP  59          HB2       ASP  59  15.061  -3.899 -10.356
  438   2HB   ASP  59          HB1       ASP  59  14.479  -2.761  -9.146
  439    H    ASN  60           HN       ASN  60  16.894  -4.941  -6.870
  440    HA   ASN  60           HA       ASN  60  18.225  -7.030  -8.410
  441   1HB   ASN  60          HB2       ASN  60  19.067  -5.319  -6.074
  442   2HB   ASN  60          HB1       ASN  60  20.020  -6.697  -6.606
  443   1HD2  ASN  60          HD21      ASN  60  18.907  -3.498  -7.413
  444   2HD2  ASN  60          HD22      ASN  60  20.033  -3.223  -8.692
  445    H    ASN  61           HN       ASN  61  15.745  -7.320  -6.673
  446    HA   ASN  61           HA       ASN  61  15.013  -8.378  -4.741
  447   1HB   ASN  61          HB2       ASN  61  14.775 -10.759  -5.204
  448   2HB   ASN  61          HB1       ASN  61  14.458  -9.794  -6.633
  449   1HD2  ASN  61          HD21      ASN  61  15.181 -12.612  -6.285
  450   2HD2  ASN  61          HD22      ASN  61  16.598 -12.856  -7.249
  451    H    ARG  62           HN       ARG  62  16.716  -7.452  -3.369
  452    HA   ARG  62           HA       ARG  62  18.520  -9.546  -2.354
  453   1HB   ARG  62          HB2       ARG  62  19.979  -7.600  -1.604
  454   2HB   ARG  62          HB1       ARG  62  19.931  -7.936  -3.327
  455   1HG   ARG  62          HG2       ARG  62  18.518  -6.074  -3.737
  456   2HG   ARG  62          HG1       ARG  62  18.242  -5.828  -2.013
  457   1HD   ARG  62          HD2       ARG  62  20.951  -5.630  -3.304
  458   2HD   ARG  62          HD1       ARG  62  19.879  -4.248  -3.083
  459    HE   ARG  62           HE       ARG  62  20.140  -4.467  -0.728
  460   1HH1  ARG  62          HH11      ARG  62  22.222  -6.578  -2.596
  461   2HH1  ARG  62          HH12      ARG  62  23.343  -6.835  -1.290
  462   1HH2  ARG  62          HH21      ARG  62  21.618  -4.788   0.966
  463   2HH2  ARG  62          HH22      ARG  62  23.000  -5.819   0.736
  464    H    ASP  63           HN       ASP  63  16.577  -6.712  -1.456
  465    HA   ASP  63           HA       ASP  63  16.353  -7.803   1.252
  466   1HB   ASP  63          HB2       ASP  63  18.185  -6.105   1.237
  467   2HB   ASP  63          HB1       ASP  63  17.028  -4.908   0.665
  468    H    LYS  64           HN       LYS  64  14.386  -7.441   2.206
  469    HA   LYS  64           HA       LYS  64  12.456  -5.863   0.658
  470   1HB   LYS  64          HB2       LYS  64  10.742  -7.625   1.161
  471   2HB   LYS  64          HB1       LYS  64  11.997  -8.117   0.037
  472   1HG   LYS  64          HG2       LYS  64  11.884  -9.971   1.350
  473   2HG   LYS  64          HG1       LYS  64  13.121  -9.066   2.220
  474   1HD   LYS  64          HD2       LYS  64  11.377  -8.203   3.739
  475   2HD   LYS  64          HD1       LYS  64  10.182  -9.187   2.892
  476   1HE   LYS  64          HE2       LYS  64  10.837 -10.363   4.863
  477   2HE   LYS  64          HE1       LYS  64  11.528 -11.200   3.476
  478   1HZ   LYS  64          HZ1       LYS  64  13.652 -10.153   3.929
  479   2HZ   LYS  64          HZ2       LYS  64  13.112 -10.991   5.300
  480   3HZ   LYS  64          HZ3       LYS  64  12.992  -9.301   5.237
  481    H    LEU  65           HN       LEU  65  11.001  -4.687   1.809
  482    HA   LEU  65           HA       LEU  65  11.146  -4.885   4.747
  483   1HB   LEU  65          HB2       LEU  65  11.193  -2.375   3.077
  484   2HB   LEU  65          HB1       LEU  65  10.936  -2.390   4.809
  485    HG   LEU  65           HG       LEU  65  13.231  -3.582   4.913
  486   1HD1  LEU  65          HD11      LEU  65  14.766  -2.938   3.109
  487   2HD1  LEU  65          HD12      LEU  65  13.406  -2.291   2.193
  488   3HD1  LEU  65          HD13      LEU  65  13.493  -4.016   2.539
  489   1HD2  LEU  65          HD21      LEU  65  12.964  -0.675   4.174
  490   2HD2  LEU  65          HD22      LEU  65  14.381  -1.405   4.931
  491   3HD2  LEU  65          HD23      LEU  65  12.841  -1.370   5.790
  492    H    TYR  66           HN       TYR  66   9.193  -5.255   5.575
  493    HA   TYR  66           HA       TYR  66   6.807  -4.949   4.050
  494   1HB   TYR  66          HB2       TYR  66   7.121  -5.402   7.029
  495   2HB   TYR  66          HB1       TYR  66   5.641  -5.626   6.101
  496    HD1  TYR  66           HD1      TYR  66   9.019  -6.940   6.726
  497    HD2  TYR  66           HD2      TYR  66   5.281  -7.633   4.807
  498    HE1  TYR  66           HE1      TYR  66   9.673  -9.267   6.299
  499    HE2  TYR  66           HE2      TYR  66   5.933  -9.963   4.375
  500    HH   TYR  66           HH       TYR  66   8.680 -11.399   5.858
  501    H    VAL  67           HN       VAL  67   5.432  -3.280   3.938
  502    HA   VAL  67           HA       VAL  67   5.791  -1.048   5.817
  503    HB   VAL  67           HB       VAL  67   5.252   0.517   3.934
  504   1HG1  VAL  67          HG11      VAL  67   7.797  -1.076   3.659
  505   2HG1  VAL  67          HG12      VAL  67   7.523   0.244   4.797
  506   3HG1  VAL  67          HG13      VAL  67   7.528   0.562   3.061
  507   1HG2  VAL  67          HG21      VAL  67   4.302  -1.101   2.371
  508   2HG2  VAL  67          HG22      VAL  67   5.870  -1.898   2.232
  509   3HG2  VAL  67          HG23      VAL  67   5.664  -0.248   1.645
  510    H    ASN  68           HN       ASN  68   3.990  -0.505   6.824
  511    HA   ASN  68           HA       ASN  68   1.476  -1.556   5.784
  512   1HB   ASN  68          HB2       ASN  68   0.586  -0.667   8.054
  513   2HB   ASN  68          HB1       ASN  68   1.583  -2.112   8.040
  514   1HD2  ASN  68          HD21      ASN  68   2.753   1.222   7.739
  515   2HD2  ASN  68          HD22      ASN  68   3.631   1.216   9.239
  516    H    ILE  69           HN       ILE  69   0.146  -0.371   4.667
  517    HA   ILE  69           HA       ILE  69   0.728   2.431   4.275
  518    HB   ILE  69           HB       ILE  69  -1.674   1.093   3.090
  519   1HG1  ILE  69          HG12      ILE  69   1.162   0.701   2.111
  520   2HG1  ILE  69          HG11      ILE  69   0.176  -0.540   2.872
  521   1HG2  ILE  69          HG21      ILE  69   0.336   3.074   2.018
  522   2HG2  ILE  69          HG22      ILE  69  -1.255   3.465   2.667
  523   3HG2  ILE  69          HG23      ILE  69  -1.115   2.521   1.184
  524   1HD1  ILE  69          HD11      ILE  69  -0.390   0.825   0.252
  525   2HD1  ILE  69          HD12      ILE  69  -1.413  -0.392   1.017
  526   3HD1  ILE  69          HD13      ILE  69   0.210  -0.818   0.472
  527    H    ARG  70           HN       ARG  70   0.173   3.299   6.318
  528    HA   ARG  70           HA       ARG  70  -2.587   3.002   7.210
  529   1HB   ARG  70          HB2       ARG  70  -0.237   4.446   8.460
  530   2HB   ARG  70          HB1       ARG  70  -1.844   4.371   9.161
  531   1HG   ARG  70          HG2       ARG  70  -1.662   1.976   9.411
  532   2HG   ARG  70          HG1       ARG  70  -0.093   1.986   8.602
  533   1HD   ARG  70          HD2       ARG  70   0.118   1.862  11.053
  534   2HD   ARG  70          HD1       ARG  70   0.853   3.321  10.390
  535    HE   ARG  70           HE       ARG  70  -1.885   3.506  11.407
  536   1HH1  ARG  70          HH11      ARG  70   1.534   4.119  11.921
  537   2HH1  ARG  70          HH12      ARG  70   1.262   5.366  13.102
  538   1HH2  ARG  70          HH21      ARG  70  -2.243   5.141  12.955
  539   2HH2  ARG  70          HH22      ARG  70  -0.885   5.923  13.718
  540    HA   PRO  71           HA       PRO  71  -3.689   6.709   5.093
  541   1HB   PRO  71          HB2       PRO  71  -6.017   7.233   6.374
  542   2HB   PRO  71          HB1       PRO  71  -5.859   6.002   5.129
  543   1HG   PRO  71          HG2       PRO  71  -5.881   5.682   8.098
  544   2HG   PRO  71          HG1       PRO  71  -6.654   4.681   6.851
  545   1HD   PRO  71          HD2       PRO  71  -4.326   3.980   8.064
  546   2HD   PRO  71          HD1       PRO  71  -4.710   3.539   6.387
  547    H    MET  72           HN       MET  72  -3.242   8.800   5.384
  548    HA   MET  72           HA       MET  72  -2.004   9.460   7.891
  549   1HB   MET  72          HB2       MET  72  -1.099  10.031   5.571
  550   2HB   MET  72          HB1       MET  72  -2.332  11.287   5.518
  551   1HG   MET  72          HG2       MET  72  -1.389  12.391   7.421
  552   2HG   MET  72          HG1       MET  72  -0.255  11.071   7.682
  553   1HE   MET  72          HE1       MET  72   0.625  14.101   7.594
  554   2HE   MET  72          HE2       MET  72   2.093  13.985   6.620
  555   3HE   MET  72          HE3       MET  72   1.738  12.754   7.832
  556    H    ASP  73           HN       ASP  73  -3.655   9.619   9.361
  557    HA   ASP  73           HA       ASP  73  -5.046  10.784  10.726
  558   1HB   ASP  73          HB2       ASP  73  -4.606  13.057   8.776
  559   2HB   ASP  73          HB1       ASP  73  -5.393  13.203  10.344
  560    H    ASN  74           HN       ASN  74  -6.185   9.127   8.678
  561    HA   ASN  74           HA       ASN  74  -8.761  10.489   8.398
  562   1HB   ASN  74          HB2       ASN  74  -7.164   9.325   6.152
  563   2HB   ASN  74          HB1       ASN  74  -8.917   9.408   6.054
  564   1HD2  ASN  74          HD21      ASN  74  -5.961  11.131   5.848
  565   2HD2  ASN  74          HD22      ASN  74  -6.636  12.672   5.451
  566    H    SER  75           HN       SER  75 -10.148   9.331   9.453
  567    HA   SER  75           HA       SER  75 -11.624   7.682   9.919
  568   1HB   SER  75          HB2       SER  75 -10.472   6.269   7.510
  569   2HB   SER  75          HB1       SER  75 -12.056   6.007   8.239
  570    HG   SER  75           HG       SER  75 -11.939   8.573   7.744
  571    H    ALA  76           HN       ALA  76 -11.627   4.975   9.795
  572    HA   ALA  76           HA       ALA  76  -9.195   4.141  11.238
  573   1HB   ALA  76          HB1       ALA  76 -10.590   2.646  12.588
  574   2HB   ALA  76          HB2       ALA  76 -12.029   3.277  11.790
  575   3HB   ALA  76          HB3       ALA  76 -11.050   4.335  12.803
  576    H    TRP  77           HN       TRP  77  -8.120   2.733  10.072
  577    HA   TRP  77           HA       TRP  77  -9.593   1.023   8.190
  578   1HB   TRP  77          HB2       TRP  77  -6.765   2.079   8.139
  579   2HB   TRP  77          HB1       TRP  77  -7.335   0.816   7.055
  580    HD1  TRP  77           HD1      TRP  77  -9.063   4.182   7.985
  581    HE1  TRP  77           HE1      TRP  77  -9.554   5.439   5.790
  582    HE3  TRP  77           HE3      TRP  77  -6.917   0.918   4.695
  583    HZ2  TRP  77           HZ2      TRP  77  -9.084   5.081   3.030
  584    HZ3  TRP  77           HZ3      TRP  77  -6.982   1.443   2.298
  585    HH2  TRP  77           HH2      TRP  77  -8.039   3.488   1.485
  586    H    THR  78           HN       THR  78  -9.301  -1.163   8.223
  587    HA   THR  78           HA       THR  78  -8.015  -2.324  10.528
  588    HB   THR  78           HB       THR  78  -9.248  -3.729   8.144
  589    HG1  THR  78           HG1      THR  78 -10.372  -2.780  10.591
  590   1HG2  THR  78          HG21      THR  78  -8.716  -4.680  10.966
  591   2HG2  THR  78          HG22      THR  78  -7.803  -5.156   9.534
  592   3HG2  THR  78          HG23      THR  78  -9.499  -5.613   9.693
  593    H    THR  79           HN       THR  79  -5.897  -2.606  10.578
  594    HA   THR  79           HA       THR  79  -4.393  -2.520   8.105
  595    HB   THR  79           HB       THR  79  -3.582  -1.103   9.840
  596    HG1  THR  79           HG1      THR  79  -1.855  -3.367   9.635
  597   1HG2  THR  79          HG21      THR  79  -3.342  -3.562  11.574
  598   2HG2  THR  79          HG22      THR  79  -4.506  -2.254  11.781
  599   3HG2  THR  79          HG23      THR  79  -2.784  -1.944  12.001
  600    H    ASP  80           HN       ASP  80  -4.077  -4.288   7.020
  601    HA   ASP  80           HA       ASP  80  -2.957  -6.596   8.455
  602   1HB   ASP  80          HB2       ASP  80  -5.279  -7.084   7.643
  603   2HB   ASP  80          HB1       ASP  80  -4.737  -6.752   5.998
  604    H    ASN  81           HN       ASN  81  -1.369  -7.807   7.131
  605    HA   ASN  81           HA       ASN  81   0.160  -5.937   5.538
  606   1HB   ASN  81          HB2       ASN  81   0.716  -8.688   6.590
  607   2HB   ASN  81          HB1       ASN  81   1.746  -7.976   5.353
  608   1HD2  ASN  81          HD21      ASN  81   2.974  -6.153   5.846
  609   2HD2  ASN  81          HD22      ASN  81   3.317  -5.708   7.485
  610    H    GLY  82           HN       GLY  82  -2.329  -7.946   4.813
  611   1HA   GLY  82          HA2       GLY  82  -1.315  -8.358   2.086
  612   2HA   GLY  82          HA1       GLY  82  -2.628  -9.272   2.811
  613    H    VAL  83           HN       VAL  83  -3.886  -6.932   3.988
  614    HA   VAL  83           HA       VAL  83  -4.757  -5.442   1.626
  615    HB   VAL  83           HB       VAL  83  -7.086  -5.785   2.068
  616   1HG1  VAL  83          HG11      VAL  83  -5.645  -8.439   2.159
  617   2HG1  VAL  83          HG12      VAL  83  -6.049  -7.514   0.712
  618   3HG1  VAL  83          HG13      VAL  83  -7.333  -8.210   1.702
  619   1HG2  VAL  83          HG21      VAL  83  -7.914  -7.233   3.869
  620   2HG2  VAL  83          HG22      VAL  83  -7.013  -5.857   4.506
  621   3HG2  VAL  83          HG23      VAL  83  -6.262  -7.452   4.450
  622    H    PHE  84           HN       PHE  84  -5.847  -3.408   2.185
  623    HA   PHE  84           HA       PHE  84  -5.690  -2.717   5.025
  624   1HB   PHE  84          HB2       PHE  84  -3.623  -1.981   3.412
  625   2HB   PHE  84          HB1       PHE  84  -4.693  -0.599   3.206
  626    HD1  PHE  84           HD1      PHE  84  -5.723   0.269   5.531
  627    HD2  PHE  84           HD2      PHE  84  -2.076  -1.868   5.066
  628    HE1  PHE  84           HE1      PHE  84  -4.922   1.180   7.670
  629    HE2  PHE  84           HE2      PHE  84  -1.263  -0.957   7.201
  630    HZ   PHE  84           HZ       PHE  84  -2.690   0.567   8.510
  631    H    TYR  85           HN       TYR  85  -7.754  -2.143   5.444
  632    HA   TYR  85           HA       TYR  85  -9.107  -0.531   3.434
  633   1HB   TYR  85          HB2       TYR  85 -11.043  -1.967   3.304
  634   2HB   TYR  85          HB1       TYR  85  -9.598  -2.830   2.816
  635    HD1  TYR  85           HD1      TYR  85 -12.576  -3.180   4.546
  636    HD2  TYR  85           HD2      TYR  85  -8.434  -4.094   4.906
  637    HE1  TYR  85           HE1      TYR  85 -13.108  -4.954   6.173
  638    HE2  TYR  85           HE2      TYR  85  -8.958  -5.871   6.512
  639    HH   TYR  85           HH       TYR  85 -12.041  -7.081   7.002
  640    H    LYS  86           HN       LYS  86 -10.654   0.734   4.070
  641    HA   LYS  86           HA       LYS  86 -10.749   1.518   6.793
  642   1HB   LYS  86          HB2       LYS  86 -12.490   3.138   5.950
  643   2HB   LYS  86          HB1       LYS  86 -10.942   3.210   5.123
  644   1HG   LYS  86          HG2       LYS  86 -11.937   1.763   3.330
  645   2HG   LYS  86          HG1       LYS  86 -13.494   1.968   4.124
  646   1HD   LYS  86          HD2       LYS  86 -11.917   4.401   3.445
  647   2HD   LYS  86          HD1       LYS  86 -12.715   3.532   2.136
  648   1HE   LYS  86          HE2       LYS  86 -14.247   5.182   2.821
  649   2HE   LYS  86          HE1       LYS  86 -14.834   3.676   3.521
  650   1HZ   LYS  86          HZ1       LYS  86 -14.952   5.431   5.133
  651   2HZ   LYS  86          HZ2       LYS  86 -13.323   5.811   4.934
  652   3HZ   LYS  86          HZ3       LYS  86 -13.766   4.333   5.634
  653    H    ASN  87           HN       ASN  87 -12.053   0.887   8.366
  654    HA   ASN  87           HA       ASN  87 -13.996  -1.158   8.026
  655   1HB   ASN  87          HB2       ASN  87 -13.141  -1.172  10.173
  656   2HB   ASN  87          HB1       ASN  87 -13.071   0.583  10.271
  657   1HD2  ASN  87          HD21      ASN  87 -15.142  -2.229  10.576
  658   2HD2  ASN  87          HD22      ASN  87 -16.394  -1.428  11.464
  659    H    ASP  88           HN       ASP  88 -14.110   2.326   8.254
  660    HA   ASP  88           HA       ASP  88 -16.939   2.589   8.289
  661   1HB   ASP  88          HB2       ASP  88 -15.946   4.880   7.035
  662   2HB   ASP  88          HB1       ASP  88 -16.266   4.688   8.759
  663    H    VAL  89           HN       VAL  89 -18.345   2.305   6.669
  664    HA   VAL  89           HA       VAL  89 -17.266   1.790   4.011
  665    HB   VAL  89           HB       VAL  89 -19.599   1.064   3.449
  666   1HG1  VAL  89          HG11      VAL  89 -19.459  -1.041   4.699
  667   2HG1  VAL  89          HG12      VAL  89 -18.279  -0.311   5.787
  668   3HG1  VAL  89          HG13      VAL  89 -17.884  -0.540   4.083
  669   1HG2  VAL  89          HG21      VAL  89 -21.173   0.643   5.265
  670   2HG2  VAL  89          HG22      VAL  89 -20.796   2.362   5.151
  671   3HG2  VAL  89          HG23      VAL  89 -20.059   1.381   6.415
  672    H    GLY  90           HN       GLY  90 -17.134   3.359   2.578
  673   1HA   GLY  90          HA2       GLY  90 -19.155   4.835   1.540
  674   2HA   GLY  90          HA1       GLY  90 -18.633   5.802   2.912
  675    H    SER  91           HN       SER  91 -18.268   7.300   1.029
  676    HA   SER  91           HA       SER  91 -15.993   6.887  -0.619
  677   1HB   SER  91          HB2       SER  91 -16.220   9.422  -0.920
  678   2HB   SER  91          HB1       SER  91 -17.616   8.448  -1.392
  679    HG   SER  91           HG       SER  91 -18.024  10.371  -0.035
  680    H    TRP  92           HN       TRP  92 -13.941   7.960  -0.405
  681    HA   TRP  92           HA       TRP  92 -13.279   8.755   2.336
  682   1HB   TRP  92          HB2       TRP  92 -12.872   6.295   1.953
  683   2HB   TRP  92          HB1       TRP  92 -11.632   6.776   0.790
  684    HD1  TRP  92           HD1      TRP  92 -12.430   7.049   4.553
  685    HE1  TRP  92           HE1      TRP  92 -10.206   7.340   5.813
  686    HE3  TRP  92           HE3      TRP  92  -9.325   7.433   0.550
  687    HZ2  TRP  92           HZ2      TRP  92  -7.469   7.676   5.160
  688    HZ3  TRP  92           HZ3      TRP  92  -6.945   7.751   0.944
  689    HH2  TRP  92           HH2      TRP  92  -6.015   7.866   3.192
  690    H    GLY  93           HN       GLY  93 -11.677   8.156  -0.743
  691   1HA   GLY  93          HA2       GLY  93  -9.938   9.324  -1.756
  692   2HA   GLY  93          HA1       GLY  93 -11.177  10.551  -1.802
  693    H    GLY  94           HN       GLY  94  -8.310   9.418  -0.148
  694   1HA   GLY  94          HA2       GLY  94  -7.730  12.119   0.707
  695   2HA   GLY  94          HA1       GLY  94  -8.005  10.980   2.018
  696    H    THR  95           HN       THR  95  -5.861  11.226   2.746
  697    HA   THR  95           HA       THR  95  -3.759  10.337   0.903
  698    HB   THR  95           HB       THR  95  -2.269  11.349   2.762
  699    HG1  THR  95           HG1      THR  95  -3.356  12.897   4.046
  700   1HG2  THR  95          HG21      THR  95  -2.551  13.615   1.821
  701   2HG2  THR  95          HG22      THR  95  -4.065  13.105   1.075
  702   3HG2  THR  95          HG23      THR  95  -2.542  12.378   0.566
  703    H    ILE  96           HN       ILE  96  -2.725   8.492   1.217
  704    HA   ILE  96           HA       ILE  96  -2.649   7.329   3.915
  705    HB   ILE  96           HB       ILE  96  -2.192   5.112   2.573
  706   1HG1  ILE  96          HG12      ILE  96  -2.432   6.461   0.399
  707   2HG1  ILE  96          HG11      ILE  96  -3.209   4.884   0.496
  708   1HG2  ILE  96          HG21      ILE  96  -4.942   6.235   3.031
  709   2HG2  ILE  96          HG22      ILE  96  -3.967   5.302   4.167
  710   3HG2  ILE  96          HG23      ILE  96  -4.591   4.538   2.706
  711   1HD1  ILE  96          HD11      ILE  96  -5.347   5.973   0.951
  712   2HD1  ILE  96          HD12      ILE  96  -4.646   6.516  -0.573
  713   3HD1  ILE  96          HD13      ILE  96  -4.558   7.549   0.851
  714    H    GLY  97           HN       GLY  97  -0.608   6.541   4.579
  715   1HA   GLY  97          HA2       GLY  97   1.567   7.433   2.794
  716   2HA   GLY  97          HA1       GLY  97   1.619   7.575   4.545
  717    H    ILE  98           HN       ILE  98   3.458   6.250   2.685
  718    HA   ILE  98           HA       ILE  98   3.232   3.469   3.513
  719    HB   ILE  98           HB       ILE  98   5.102   4.901   1.636
  720   1HG1  ILE  98          HG12      ILE  98   4.306   2.968   0.154
  721   2HG1  ILE  98          HG11      ILE  98   3.113   2.652   1.412
  722   1HG2  ILE  98          HG21      ILE  98   6.340   2.812   1.328
  723   2HG2  ILE  98          HG22      ILE  98   5.418   2.075   2.640
  724   3HG2  ILE  98          HG23      ILE  98   6.501   3.427   2.974
  725   1HD1  ILE  98          HD11      ILE  98   3.384   5.192  -0.178
  726   2HD1  ILE  98          HD12      ILE  98   2.200   4.898   1.095
  727   3HD1  ILE  98          HD13      ILE  98   2.152   3.948  -0.389
  728    H    TYR  99           HN       TYR  99   3.938   2.945   5.421
  729    HA   TYR  99           HA       TYR  99   6.284   4.320   6.534
  730   1HB   TYR  99          HB2       TYR  99   4.126   3.039   8.211
  731   2HB   TYR  99          HB1       TYR  99   5.341   4.213   8.702
  732    HD1  TYR  99           HD1      TYR  99   5.098   6.600   7.956
  733    HD2  TYR  99           HD2      TYR  99   2.006   3.736   7.427
  734    HE1  TYR  99           HE1      TYR  99   3.468   8.416   7.671
  735    HE2  TYR  99           HE2      TYR  99   0.374   5.551   7.135
  736    HH   TYR  99           HH       TYR  99   0.172   7.979   7.845
  737    H    VAL 100           HN       VAL 100   7.943   3.005   7.050
  738    HA   VAL 100           HA       VAL 100   7.811   0.238   6.386
  739    HB   VAL 100           HB       VAL 100   9.883   1.665   6.182
  740   1HG1  VAL 100          HG11      VAL 100   9.762   2.779   8.339
  741   2HG1  VAL 100          HG12      VAL 100  11.288   1.914   8.166
  742   3HG1  VAL 100          HG13      VAL 100   9.999   1.238   9.164
  743   1HG2  VAL 100          HG21      VAL 100   9.976  -0.761   5.996
  744   2HG2  VAL 100          HG22      VAL 100  10.134  -0.901   7.746
  745   3HG2  VAL 100          HG23      VAL 100  11.415  -0.139   6.805
  746    H    ASP 101           HN       ASP 101   7.721  -1.530   7.717
  747    HA   ASP 101           HA       ASP 101   6.541  -1.276  10.270
  748   1HB   ASP 101          HB2       ASP 101   6.209  -3.268   8.880
  749   2HB   ASP 101          HB1       ASP 101   7.924  -3.659   9.014
  750    H    GLY 102           HN       GLY 102   7.771  -0.033  11.644
  751   1HA   GLY 102          HA2       GLY 102   9.382   0.446  13.205
  752   2HA   GLY 102          HA1       GLY 102   9.479  -1.294  13.397
  753    H    GLN 103           HN       GLN 103  10.463   0.934  10.800
  754    HA   GLN 103           HA       GLN 103  12.210   0.748   9.350
  755   1HB   GLN 103          HB2       GLN 103  14.387   1.340  10.385
  756   2HB   GLN 103          HB1       GLN 103  13.059   2.400  10.817
  757   1HG   GLN 103          HG2       GLN 103  12.908   1.398  12.996
  758   2HG   GLN 103          HG1       GLN 103  14.116   0.189  12.561
  759   1HE2  GLN 103          HE21      GLN 103  14.360   3.520  11.556
  760   2HE2  GLN 103          HE22      GLN 103  15.708   3.928  12.559
  761    H    GLN 104           HN       GLN 104  12.097  -1.206   8.467
  762    HA   GLN 104           HA       GLN 104  12.752  -3.651   9.588
  763   1HB   GLN 104          HB2       GLN 104  12.402  -2.610   6.836
  764   2HB   GLN 104          HB1       GLN 104  13.170  -4.184   6.998
  765   1HG   GLN 104          HG2       GLN 104  10.509  -3.439   8.201
  766   2HG   GLN 104          HG1       GLN 104  10.712  -4.267   6.656
  767   1HE2  GLN 104          HE21      GLN 104   9.405  -5.116   9.138
  768   2HE2  GLN 104          HE22      GLN 104  10.158  -6.610   9.572
  769    H    THR 105           HN       THR 105  14.718  -2.175   7.002
  770    HA   THR 105           HA       THR 105  17.125  -3.203   8.293
  771    HB   THR 105           HB       THR 105  17.683  -4.276   5.972
  772    HG1  THR 105           HG1      THR 105  16.032  -4.569   4.654
  773   1HG2  THR 105          HG21      THR 105  15.740  -5.580   7.886
  774   2HG2  THR 105          HG22      THR 105  17.495  -5.555   8.046
  775   3HG2  THR 105          HG23      THR 105  16.745  -6.424   6.709
  776    H    ASN 106           HN       ASN 106  16.038  -2.059   5.104
  777    HA   ASN 106           HA       ASN 106  16.973  -0.702   3.566
  778   1HB   ASN 106          HB2       ASN 106  16.539   1.045   5.239
  779   2HB   ASN 106          HB1       ASN 106  18.078   0.708   6.006
  780   1HD2  ASN 106          HD21      ASN 106  19.872   1.714   5.265
  781   2HD2  ASN 106          HD22      ASN 106  19.912   2.762   3.878
  782    H    THR 107           HN       THR 107  18.132  -3.066   3.919
  783    HA   THR 107           HA       THR 107  20.970  -2.919   4.283
  784    HB   THR 107           HB       THR 107  19.434  -5.041   2.764
  785    HG1  THR 107           HG1      THR 107  18.540  -5.505   4.617
  786   1HG2  THR 107          HG21      THR 107  21.870  -5.170   2.563
  787   2HG2  THR 107          HG22      THR 107  21.244  -6.511   3.523
  788   3HG2  THR 107          HG23      THR 107  22.022  -5.143   4.320
  789    HA   PRO 108           HA       PRO 108  22.514  -0.388   1.164
  790   1HB   PRO 108          HB2       PRO 108  23.633  -2.920   0.018
  791   2HB   PRO 108          HB1       PRO 108  24.412  -1.347   0.238
  792   1HG   PRO 108          HG2       PRO 108  24.537  -3.504   2.030
  793   2HG   PRO 108          HG1       PRO 108  24.987  -1.829   2.382
  794   1HD   PRO 108          HD2       PRO 108  22.877  -3.254   3.572
  795   2HD   PRO 108          HD1       PRO 108  23.093  -1.490   3.618
  796    HA   PRO 109           HA       PRO 109  19.105  -1.735  -1.540
  797   1HB   PRO 109          HB2       PRO 109  17.799   0.750  -1.194
  798   2HB   PRO 109          HB1       PRO 109  17.429  -0.773  -0.389
  799   1HG   PRO 109          HG2       PRO 109  18.418   1.510   0.852
  800   2HG   PRO 109          HG1       PRO 109  18.451  -0.125   1.527
  801   1HD   PRO 109          HD2       PRO 109  20.613   1.402   0.148
  802   2HD   PRO 109          HD1       PRO 109  20.713   0.274   1.518
  803    H    GLY 110           HN       GLY 110  17.735  -0.217  -3.106
  804   1HA   GLY 110          HA2       GLY 110  19.172   1.745  -4.584
  805   2HA   GLY 110          HA1       GLY 110  19.138   0.181  -5.404
  806    H    ASN 111           HN       ASN 111  17.443  -0.188  -6.688
  807    HA   ASN 111           HA       ASN 111  15.092   1.515  -6.437
  808   1HB   ASN 111          HB2       ASN 111  16.017   1.081  -8.682
  809   2HB   ASN 111          HB1       ASN 111  15.720  -0.643  -8.464
  810   1HD2  ASN 111          HD21      ASN 111  14.304  -0.812 -10.165
  811   2HD2  ASN 111          HD22      ASN 111  12.714  -0.128 -10.136
  812    H    TYR 112           HN       TYR 112  13.199   0.900  -5.586
  813    HA   TYR 112           HA       TYR 112  12.797  -1.945  -4.963
  814   1HB   TYR 112          HB2       TYR 112  12.406   0.452  -3.195
  815   2HB   TYR 112          HB1       TYR 112  11.394  -0.968  -2.982
  816    HD1  TYR 112           HD1      TYR 112  12.043  -2.194  -1.170
  817    HD2  TYR 112           HD2      TYR 112  15.056  -0.472  -3.609
  818    HE1  TYR 112           HE1      TYR 112  13.764  -3.266   0.218
  819    HE2  TYR 112           HE2      TYR 112  16.785  -1.541  -2.236
  820    HH   TYR 112           HH       TYR 112  16.039  -3.905   0.163
  821    H    THR 113           HN       THR 113  11.026  -2.733  -5.801
  822    HA   THR 113           HA       THR 113   9.052  -0.898  -6.921
  823    HB   THR 113           HB       THR 113   9.203  -3.888  -7.251
  824    HG1  THR 113           HG1      THR 113  10.961  -3.458  -8.346
  825   1HG2  THR 113          HG21      THR 113   7.868  -1.724  -8.883
  826   2HG2  THR 113          HG22      THR 113   7.058  -2.907  -7.856
  827   3HG2  THR 113          HG23      THR 113   7.912  -3.437  -9.304
  828    H    LEU 114           HN       LEU 114   7.188  -0.578  -5.936
  829    HA   LEU 114           HA       LEU 114   5.903  -2.811  -4.602
  830   1HB   LEU 114          HB2       LEU 114   5.090  -1.169  -2.804
  831   2HB   LEU 114          HB1       LEU 114   6.714  -1.813  -2.654
  832    HG   LEU 114           HG       LEU 114   6.393   0.786  -4.044
  833   1HD1  LEU 114          HD11      LEU 114   6.253   0.487  -1.044
  834   2HD1  LEU 114          HD12      LEU 114   4.925   1.002  -2.085
  835   3HD1  LEU 114          HD13      LEU 114   6.369   2.006  -1.934
  836   1HD2  LEU 114          HD21      LEU 114   8.414  -0.278  -2.079
  837   2HD2  LEU 114          HD22      LEU 114   8.516   1.254  -2.949
  838   3HD2  LEU 114          HD23      LEU 114   8.583  -0.271  -3.835
  839    H    THR 115           HN       THR 115   4.204  -3.050  -5.835
  840    HA   THR 115           HA       THR 115   2.944  -0.665  -6.997
  841    HB   THR 115           HB       THR 115   2.848  -3.504  -8.051
  842    HG1  THR 115           HG1      THR 115   4.552  -3.015  -9.258
  843   1HG2  THR 115          HG21      THR 115   0.914  -2.124  -8.675
  844   2HG2  THR 115          HG22      THR 115   1.930  -2.480 -10.071
  845   3HG2  THR 115          HG23      THR 115   2.003  -0.890  -9.311
  846    H    LEU 116           HN       LEU 116   0.944  -0.241  -6.342
  847    HA   LEU 116           HA       LEU 116  -0.359  -2.317  -4.731
  848   1HB   LEU 116          HB2       LEU 116  -0.393   0.673  -4.439
  849   2HB   LEU 116          HB1       LEU 116  -1.421  -0.401  -3.512
  850    HG   LEU 116           HG       LEU 116   0.351   0.105  -2.075
  851   1HD1  LEU 116          HD11      LEU 116   1.613  -1.953  -1.784
  852   2HD1  LEU 116          HD12      LEU 116   1.092  -2.486  -3.384
  853   3HD1  LEU 116          HD13      LEU 116  -0.096  -2.264  -2.098
  854   1HD2  LEU 116          HD21      LEU 116   2.249  -0.351  -4.353
  855   2HD2  LEU 116          HD22      LEU 116   2.716  -0.008  -2.688
  856   3HD2  LEU 116          HD23      LEU 116   1.832   1.200  -3.622
  857    H    THR 117           HN       THR 117  -1.943  -3.195  -5.781
  858    HA   THR 117           HA       THR 117  -3.609  -1.586  -7.579
  859    HB   THR 117           HB       THR 117  -3.732  -4.584  -7.145
  860    HG1  THR 117           HG1      THR 117  -1.679  -3.323  -8.068
  861   1HG2  THR 117          HG21      THR 117  -4.720  -4.564  -9.404
  862   2HG2  THR 117          HG22      THR 117  -4.611  -2.803  -9.428
  863   3HG2  THR 117          HG23      THR 117  -5.668  -3.606  -8.267
  864    H    GLY 118           HN       GLY 118  -5.199  -0.585  -6.459
  865   1HA   GLY 118          HA2       GLY 118  -6.146  -1.813  -3.975
  866   2HA   GLY 118          HA1       GLY 118  -6.404  -0.147  -4.470
  867    H    GLY 119           HN       GLY 119  -8.616  -0.502  -3.855
  868   1HA   GLY 119          HA2       GLY 119 -10.398  -0.423  -5.798
  869   2HA   GLY 119          HA1       GLY 119 -10.170  -2.166  -5.669
  870    H    TYR 120           HN       TYR 120 -12.544  -1.952  -5.137
  871    HA   TYR 120           HA       TYR 120 -12.865  -1.224  -2.331
  872   1HB   TYR 120          HB2       TYR 120 -15.261  -1.281  -2.659
  873   2HB   TYR 120          HB1       TYR 120 -14.520  -0.255  -3.873
  874    HD1  TYR 120           HD1      TYR 120 -16.305  -3.388  -3.265
  875    HD2  TYR 120           HD2      TYR 120 -14.580  -0.861  -6.235
  876    HE1  TYR 120           HE1      TYR 120 -17.464  -4.664  -5.015
  877    HE2  TYR 120           HE2      TYR 120 -15.745  -2.134  -7.990
  878    HH   TYR 120           HH       TYR 120 -16.700  -4.461  -8.266
  879    H    TRP 121           HN       TRP 121 -13.375  -2.589  -0.818
  880    HA   TRP 121           HA       TRP 121 -13.005  -5.426  -1.374
  881   1HB   TRP 121          HB2       TRP 121 -11.668  -4.463   0.403
  882   2HB   TRP 121          HB1       TRP 121 -13.093  -3.771   1.166
  883    HD1  TRP 121           HD1      TRP 121 -14.867  -5.634   2.164
  884    HE1  TRP 121           HE1      TRP 121 -14.366  -7.838   3.385
  885    HE3  TRP 121           HE3      TRP 121 -10.082  -6.336   0.592
  886    HZ2  TRP 121           HZ2      TRP 121 -12.229  -9.634   3.616
  887    HZ3  TRP 121           HZ3      TRP 121  -8.873  -8.333   1.384
  888    HH2  TRP 121           HH2      TRP 121  -9.928  -9.943   2.851
  889    H    ALA 122           HN       ALA 122 -14.606  -6.969  -0.965
  890    HA   ALA 122           HA       ALA 122 -17.101  -6.052   0.183
  891   1HB   ALA 122          HB1       ALA 122 -17.356  -5.601  -2.207
  892   2HB   ALA 122          HB2       ALA 122 -18.474  -6.851  -1.663
  893   3HB   ALA 122          HB3       ALA 122 -17.022  -7.296  -2.558
  894    H    LYS 123           HN       LYS 123 -15.629  -7.603   1.569
  895    HA   LYS 123           HA       LYS 123 -17.216  -9.981   1.887
  896   1HB   LYS 123          HB2       LYS 123 -14.301 -10.172   1.131
  897   2HB   LYS 123          HB1       LYS 123 -15.057 -11.409   2.121
  898   1HG   LYS 123          HG2       LYS 123 -15.789 -10.644  -0.697
  899   2HG   LYS 123          HG1       LYS 123 -15.051 -12.151  -0.153
  900   1HD   LYS 123          HD2       LYS 123 -17.042 -12.781   1.019
  901   2HD   LYS 123          HD1       LYS 123 -17.776 -11.204   0.721
  902   1HE   LYS 123          HE2       LYS 123 -17.619 -11.724  -1.740
  903   2HE   LYS 123          HE1       LYS 123 -17.163 -13.365  -1.288
  904   1HZ   LYS 123          HZ1       LYS 123 -19.273 -13.519  -0.047
  905   2HZ   LYS 123          HZ2       LYS 123 -19.504 -13.284  -1.708
  906   3HZ   LYS 123          HZ3       LYS 123 -19.711 -11.991  -0.634
  907    H    ASP 124           HN       ASP 124 -14.837 -11.038   3.565
  908    HA   ASP 124           HA       ASP 124 -14.312  -8.888   5.383
  909   1HB   ASP 124          HB2       ASP 124 -15.165 -10.112   7.402
  910   2HB   ASP 124          HB1       ASP 124 -16.418  -9.511   6.325
  911    H    ASN 125           HN       ASN 125 -12.283  -8.998   5.284
  912    HA   ASN 125           HA       ASN 125 -10.136  -9.571   5.519
  913   1HB   ASN 125          HB2       ASN 125 -10.646  -9.977   7.796
  914   2HB   ASN 125          HB1       ASN 125 -11.275 -11.581   7.435
  915   1HD2  ASN 125          HD21      ASN 125  -8.397  -9.618   7.658
  916   2HD2  ASN 125          HD22      ASN 125  -7.274 -10.927   7.767
  917    H    LYS 126           HN       LYS 126 -12.141 -12.411   4.878
  918    HA   LYS 126           HA       LYS 126 -10.178 -14.240   4.359
  919   1HB   LYS 126          HB2       LYS 126 -11.837 -15.452   2.988
  920   2HB   LYS 126          HB1       LYS 126 -12.489 -14.896   4.523
  921   1HG   LYS 126          HG2       LYS 126 -13.702 -13.137   3.465
  922   2HG   LYS 126          HG1       LYS 126 -12.880 -13.419   1.930
  923   1HD   LYS 126          HD2       LYS 126 -15.081 -14.362   1.818
  924   2HD   LYS 126          HD1       LYS 126 -13.891 -15.663   1.831
  925   1HE   LYS 126          HE2       LYS 126 -14.291 -15.990   4.232
  926   2HE   LYS 126          HE1       LYS 126 -15.492 -14.698   4.205
  927   1HZ   LYS 126          HZ1       LYS 126 -16.582 -16.819   4.073
  928   2HZ   LYS 126          HZ2       LYS 126 -15.635 -17.279   2.742
  929   3HZ   LYS 126          HZ3       LYS 126 -16.761 -16.022   2.583
  930    H    GLN 127           HN       GLN 127 -11.676 -12.090   2.019
  931    HA   GLN 127           HA       GLN 127  -9.814 -11.300   0.384
  932   1HB   GLN 127          HB2       GLN 127  -8.873 -13.566   0.105
  933   2HB   GLN 127          HB1       GLN 127 -10.420 -14.124  -0.531
  934   1HG   GLN 127          HG2       GLN 127 -10.207 -12.723  -2.459
  935   2HG   GLN 127          HG1       GLN 127  -8.782 -11.931  -1.792
  936   1HE2  GLN 127          HE21      GLN 127  -7.606 -14.396  -0.803
  937   2HE2  GLN 127          HE22      GLN 127  -7.024 -15.243  -2.196
  938    H    GLY 128           HN       GLY 128 -11.556  -9.905   0.213
  939   1HA   GLY 128          HA2       GLY 128 -13.181 -10.596  -2.127
  940   2HA   GLY 128          HA1       GLY 128 -13.978  -9.917  -0.712
  941    H    PHE 129           HN       PHE 129 -11.838  -9.286  -3.383
  942    HA   PHE 129           HA       PHE 129 -12.339  -6.429  -2.995
  943   1HB   PHE 129          HB2       PHE 129  -9.988  -5.850  -3.319
  944   2HB   PHE 129          HB1       PHE 129 -10.168  -6.886  -1.907
  945    HD1  PHE 129           HD1      PHE 129  -9.493  -9.284  -2.048
  946    HD2  PHE 129           HD2      PHE 129  -8.679  -6.514  -5.178
  947    HE1  PHE 129           HE1      PHE 129  -7.797 -10.816  -2.958
  948    HE2  PHE 129           HE2      PHE 129  -6.990  -8.047  -6.097
  949    HZ   PHE 129           HZ       PHE 129  -6.546 -10.198  -4.987
  950    H    THR 130           HN       THR 130 -11.646  -5.197  -5.022
  951    HA   THR 130           HA       THR 130 -10.980  -6.784  -7.334
  952    HB   THR 130           HB       THR 130 -13.350  -7.098  -7.449
  953    HG1  THR 130           HG1      THR 130 -12.901  -4.945  -9.240
  954   1HG2  THR 130          HG21      THR 130 -13.609  -4.111  -7.176
  955   2HG2  THR 130          HG22      THR 130 -14.060  -5.313  -5.967
  956   3HG2  THR 130          HG23      THR 130 -14.934  -5.230  -7.497
  957    HA   PRO 131           HA       PRO 131  -8.740  -3.020  -8.070
  958   1HB   PRO 131          HB2       PRO 131  -8.398  -4.124 -10.785
  959   2HB   PRO 131          HB1       PRO 131  -7.172  -3.695  -9.587
  960   1HG   PRO 131          HG2       PRO 131  -7.718  -6.252 -10.172
  961   2HG   PRO 131          HG1       PRO 131  -7.304  -5.744  -8.524
  962   1HD   PRO 131          HD2       PRO 131  -9.985  -6.371  -9.698
  963   2HD   PRO 131          HD1       PRO 131  -9.329  -6.781  -8.099
  964    H    SER 132           HN       SER 132  -9.998  -1.264  -8.312
  965    HA   SER 132           HA       SER 132 -11.445  -0.958 -10.842
  966   1HB   SER 132          HB2       SER 132 -13.039  -1.566  -9.044
  967   2HB   SER 132          HB1       SER 132 -12.510  -0.155  -8.137
  968    HG   SER 132           HG       SER 132 -14.010   0.854  -9.205
  969    H    GLY 133           HN       GLY 133  -9.846   0.379 -11.672
  970   1HA   GLY 133          HA2       GLY 133  -9.297   2.592 -12.218
  971   2HA   GLY 133          HA1       GLY 133  -9.992   3.115 -10.699
  972    H    THR 134           HN       THR 134  -8.037   0.566  -9.970
  973    HA   THR 134           HA       THR 134  -6.175   2.457  -8.784
  974    HB   THR 134           HB       THR 134  -5.732   0.424  -7.301
  975    HG1  THR 134           HG1      THR 134  -7.293  -1.222  -7.450
  976   1HG2  THR 134          HG21      THR 134  -7.120   2.296  -6.575
  977   2HG2  THR 134          HG22      THR 134  -7.813   0.768  -6.026
  978   3HG2  THR 134          HG23      THR 134  -8.511   1.606  -7.413
  979    H    THR 135           HN       THR 135  -4.322   2.663  -9.982
  980    HA   THR 135           HA       THR 135  -2.719   0.224  -9.954
  981    HB   THR 135           HB       THR 135  -2.679   2.161 -12.288
  982    HG1  THR 135           HG1      THR 135  -4.200  -0.014 -11.779
  983   1HG2  THR 135          HG21      THR 135  -0.474   1.198 -11.787
  984   2HG2  THR 135          HG22      THR 135  -1.120   0.563 -13.301
  985   3HG2  THR 135          HG23      THR 135  -1.170  -0.422 -11.839
  986    H    GLY 136           HN       GLY 136  -1.582   0.876  -8.167
  987   1HA   GLY 136          HA2       GLY 136  -0.336   3.543  -8.299
  988   2HA   GLY 136          HA1       GLY 136  -0.719   2.686  -6.812
  989    H    THR 137           HN       THR 137   1.433   2.798  -9.578
  990    HA   THR 137           HA       THR 137   3.207   0.827  -8.449
  991    HB   THR 137           HB       THR 137   3.862   2.742 -10.689
  992    HG1  THR 137           HG1      THR 137   2.688   1.537 -12.027
  993   1HG2  THR 137          HG21      THR 137   5.346   0.926 -11.415
  994   2HG2  THR 137          HG22      THR 137   4.829  -0.049 -10.040
  995   3HG2  THR 137          HG23      THR 137   5.731   1.442  -9.774
  996    H    THR 138           HN       THR 138   3.893   1.580  -6.474
  997    HA   THR 138           HA       THR 138   5.062   4.244  -6.310
  998    HB   THR 138           HB       THR 138   4.888   2.129  -4.150
  999    HG1  THR 138           HG1      THR 138   2.803   2.748  -4.852
 1000   1HG2  THR 138          HG21      THR 138   5.211   4.002  -2.617
 1001   2HG2  THR 138          HG22      THR 138   5.309   5.118  -3.978
 1002   3HG2  THR 138          HG23      THR 138   6.560   3.896  -3.749
 1003    H    LYS 139           HN       LYS 139   7.048   4.408  -7.134
 1004    HA   LYS 139           HA       LYS 139   8.886   2.143  -6.796
 1005   1HB   LYS 139          HB2       LYS 139   8.303   3.141  -9.103
 1006   2HB   LYS 139          HB1       LYS 139   9.309   4.498  -8.625
 1007   1HG   LYS 139          HG2       LYS 139  11.247   3.181  -8.555
 1008   2HG   LYS 139          HG1       LYS 139  10.324   1.676  -8.566
 1009   1HD   LYS 139          HD2       LYS 139  10.514   3.652 -10.847
 1010   2HD   LYS 139          HD1       LYS 139  11.359   2.104 -10.745
 1011   1HE   LYS 139          HE2       LYS 139   9.158   0.969 -10.624
 1012   2HE   LYS 139          HE1       LYS 139   8.374   2.529 -10.859
 1013   1HZ   LYS 139          HZ1       LYS 139  10.147   1.116 -12.776
 1014   2HZ   LYS 139          HZ2       LYS 139   9.585   2.701 -12.995
 1015   3HZ   LYS 139          HZ3       LYS 139   8.484   1.415 -12.942
 1016    H    LEU 140           HN       LEU 140  10.045   2.280  -5.124
 1017    HA   LEU 140           HA       LEU 140  10.891   4.900  -4.121
 1018   1HB   LEU 140          HB2       LEU 140   9.615   3.790  -2.483
 1019   2HB   LEU 140          HB1       LEU 140  10.358   2.241  -2.817
 1020    HG   LEU 140           HG       LEU 140  12.447   3.046  -1.824
 1021   1HD1  LEU 140          HD11      LEU 140  12.440   5.127  -0.512
 1022   2HD1  LEU 140          HD12      LEU 140  10.835   5.504  -1.139
 1023   3HD1  LEU 140          HD13      LEU 140  12.216   5.429  -2.235
 1024   1HD2  LEU 140          HD21      LEU 140  10.880   1.804  -0.465
 1025   2HD2  LEU 140          HD22      LEU 140  10.017   3.288  -0.060
 1026   3HD2  LEU 140          HD23      LEU 140  11.669   3.047   0.507
 1027    H    THR 141           HN       THR 141  12.822   5.360  -4.936
 1028    HA   THR 141           HA       THR 141  14.822   3.197  -5.137
 1029    HB   THR 141           HB       THR 141  14.749   5.704  -6.820
 1030    HG1  THR 141           HG1      THR 141  13.696   3.118  -7.461
 1031   1HG2  THR 141          HG21      THR 141  16.901   4.575  -6.727
 1032   2HG2  THR 141          HG22      THR 141  16.179   4.372  -8.322
 1033   3HG2  THR 141          HG23      THR 141  16.144   3.046  -7.161
 1034    H    VAL 142           HN       VAL 142  16.778   3.536  -4.154
 1035    HA   VAL 142           HA       VAL 142  17.280   6.140  -2.918
 1036    HB   VAL 142           HB       VAL 142  19.037   3.688  -2.860
 1037   1HG1  VAL 142          HG11      VAL 142  19.020   6.151  -1.133
 1038   2HG1  VAL 142          HG12      VAL 142  20.219   5.749  -2.361
 1039   3HG1  VAL 142          HG13      VAL 142  20.070   4.752  -0.914
 1040   1HG2  VAL 142          HG21      VAL 142  16.895   3.146  -1.861
 1041   2HG2  VAL 142          HG22      VAL 142  16.999   4.578  -0.835
 1042   3HG2  VAL 142          HG23      VAL 142  18.145   3.255  -0.622
 1043    H    THR 143           HN       THR 143  18.139   7.634  -4.196
 1044    HA   THR 143           HA       THR 143  19.508   8.700  -5.658
 1045    HB   THR 143           HB       THR 143  21.009   6.098  -6.008
 1046    HG1  THR 143           HG1      THR 143  21.830   6.439  -4.096
 1047   1HG2  THR 143          HG21      THR 143  22.879   7.603  -6.609
 1048   2HG2  THR 143          HG22      THR 143  21.779   8.978  -6.497
 1049   3HG2  THR 143          HG23      THR 143  21.518   7.735  -7.722
  Start of MODEL    6
    1    H    GLU   1           H        GLU   1 -20.758   2.072  -6.626
    2    HA   GLU   1           HA       GLU   1 -21.096  -0.108  -4.649
    3   1HB   GLU   1          HB2       GLU   1 -22.733   0.347  -6.717
    4   2HB   GLU   1          HB1       GLU   1 -21.444  -0.462  -7.594
    5   1HG   GLU   1          HG2       GLU   1 -22.973  -1.588  -5.258
    6   2HG   GLU   1          HG1       GLU   1 -23.203  -2.008  -6.953
    7    H    GLU   2           HN       GLU   2 -19.707   0.616  -7.851
    8    HA   GLU   2           HA       GLU   2 -17.384  -1.026  -7.219
    9   1HB   GLU   2          HB2       GLU   2 -18.490  -1.233  -9.423
   10   2HB   GLU   2          HB1       GLU   2 -18.118   0.452  -9.747
   11   1HG   GLU   2          HG2       GLU   2 -15.781   0.009  -9.798
   12   2HG   GLU   2          HG1       GLU   2 -16.027  -1.644  -9.236
   13    H    CYS   3           HN       CYS   3 -15.702  -0.123  -6.278
   14    HA   CYS   3           HA       CYS   3 -15.498   2.776  -6.202
   15   1HB   CYS   3          HB2       CYS   3 -14.350   0.548  -4.563
   16   2HB   CYS   3          HB1       CYS   3 -13.605   2.141  -4.520
   17    H    GLN   4           HN       GLN   4 -14.408   3.669  -7.828
   18    HA   GLN   4           HA       GLN   4 -12.063   2.363  -8.930
   19   1HB   GLN   4          HB2       GLN   4 -13.594   3.574 -10.439
   20   2HB   GLN   4          HB1       GLN   4 -13.286   5.063  -9.552
   21   1HG   GLN   4          HG2       GLN   4 -10.897   4.862 -10.154
   22   2HG   GLN   4          HG1       GLN   4 -11.304   3.475 -11.159
   23   1HE2  GLN   4          HE21      GLN   4 -12.511   3.798 -13.040
   24   2HE2  GLN   4          HE22      GLN   4 -12.625   5.355 -13.786
   25    H    VAL   5           HN       VAL   5 -10.255   2.490  -7.769
   26    HA   VAL   5           HA       VAL   5  -9.791   4.692  -5.973
   27    HB   VAL   5           HB       VAL   5  -7.692   3.576  -5.402
   28   1HG1  VAL   5          HG11      VAL   5  -9.751   2.850  -4.307
   29   2HG1  VAL   5          HG12      VAL   5  -8.617   1.510  -4.490
   30   3HG1  VAL   5          HG13      VAL   5 -10.004   1.645  -5.573
   31   1HG2  VAL   5          HG21      VAL   5  -7.091   1.426  -6.433
   32   2HG2  VAL   5          HG22      VAL   5  -7.059   2.748  -7.600
   33   3HG2  VAL   5          HG23      VAL   5  -8.413   1.619  -7.585
   34    H    ARG   6           HN       ARG   6  -8.501   6.416  -6.274
   35    HA   ARG   6           HA       ARG   6  -7.222   6.688  -8.886
   36   1HB   ARG   6          HB2       ARG   6  -7.734   8.714  -6.706
   37   2HB   ARG   6          HB1       ARG   6  -6.876   9.065  -8.200
   38   1HG   ARG   6          HG2       ARG   6  -9.725   8.095  -8.045
   39   2HG   ARG   6          HG1       ARG   6  -9.239   9.781  -8.220
   40   1HD   ARG   6          HD2       ARG   6  -9.784   8.983 -10.390
   41   2HD   ARG   6          HD1       ARG   6  -8.029   9.118 -10.316
   42    HE   ARG   6           HE       ARG   6  -8.986   6.497  -9.659
   43   1HH1  ARG   6          HH11      ARG   6  -8.111   8.636 -12.289
   44   2HH1  ARG   6          HH12      ARG   6  -7.780   7.337 -13.398
   45   1HH2  ARG   6          HH21      ARG   6  -8.520   4.795 -11.111
   46   2HH2  ARG   6          HH22      ARG   6  -8.008   5.163 -12.733
   47    H    VAL   7           HN       VAL   7  -5.420   5.481  -8.738
   48    HA   VAL   7           HA       VAL   7  -3.432   6.355  -6.756
   49    HB   VAL   7           HB       VAL   7  -4.123   3.960  -6.530
   50   1HG1  VAL   7          HG11      VAL   7  -4.577   3.453  -8.853
   51   2HG1  VAL   7          HG12      VAL   7  -3.378   2.339  -8.197
   52   3HG1  VAL   7          HG13      VAL   7  -2.871   3.661  -9.249
   53   1HG2  VAL   7          HG21      VAL   7  -1.939   4.671  -5.749
   54   2HG2  VAL   7          HG22      VAL   7  -1.264   4.429  -7.360
   55   3HG2  VAL   7          HG23      VAL   7  -1.844   3.047  -6.431
   56    H    GLY   8           HN       GLY   8  -1.419   6.934  -7.519
   57   1HA   GLY   8          HA2       GLY   8  -1.152   6.979 -10.452
   58   2HA   GLY   8          HA1       GLY   8  -0.768   8.380  -9.459
   59    H    ASP   9           HN       ASP   9   0.741   6.364 -11.269
   60    HA   ASP   9           HA       ASP   9   2.711   5.160  -9.623
   61   1HB   ASP   9          HB2       ASP   9   2.898   6.008 -12.522
   62   2HB   ASP   9          HB1       ASP   9   4.015   4.925 -11.701
   63    H    LEU  10           HN       LEU  10   3.908   6.349  -8.289
   64    HA   LEU  10           HA       LEU  10   5.000   8.874  -9.311
   65   1HB   LEU  10          HB2       LEU  10   5.046   9.652  -6.950
   66   2HB   LEU  10          HB1       LEU  10   3.441   9.393  -7.597
   67    HG   LEU  10           HG       LEU  10   3.657   7.059  -6.412
   68   1HD1  LEU  10          HD11      LEU  10   4.929   7.165  -4.341
   69   2HD1  LEU  10          HD12      LEU  10   5.562   8.746  -4.797
   70   3HD1  LEU  10          HD13      LEU  10   5.989   7.319  -5.743
   71   1HD2  LEU  10          HD21      LEU  10   2.000   8.780  -5.905
   72   2HD2  LEU  10          HD22      LEU  10   3.174   9.620  -4.893
   73   3HD2  LEU  10          HD23      LEU  10   2.603   8.015  -4.437
   74    H    THR  11           HN       THR  11   7.107   9.465  -8.664
   75    HA   THR  11           HA       THR  11   8.760   7.167  -7.831
   76    HB   THR  11           HB       THR  11   9.595   9.355  -9.749
   77    HG1  THR  11           HG1      THR  11   7.959   7.932 -10.622
   78   1HG2  THR  11          HG21      THR  11  11.438   8.301  -8.511
   79   2HG2  THR  11          HG22      THR  11  11.489   7.880 -10.222
   80   3HG2  THR  11          HG23      THR  11  10.885   6.714  -9.045
   81    H    VAL  12           HN       VAL  12   9.877   7.501  -6.024
   82    HA   VAL  12           HA       VAL  12  10.546  10.268  -5.250
   83    HB   VAL  12           HB       VAL  12   9.620   8.133  -3.319
   84   1HG1  VAL  12          HG11      VAL  12  11.156   9.696  -2.313
   85   2HG1  VAL  12          HG12      VAL  12   9.524   9.982  -1.706
   86   3HG1  VAL  12          HG13      VAL  12  10.212  11.057  -2.921
   87   1HG2  VAL  12          HG21      VAL  12   8.105  10.545  -4.311
   88   2HG2  VAL  12          HG22      VAL  12   7.562   9.417  -3.069
   89   3HG2  VAL  12          HG23      VAL  12   7.762   8.869  -4.734
   90    H    ALA  13           HN       ALA  13  12.597  10.555  -4.570
   91    HA   ALA  13           HA       ALA  13  14.256   8.158  -4.219
   92   1HB   ALA  13          HB1       ALA  13  16.172   9.598  -4.630
   93   2HB   ALA  13          HB2       ALA  13  15.116  11.010  -4.708
   94   3HB   ALA  13          HB3       ALA  13  14.995   9.748  -5.934
   95    H    LYS  14           HN       LYS  14  13.962   7.586  -2.120
   96    HA   LYS  14           HA       LYS  14  14.995   9.401  -0.080
   97   1HB   LYS  14          HB2       LYS  14  12.277   8.075   0.074
   98   2HB   LYS  14          HB1       LYS  14  13.099   8.772   1.458
   99   1HG   LYS  14          HG2       LYS  14  12.360  10.337  -1.001
  100   2HG   LYS  14          HG1       LYS  14  11.336  10.207   0.429
  101   1HD   LYS  14          HD2       LYS  14  13.134  11.182   1.789
  102   2HD   LYS  14          HD1       LYS  14  14.133  11.335   0.340
  103   1HE   LYS  14          HE2       LYS  14  13.094  13.461   0.830
  104   2HE   LYS  14          HE1       LYS  14  12.414  12.797  -0.656
  105   1HZ   LYS  14          HZ1       LYS  14  11.120  12.581   2.015
  106   2HZ   LYS  14          HZ2       LYS  14  10.459  12.117   0.524
  107   3HZ   LYS  14          HZ3       LYS  14  10.732  13.757   0.855
  108    H    THR  15           HN       THR  15  15.427   8.258   1.968
  109    HA   THR  15           HA       THR  15  16.316   5.530   1.452
  110    HB   THR  15           HB       THR  15  17.382   5.762   3.728
  111    HG1  THR  15           HG1      THR  15  17.359   8.439   3.853
  112   1HG2  THR  15          HG21      THR  15  18.646   6.185   1.680
  113   2HG2  THR  15          HG22      THR  15  19.150   7.278   2.969
  114   3HG2  THR  15          HG23      THR  15  18.097   7.861   1.681
  115    H    ARG  16           HN       ARG  16  15.708   3.751   2.769
  116    HA   ARG  16           HA       ARG  16  13.037   3.973   3.866
  117   1HB   ARG  16          HB2       ARG  16  14.882   1.580   3.670
  118   2HB   ARG  16          HB1       ARG  16  13.226   1.519   4.270
  119   1HG   ARG  16          HG2       ARG  16  12.620   1.081   2.182
  120   2HG   ARG  16          HG1       ARG  16  12.981   2.768   1.823
  121   1HD   ARG  16          HD2       ARG  16  14.190   1.622   0.214
  122   2HD   ARG  16          HD1       ARG  16  15.394   1.944   1.458
  123    HE   ARG  16           HE       ARG  16  14.106  -0.652   0.931
  124   1HH1  ARG  16          HH11      ARG  16  16.679   1.246   2.362
  125   2HH1  ARG  16          HH12      ARG  16  17.659  -0.135   2.741
  126   1HH2  ARG  16          HH21      ARG  16  15.380  -2.495   1.516
  127   2HH2  ARG  16          HH22      ARG  16  16.915  -2.247   2.277
  128    H    GLY  17           HN       GLY  17  15.995   4.676   5.006
  129   1HA   GLY  17          HA2       GLY  17  15.615   3.800   7.744
  130   2HA   GLY  17          HA1       GLY  17  16.910   4.829   7.141
  131    H    GLN  18           HN       GLN  18  14.917   6.529   5.748
  132    HA   GLN  18           HA       GLN  18  14.338   8.502   7.621
  133   1HB   GLN  18          HB2       GLN  18  14.314   8.940   5.237
  134   2HB   GLN  18          HB1       GLN  18  13.004   7.797   4.994
  135   1HG   GLN  18          HG2       GLN  18  12.270  10.125   4.857
  136   2HG   GLN  18          HG1       GLN  18  11.470   9.240   6.152
  137   1HE2  GLN  18          HE21      GLN  18  10.940  11.193   7.152
  138   2HE2  GLN  18          HE22      GLN  18  12.112  12.098   8.054
  139    H    LEU  19           HN       LEU  19  12.671   5.616   6.711
  140    HA   LEU  19           HA       LEU  19  10.325   6.251   8.292
  141   1HB   LEU  19          HB2       LEU  19  10.872   3.574   7.075
  142   2HB   LEU  19          HB1       LEU  19   9.334   4.369   7.353
  143    HG   LEU  19           HG       LEU  19  11.339   5.095   5.217
  144   1HD1  LEU  19          HD11      LEU  19   9.641   4.257   3.674
  145   2HD1  LEU  19          HD12      LEU  19   8.631   3.782   5.040
  146   3HD1  LEU  19          HD13      LEU  19  10.185   2.995   4.779
  147   1HD2  LEU  19          HD21      LEU  19   8.622   6.235   5.849
  148   2HD2  LEU  19          HD22      LEU  19   9.565   6.598   4.404
  149   3HD2  LEU  19          HD23      LEU  19  10.172   7.064   5.992
  150    H    THR  20           HN       THR  20  10.529   6.022  10.413
  151    HA   THR  20           HA       THR  20  12.091   3.771  11.466
  152    HB   THR  20           HB       THR  20  11.197   6.215  13.014
  153    HG1  THR  20           HG1      THR  20  12.907   6.229  11.067
  154   1HG2  THR  20          HG21      THR  20  13.358   4.166  13.531
  155   2HG2  THR  20          HG22      THR  20  11.792   4.229  14.339
  156   3HG2  THR  20          HG23      THR  20  12.955   5.535  14.568
  157    H    ASP  21           HN       ASP  21  10.332   2.425  10.930
  158    HA   ASP  21           HA       ASP  21   8.398   1.311  11.151
  159   1HB   ASP  21          HB2       ASP  21   9.066   1.079  13.528
  160   2HB   ASP  21          HB1       ASP  21   8.191   2.565  13.896
  161    H    ALA  22           HN       ALA  22   7.088   3.824  13.230
  162    HA   ALA  22           HA       ALA  22   5.054   4.320  11.236
  163   1HB   ALA  22          HB1       ALA  22   5.352   5.537  13.980
  164   2HB   ALA  22          HB2       ALA  22   4.449   4.069  13.607
  165   3HB   ALA  22          HB3       ALA  22   3.929   5.615  12.941
  166    H    ALA  23           HN       ALA  23   6.696   5.182   9.757
  167    HA   ALA  23           HA       ALA  23   6.466   8.074   9.772
  168   1HB   ALA  23          HB1       ALA  23   8.653   7.718  10.847
  169   2HB   ALA  23          HB2       ALA  23   8.823   8.464   9.256
  170   3HB   ALA  23          HB3       ALA  23   9.168   6.747   9.467
  171    HA   PRO  24           HA       PRO  24   5.763   6.646   5.590
  172   1HB   PRO  24          HB2       PRO  24   4.282   8.679   4.764
  173   2HB   PRO  24          HB1       PRO  24   3.683   7.597   6.031
  174   1HG   PRO  24          HG2       PRO  24   4.897  10.323   6.296
  175   2HG   PRO  24          HG1       PRO  24   3.495   9.638   7.138
  176   1HD   PRO  24          HD2       PRO  24   6.076   9.755   8.170
  177   2HD   PRO  24          HD1       PRO  24   4.800   8.664   8.732
  178    H    ILE  25           HN       ILE  25   6.570   7.025   3.573
  179    HA   ILE  25           HA       ILE  25   8.500   9.205   3.264
  180    HB   ILE  25           HB       ILE  25   8.566   7.721   0.925
  181   1HG1  ILE  25          HG12      ILE  25   8.371   5.837   3.269
  182   2HG1  ILE  25          HG11      ILE  25   7.099   6.058   2.085
  183   1HG2  ILE  25          HG21      ILE  25  10.278   7.442   3.390
  184   2HG2  ILE  25          HG22      ILE  25  10.482   8.635   2.108
  185   3HG2  ILE  25          HG23      ILE  25  10.720   6.922   1.764
  186   1HD1  ILE  25          HD11      ILE  25   9.874   5.035   1.515
  187   2HD1  ILE  25          HD12      ILE  25   8.585   5.243   0.326
  188   3HD1  ILE  25          HD13      ILE  25   8.408   4.059   1.624
  189    H    GLY  26           HN       GLY  26   6.101   7.609   1.168
  190   1HA   GLY  26          HA2       GLY  26   5.511  10.267   0.038
  191   2HA   GLY  26          HA1       GLY  26   5.605   8.810  -0.943
  192    HA   PRO  27           HA       PRO  27   1.377   8.815   1.753
  193   1HB   PRO  27          HB2       PRO  27   0.811  11.585   1.877
  194   2HB   PRO  27          HB1       PRO  27   1.140  10.509   3.237
  195   1HG   PRO  27          HG2       PRO  27   2.984  12.348   1.785
  196   2HG   PRO  27          HG1       PRO  27   2.953  11.908   3.505
  197   1HD   PRO  27          HD2       PRO  27   4.809  10.870   1.898
  198   2HD   PRO  27          HD1       PRO  27   4.011   9.863   3.124
  199    H    VAL  28           HN       VAL  28   0.320   8.146   0.022
  200    HA   VAL  28           HA       VAL  28   0.197   9.709  -2.420
  201    HB   VAL  28           HB       VAL  28  -1.140   7.064  -1.798
  202   1HG1  VAL  28          HG11      VAL  28  -0.448   8.377  -4.427
  203   2HG1  VAL  28          HG12      VAL  28  -2.064   8.199  -3.742
  204   3HG1  VAL  28          HG13      VAL  28  -1.151   6.772  -4.233
  205   1HG2  VAL  28          HG21      VAL  28   1.558   7.552  -3.060
  206   2HG2  VAL  28          HG22      VAL  28   0.760   5.988  -2.901
  207   3HG2  VAL  28          HG23      VAL  28   1.270   6.869  -1.460
  208    H    THR  29           HN       THR  29  -1.511  10.904  -3.057
  209    HA   THR  29           HA       THR  29  -3.759  11.241  -1.299
  210    HB   THR  29           HB       THR  29  -4.608  12.764  -3.120
  211    HG1  THR  29           HG1      THR  29  -3.406  11.647  -4.823
  212   1HG2  THR  29          HG21      THR  29  -2.882  14.486  -2.751
  213   2HG2  THR  29          HG22      THR  29  -1.804  13.251  -2.103
  214   3HG2  THR  29          HG23      THR  29  -3.305  13.641  -1.263
  215    H    VAL  30           HN       VAL  30  -4.527   9.037  -1.315
  216    HA   VAL  30           HA       VAL  30  -5.554   7.937  -3.786
  217    HB   VAL  30           HB       VAL  30  -5.958   6.915  -0.977
  218   1HG1  VAL  30          HG11      VAL  30  -6.211   5.537  -3.649
  219   2HG1  VAL  30          HG12      VAL  30  -7.539   6.006  -2.585
  220   3HG1  VAL  30          HG13      VAL  30  -6.393   4.767  -2.072
  221   1HG2  VAL  30          HG21      VAL  30  -3.816   6.193  -2.979
  222   2HG2  VAL  30          HG22      VAL  30  -4.093   5.381  -1.438
  223   3HG2  VAL  30          HG23      VAL  30  -3.576   7.066  -1.467
  224    H    GLN  31           HN       GLN  31  -7.358   8.615  -4.572
  225    HA   GLN  31           HA       GLN  31  -9.542   9.439  -2.802
  226   1HB   GLN  31          HB2       GLN  31  -8.801  11.240  -4.217
  227   2HB   GLN  31          HB1       GLN  31  -8.881  10.219  -5.644
  228   1HG   GLN  31          HG2       GLN  31 -11.294  10.127  -5.482
  229   2HG   GLN  31          HG1       GLN  31 -11.248  11.068  -3.991
  230   1HE2  GLN  31          HE21      GLN  31  -9.075  11.758  -6.605
  231   2HE2  GLN  31          HE22      GLN  31  -9.812  13.250  -7.092
  232    H    ALA  32           HN       ALA  32 -11.460   8.425  -2.932
  233    HA   ALA  32           HA       ALA  32 -11.622   6.115  -4.739
  234   1HB   ALA  32          HB1       ALA  32 -11.709   5.594  -2.350
  235   2HB   ALA  32          HB2       ALA  32 -13.229   5.191  -3.149
  236   3HB   ALA  32          HB3       ALA  32 -13.108   6.652  -2.169
  237    H    LEU  33           HN       LEU  33 -13.016   6.181  -6.368
  238    HA   LEU  33           HA       LEU  33 -15.145   8.214  -6.288
  239   1HB   LEU  33          HB2       LEU  33 -13.789   6.983  -8.688
  240   2HB   LEU  33          HB1       LEU  33 -15.034   8.214  -8.736
  241    HG   LEU  33           HG       LEU  33 -12.268   8.569  -7.576
  242   1HD1  LEU  33          HD11      LEU  33 -13.500   9.633 -10.112
  243   2HD1  LEU  33          HD12      LEU  33 -12.258   8.388 -10.006
  244   3HD1  LEU  33          HD13      LEU  33 -11.900  10.035  -9.491
  245   1HD2  LEU  33          HD21      LEU  33 -14.504  10.555  -7.970
  246   2HD2  LEU  33          HD22      LEU  33 -12.873  10.934  -7.419
  247   3HD2  LEU  33          HD23      LEU  33 -13.930   9.934  -6.423
  248    H    GLY  34           HN       GLY  34 -17.151   7.484  -6.156
  249   1HA   GLY  34          HA2       GLY  34 -18.984   6.226  -7.004
  250   2HA   GLY  34          HA1       GLY  34 -17.854   4.982  -7.523
  251    H    CYS  35           HN       CYS  35 -17.739   6.459  -4.369
  252    HA   CYS  35           HA       CYS  35 -18.562   3.874  -3.219
  253   1HB   CYS  35          HB2       CYS  35 -16.525   5.753  -2.030
  254   2HB   CYS  35          HB1       CYS  35 -16.889   4.106  -1.527
  255    H    ASN  36           HN       ASN  36 -20.674   4.521  -2.784
  256    HA   ASN  36           HA       ASN  36 -20.993   6.738  -0.890
  257   1HB   ASN  36          HB2       ASN  36 -23.102   5.019  -2.224
  258   2HB   ASN  36          HB1       ASN  36 -23.412   6.426  -1.212
  259   1HD2  ASN  36          HD21      ASN  36 -22.968   8.492  -2.025
  260   2HD2  ASN  36          HD22      ASN  36 -22.758   8.770  -3.720
  261    H    ALA  37           HN       ALA  37 -20.789   3.331  -1.077
  262    HA   ALA  37           HA       ALA  37 -20.689   3.079   1.754
  263   1HB   ALA  37          HB1       ALA  37 -22.570   1.591   2.097
  264   2HB   ALA  37          HB2       ALA  37 -23.035   1.749   0.402
  265   3HB   ALA  37          HB3       ALA  37 -23.131   3.143   1.478
  266    H    ARG  38           HN       ARG  38 -18.609   2.370   0.625
  267    HA   ARG  38           HA       ARG  38 -18.637  -0.534   0.625
  268   1HB   ARG  38          HB2       ARG  38 -18.832   0.585  -1.787
  269   2HB   ARG  38          HB1       ARG  38 -17.094   0.752  -1.575
  270   1HG   ARG  38          HG2       ARG  38 -17.606  -1.279  -2.786
  271   2HG   ARG  38          HG1       ARG  38 -16.919  -1.668  -1.206
  272   1HD   ARG  38          HD2       ARG  38 -19.148  -2.076  -0.321
  273   2HD   ARG  38          HD1       ARG  38 -19.860  -1.642  -1.874
  274    HE   ARG  38           HE       ARG  38 -18.528  -3.620  -2.750
  275   1HH1  ARG  38          HH11      ARG  38 -19.736  -3.400   0.524
  276   2HH1  ARG  38          HH12      ARG  38 -19.933  -5.119   0.709
  277   1HH2  ARG  38          HH21      ARG  38 -18.807  -5.899  -2.529
  278   2HH2  ARG  38          HH22      ARG  38 -19.413  -6.533  -1.031
  279    H    GLN  39           HN       GLN  39 -16.664  -1.421   1.312
  280    HA   GLN  39           HA       GLN  39 -14.777   0.405   2.480
  281   1HB   GLN  39          HB2       GLN  39 -14.418  -2.580   2.137
  282   2HB   GLN  39          HB1       GLN  39 -13.599  -1.531   3.284
  283   1HG   GLN  39          HG2       GLN  39 -15.124  -2.519   4.653
  284   2HG   GLN  39          HG1       GLN  39 -16.035  -1.095   4.151
  285   1HE2  GLN  39          HE21      GLN  39 -15.695  -4.526   3.862
  286   2HE2  GLN  39          HE22      GLN  39 -17.211  -4.826   3.084
  287    H    VAL  40           HN       VAL  40 -12.907   1.093   1.626
  288    HA   VAL  40           HA       VAL  40 -12.163   0.113  -1.040
  289    HB   VAL  40           HB       VAL  40 -11.415   2.689   0.365
  290   1HG1  VAL  40          HG11      VAL  40  -9.588   1.907  -1.054
  291   2HG1  VAL  40          HG12      VAL  40 -10.355   3.337  -1.746
  292   3HG1  VAL  40          HG13      VAL  40 -10.703   1.741  -2.411
  293   1HG2  VAL  40          HG21      VAL  40 -13.190   2.170  -2.016
  294   2HG2  VAL  40          HG22      VAL  40 -12.749   3.759  -1.393
  295   3HG2  VAL  40          HG23      VAL  40 -13.719   2.664  -0.407
  296    H    ALA  41           HN       ALA  41 -10.423  -1.170  -1.170
  297    HA   ALA  41           HA       ALA  41  -8.632  -1.239   1.149
  298   1HB   ALA  41          HB1       ALA  41  -8.313  -3.593   0.747
  299   2HB   ALA  41          HB2       ALA  41  -9.305  -3.512  -0.706
  300   3HB   ALA  41          HB3       ALA  41 -10.037  -3.249   0.874
  301    H    LEU  42           HN       LEU  42  -6.475  -1.260   0.844
  302    HA   LEU  42           HA       LEU  42  -5.530  -0.847  -1.898
  303   1HB   LEU  42          HB2       LEU  42  -4.074  -0.382   0.706
  304   2HB   LEU  42          HB1       LEU  42  -3.516   0.068  -0.892
  305    HG   LEU  42           HG       LEU  42  -5.918   1.226   0.512
  306   1HD1  LEU  42          HD11      LEU  42  -3.226   2.435  -0.094
  307   2HD1  LEU  42          HD12      LEU  42  -3.792   1.926   1.496
  308   3HD1  LEU  42          HD13      LEU  42  -4.592   3.257   0.662
  309   1HD2  LEU  42          HD21      LEU  42  -6.235   1.173  -1.895
  310   2HD2  LEU  42          HD22      LEU  42  -4.656   1.921  -2.136
  311   3HD2  LEU  42          HD23      LEU  42  -5.949   2.826  -1.349
  312    H    LYS  43           HN       LYS  43  -4.781  -2.547  -2.880
  313    HA   LYS  43           HA       LYS  43  -3.479  -4.681  -1.323
  314   1HB   LYS  43          HB2       LYS  43  -5.132  -4.738  -3.831
  315   2HB   LYS  43          HB1       LYS  43  -3.934  -5.986  -3.550
  316   1HG   LYS  43          HG2       LYS  43  -6.078  -6.790  -2.867
  317   2HG   LYS  43          HG1       LYS  43  -5.077  -6.557  -1.438
  318   1HD   LYS  43          HD2       LYS  43  -7.439  -5.804  -1.189
  319   2HD   LYS  43          HD1       LYS  43  -6.233  -4.560  -0.860
  320   1HE   LYS  43          HE2       LYS  43  -8.137  -3.732  -2.178
  321   2HE   LYS  43          HE1       LYS  43  -6.601  -3.570  -3.020
  322   1HZ   LYS  43          HZ1       LYS  43  -8.644  -5.669  -3.495
  323   2HZ   LYS  43          HZ2       LYS  43  -7.154  -5.565  -4.287
  324   3HZ   LYS  43          HZ3       LYS  43  -8.313  -4.353  -4.504
  325    H    ALA  44           HN       ALA  44  -1.523  -5.526  -2.155
  326    HA   ALA  44           HA       ALA  44  -0.181  -3.825  -4.106
  327   1HB   ALA  44          HB1       ALA  44   1.065  -4.483  -2.102
  328   2HB   ALA  44          HB2       ALA  44   1.824  -5.110  -3.565
  329   3HB   ALA  44          HB3       ALA  44   0.869  -6.180  -2.538
  330    H    ASP  45           HN       ASP  45   0.759  -4.721  -6.030
  331    HA   ASP  45           HA       ASP  45  -0.857  -6.775  -7.233
  332   1HB   ASP  45          HB2       ASP  45   0.173  -4.776  -8.452
  333   2HB   ASP  45          HB1       ASP  45   1.709  -5.636  -8.354
  334    H    THR  46           HN       THR  46   0.248  -8.753  -8.253
  335    HA   THR  46           HA       THR  46   1.045 -10.280  -6.078
  336    HB   THR  46           HB       THR  46   1.705 -11.892  -8.047
  337    HG1  THR  46           HG1      THR  46   0.104 -11.186  -9.796
  338   1HG2  THR  46          HG21      THR  46  -0.650 -12.573  -8.164
  339   2HG2  THR  46          HG22      THR  46  -1.118 -11.044  -7.419
  340   3HG2  THR  46          HG23      THR  46  -0.163 -12.215  -6.507
  341    H    ASP  47           HN       ASP  47   3.021  -8.449  -8.256
  342    HA   ASP  47           HA       ASP  47   5.467  -9.831  -7.832
  343   1HB   ASP  47          HB2       ASP  47   4.891  -6.965  -8.605
  344   2HB   ASP  47          HB1       ASP  47   6.518  -7.625  -8.499
  345    H    ASN  48           HN       ASN  48   3.719  -7.429  -6.015
  346    HA   ASN  48           HA       ASN  48   5.913  -7.267  -4.054
  347   1HB   ASN  48          HB2       ASN  48   5.311  -5.108  -5.242
  348   2HB   ASN  48          HB1       ASN  48   3.711  -5.236  -4.516
  349   1HD2  ASN  48          HD21      ASN  48   3.795  -3.467  -3.244
  350   2HD2  ASN  48          HD22      ASN  48   4.918  -3.266  -1.939
  351    H    PHE  49           HN       PHE  49   3.407  -9.037  -4.478
  352    HA   PHE  49           HA       PHE  49   2.297  -8.730  -1.763
  353   1HB   PHE  49          HB2       PHE  49   0.787  -7.831  -3.545
  354   2HB   PHE  49          HB1       PHE  49   0.748  -9.426  -4.266
  355    HD1  PHE  49           HD1      PHE  49  -0.078  -7.620  -1.110
  356    HD2  PHE  49           HD2      PHE  49  -0.916 -10.898  -3.694
  357    HE1  PHE  49           HE1      PHE  49  -2.113  -8.116   0.177
  358    HE2  PHE  49           HE2      PHE  49  -2.945 -11.404  -2.401
  359    HZ   PHE  49           HZ       PHE  49  -3.560  -9.998  -0.475
  360    H    GLU  50           HN       GLU  50   3.284 -10.460  -0.825
  361    HA   GLU  50           HA       GLU  50   3.155 -13.032  -2.233
  362   1HB   GLU  50          HB2       GLU  50   4.750 -12.218   0.207
  363   2HB   GLU  50          HB1       GLU  50   4.746 -13.830  -0.493
  364   1HG   GLU  50          HG2       GLU  50   5.564 -12.779  -2.628
  365   2HG   GLU  50          HG1       GLU  50   5.797 -11.296  -1.706
  366    H    GLN  51           HN       GLN  51   1.231 -13.900  -1.893
  367    HA   GLN  51           HA       GLN  51  -0.380 -15.104  -0.839
  368   1HB   GLN  51          HB2       GLN  51   1.187 -14.637   1.700
  369   2HB   GLN  51          HB1       GLN  51  -0.098 -15.813   1.474
  370   1HG   GLN  51          HG2       GLN  51   1.229 -17.127   0.031
  371   2HG   GLN  51          HG1       GLN  51   2.443 -15.857  -0.125
  372   1HE2  GLN  51          HE21      GLN  51   4.111 -17.145   0.587
  373   2HE2  GLN  51          HE22      GLN  51   4.270 -17.641   2.241
  374    H    GLY  52           HN       GLY  52   0.647 -12.471   1.302
  375   1HA   GLY  52          HA2       GLY  52  -1.683 -10.937   1.008
  376   2HA   GLY  52          HA1       GLY  52  -1.870 -11.966   2.427
  377    H    LYS  53           HN       LYS  53   1.115 -10.580   1.202
  378    HA   LYS  53           HA       LYS  53   1.154  -8.606   3.367
  379   1HB   LYS  53          HB2       LYS  53   3.568 -10.269   2.660
  380   2HB   LYS  53          HB1       LYS  53   3.418  -9.137   3.977
  381   1HG   LYS  53          HG2       LYS  53   1.867 -11.710   3.803
  382   2HG   LYS  53          HG1       LYS  53   3.415 -11.546   4.631
  383   1HD   LYS  53          HD2       LYS  53   2.357  -9.727   6.016
  384   2HD   LYS  53          HD1       LYS  53   0.811 -10.186   5.298
  385   1HE   LYS  53          HE2       LYS  53   2.622 -12.054   6.824
  386   2HE   LYS  53          HE1       LYS  53   1.223 -11.230   7.509
  387   1HZ   LYS  53          HZ1       LYS  53   0.795 -13.548   6.800
  388   2HZ   LYS  53          HZ2       LYS  53   1.084 -13.084   5.194
  389   3HZ   LYS  53          HZ3       LYS  53  -0.217 -12.411   6.053
  390    H    PHE  54           HN       PHE  54   1.860  -6.649   2.601
  391    HA   PHE  54           HA       PHE  54   3.295  -6.709   0.049
  392   1HB   PHE  54          HB2       PHE  54   2.514  -4.288  -0.196
  393   2HB   PHE  54          HB1       PHE  54   1.355  -5.573  -0.468
  394    HD1  PHE  54           HD1      PHE  54  -0.745  -4.715   0.059
  395    HD2  PHE  54           HD2      PHE  54   2.541  -3.975   2.659
  396    HE1  PHE  54           HE1      PHE  54  -2.262  -3.672   1.688
  397    HE2  PHE  54           HE2      PHE  54   1.025  -2.920   4.289
  398    HZ   PHE  54           HZ       PHE  54  -1.480  -2.704   3.660
  399    H    PHE  55           HN       PHE  55   4.959  -5.237  -0.313
  400    HA   PHE  55           HA       PHE  55   6.279  -4.180   2.054
  401   1HB   PHE  55          HB2       PHE  55   8.383  -5.508   1.219
  402   2HB   PHE  55          HB1       PHE  55   7.210  -6.296   2.255
  403    HD1  PHE  55           HD1      PHE  55   9.056  -6.520  -0.741
  404    HD2  PHE  55           HD2      PHE  55   5.354  -7.633   1.020
  405    HE1  PHE  55           HE1      PHE  55   8.811  -8.304  -2.411
  406    HE2  PHE  55           HE2      PHE  55   5.114  -9.443  -0.633
  407    HZ   PHE  55           HZ       PHE  55   6.906  -9.791  -2.346
  408    H    LEU  56           HN       LEU  56   8.700  -3.605   1.134
  409    HA   LEU  56           HA       LEU  56   8.341  -2.336  -1.503
  410   1HB   LEU  56          HB2       LEU  56  10.074  -1.603   0.852
  411   2HB   LEU  56          HB1       LEU  56  10.524  -1.115  -0.754
  412    HG   LEU  56           HG       LEU  56   8.853   0.449  -0.927
  413   1HD1  LEU  56          HD11      LEU  56   6.971  -1.029  -0.498
  414   2HD1  LEU  56          HD12      LEU  56   6.808   0.488   0.389
  415   3HD1  LEU  56          HD13      LEU  56   7.317  -0.976   1.232
  416   1HD2  LEU  56          HD21      LEU  56   9.367   0.276   2.038
  417   2HD2  LEU  56          HD22      LEU  56   8.768   1.690   1.169
  418   3HD2  LEU  56          HD23      LEU  56  10.393   1.081   0.849
  419    H    ILE  57           HN       ILE  57   9.054  -3.748  -2.996
  420    HA   ILE  57           HA       ILE  57  11.309  -5.486  -2.262
  421    HB   ILE  57           HB       ILE  57   9.203  -6.671  -2.751
  422   1HG1  ILE  57          HG12      ILE  57  10.094  -8.255  -4.440
  423   2HG1  ILE  57          HG11      ILE  57  11.358  -7.092  -4.833
  424   1HG2  ILE  57          HG21      ILE  57   8.305  -6.731  -5.023
  425   2HG2  ILE  57          HG22      ILE  57   9.454  -5.483  -5.505
  426   3HG2  ILE  57          HG23      ILE  57   8.204  -5.120  -4.313
  427   1HD1  ILE  57          HD11      ILE  57  12.201  -8.835  -3.380
  428   2HD1  ILE  57          HD12      ILE  57  10.965  -8.458  -2.181
  429   3HD1  ILE  57          HD13      ILE  57  12.220  -7.278  -2.552
  430    H    SER  58           HN       SER  58  13.130  -5.484  -3.408
  431    HA   SER  58           HA       SER  58  13.608  -3.667  -5.547
  432   1HB   SER  58          HB2       SER  58  15.486  -4.254  -4.187
  433   2HB   SER  58          HB1       SER  58  15.185  -5.977  -4.389
  434    HG   SER  58           HG       SER  58  16.074  -4.147  -6.380
  435    H    ASP  59           HN       ASP  59  13.694  -4.076  -7.757
  436    HA   ASP  59           HA       ASP  59  11.908  -6.057  -8.703
  437   1HB   ASP  59          HB2       ASP  59  12.514  -5.303 -10.946
  438   2HB   ASP  59          HB1       ASP  59  12.259  -3.924  -9.882
  439    H    ASN  60           HN       ASN  60  15.230  -6.166  -7.968
  440    HA   ASN  60           HA       ASN  60  15.784  -8.461  -9.655
  441   1HB   ASN  60          HB2       ASN  60  17.587  -6.896  -9.343
  442   2HB   ASN  60          HB1       ASN  60  17.429  -6.984  -7.593
  443   1HD2  ASN  60          HD21      ASN  60  18.378  -8.753 -10.465
  444   2HD2  ASN  60          HD22      ASN  60  19.434  -9.867  -9.656
  445    H    ASN  61           HN       ASN  61  14.386  -7.874  -6.664
  446    HA   ASN  61           HA       ASN  61  13.815  -9.100  -4.855
  447   1HB   ASN  61          HB2       ASN  61  12.801 -10.574  -6.550
  448   2HB   ASN  61          HB1       ASN  61  14.312 -11.471  -6.670
  449   1HD2  ASN  61          HD21      ASN  61  13.328 -13.388  -6.035
  450   2HD2  ASN  61          HD22      ASN  61  12.823 -13.676  -4.405
  451    H    ARG  62           HN       ARG  62  15.398  -8.613  -3.447
  452    HA   ARG  62           HA       ARG  62  17.338 -10.666  -2.857
  453   1HB   ARG  62          HB2       ARG  62  19.240  -8.994  -2.814
  454   2HB   ARG  62          HB1       ARG  62  18.682  -9.464  -4.413
  455   1HG   ARG  62          HG2       ARG  62  17.354  -7.379  -4.523
  456   2HG   ARG  62          HG1       ARG  62  18.039  -6.900  -2.970
  457   1HD   ARG  62          HD2       ARG  62  19.661  -7.510  -5.434
  458   2HD   ARG  62          HD1       ARG  62  19.166  -5.891  -4.946
  459    HE   ARG  62           HE       ARG  62  20.432  -6.773  -2.740
  460   1HH1  ARG  62          HH11      ARG  62  21.333  -6.779  -6.130
  461   2HH1  ARG  62          HH12      ARG  62  23.038  -6.616  -5.811
  462   1HH2  ARG  62          HH21      ARG  62  22.675  -6.558  -2.316
  463   2HH2  ARG  62          HH22      ARG  62  23.792  -6.496  -3.644
  464    H    ASP  63           HN       ASP  63  16.239  -7.389  -2.177
  465    HA   ASP  63           HA       ASP  63  16.459  -7.948   0.702
  466   1HB   ASP  63          HB2       ASP  63  17.985  -6.183   0.070
  467   2HB   ASP  63          HB1       ASP  63  16.725  -5.348  -0.827
  468    H    LYS  64           HN       LYS  64  14.662  -7.610   1.948
  469    HA   LYS  64           HA       LYS  64  12.296  -6.527   0.578
  470   1HB   LYS  64          HB2       LYS  64  12.584  -9.168   1.663
  471   2HB   LYS  64          HB1       LYS  64  11.417  -8.264   2.605
  472   1HG   LYS  64          HG2       LYS  64  10.463  -7.684   0.232
  473   2HG   LYS  64          HG1       LYS  64  11.239  -9.222  -0.164
  474   1HD   LYS  64          HD2       LYS  64   9.442  -8.837   2.213
  475   2HD   LYS  64          HD1       LYS  64   8.830  -9.362   0.647
  476   1HE   LYS  64          HE2       LYS  64  11.004 -10.764   2.196
  477   2HE   LYS  64          HE1       LYS  64   9.301 -11.200   2.262
  478   1HZ   LYS  64          HZ1       LYS  64  11.007 -11.255  -0.174
  479   2HZ   LYS  64          HZ2       LYS  64   9.359 -11.679  -0.108
  480   3HZ   LYS  64          HZ3       LYS  64  10.510 -12.607   0.722
  481    H    LEU  65           HN       LEU  65  10.863  -5.484   1.778
  482    HA   LEU  65           HA       LEU  65  11.420  -4.985   4.621
  483   1HB   LEU  65          HB2       LEU  65  10.050  -3.220   2.587
  484   2HB   LEU  65          HB1       LEU  65  10.085  -2.892   4.297
  485    HG   LEU  65           HG       LEU  65  12.600  -2.796   4.125
  486   1HD1  LEU  65          HD11      LEU  65  13.537  -2.268   1.935
  487   2HD1  LEU  65          HD12      LEU  65  11.974  -2.590   1.186
  488   3HD1  LEU  65          HD13      LEU  65  12.861  -3.896   1.973
  489   1HD2  LEU  65          HD21      LEU  65  12.570  -0.485   3.353
  490   2HD2  LEU  65          HD22      LEU  65  11.183  -0.831   4.387
  491   3HD2  LEU  65          HD23      LEU  65  10.977  -0.739   2.638
  492    H    TYR  66           HN       TYR  66   9.246  -4.690   5.857
  493    HA   TYR  66           HA       TYR  66   7.003  -5.191   4.024
  494   1HB   TYR  66          HB2       TYR  66   7.141  -5.846   6.961
  495   2HB   TYR  66          HB1       TYR  66   5.660  -5.838   6.019
  496    HD1  TYR  66           HD1      TYR  66   7.863  -8.006   7.436
  497    HD2  TYR  66           HD2      TYR  66   6.123  -7.174   3.647
  498    HE1  TYR  66           HE1      TYR  66   8.359 -10.302   6.712
  499    HE2  TYR  66           HE2      TYR  66   6.590  -9.480   2.917
  500    HH   TYR  66           HH       TYR  66   7.797 -11.912   5.123
  501    H    VAL  67           HN       VAL  67   5.248  -3.767   4.200
  502    HA   VAL  67           HA       VAL  67   5.722  -1.381   5.849
  503    HB   VAL  67           HB       VAL  67   5.083   0.071   3.970
  504   1HG1  VAL  67          HG11      VAL  67   7.423  -0.228   4.508
  505   2HG1  VAL  67          HG12      VAL  67   7.222  -0.079   2.762
  506   3HG1  VAL  67          HG13      VAL  67   7.500  -1.664   3.485
  507   1HG2  VAL  67          HG21      VAL  67   5.317  -2.443   2.318
  508   2HG2  VAL  67          HG22      VAL  67   5.135  -0.812   1.675
  509   3HG2  VAL  67          HG23      VAL  67   3.838  -1.535   2.629
  510    H    ASN  68           HN       ASN  68   3.860  -0.062   6.171
  511    HA   ASN  68           HA       ASN  68   1.339  -1.363   5.431
  512   1HB   ASN  68          HB2       ASN  68   0.345  -0.477   7.548
  513   2HB   ASN  68          HB1       ASN  68   1.559  -1.721   7.795
  514   1HD2  ASN  68          HD21      ASN  68   0.517   0.424   9.543
  515   2HD2  ASN  68          HD22      ASN  68   1.922   1.291  10.082
  516    H    ILE  69           HN       ILE  69   0.456  -0.177   3.922
  517    HA   ILE  69           HA       ILE  69   0.810   2.651   3.708
  518    HB   ILE  69           HB       ILE  69  -1.491   2.043   2.263
  519   1HG1  ILE  69          HG12      ILE  69   0.475  -0.254   2.086
  520   2HG1  ILE  69          HG11      ILE  69  -1.176  -0.348   2.692
  521   1HG2  ILE  69          HG21      ILE  69   1.387   2.070   1.375
  522   2HG2  ILE  69          HG22      ILE  69   0.316   3.463   1.517
  523   3HG2  ILE  69          HG23      ILE  69  -0.011   2.219   0.311
  524   1HD1  ILE  69          HD11      ILE  69  -1.046  -1.234   0.455
  525   2HD1  ILE  69          HD12      ILE  69  -0.341   0.272  -0.133
  526   3HD1  ILE  69          HD13      ILE  69  -2.002   0.246   0.459
  527    H    ARG  70           HN       ARG  70   0.034   3.884   5.274
  528    HA   ARG  70           HA       ARG  70  -2.602   3.197   6.403
  529   1HB   ARG  70          HB2       ARG  70  -0.606   2.659   7.881
  530   2HB   ARG  70          HB1       ARG  70  -0.298   4.389   7.954
  531   1HG   ARG  70          HG2       ARG  70  -2.537   4.717   8.928
  532   2HG   ARG  70          HG1       ARG  70  -2.770   2.968   8.920
  533   1HD   ARG  70          HD2       ARG  70  -2.076   3.500  11.104
  534   2HD   ARG  70          HD1       ARG  70  -0.653   2.828  10.310
  535    HE   ARG  70           HE       ARG  70  -0.692   5.646  10.051
  536   1HH1  ARG  70          HH11      ARG  70  -0.052   3.086  12.361
  537   2HH1  ARG  70          HH12      ARG  70   0.971   4.077  13.354
  538   1HH2  ARG  70          HH21      ARG  70   0.646   6.960  11.378
  539   2HH2  ARG  70          HH22      ARG  70   1.366   6.268  12.808
  540    HA   PRO  71           HA       PRO  71  -3.965   7.353   5.444
  541   1HB   PRO  71          HB2       PRO  71  -5.112   7.015   8.191
  542   2HB   PRO  71          HB1       PRO  71  -5.867   7.657   6.734
  543   1HG   PRO  71          HG2       PRO  71  -6.403   5.190   7.531
  544   2HG   PRO  71          HG1       PRO  71  -6.184   5.548   5.806
  545   1HD   PRO  71          HD2       PRO  71  -4.351   4.167   7.702
  546   2HD   PRO  71          HD1       PRO  71  -4.569   3.920   5.958
  547    H    MET  72           HN       MET  72  -2.707   9.076   5.645
  548    HA   MET  72           HA       MET  72  -0.529   9.253   7.324
  549   1HB   MET  72          HB2       MET  72  -0.835  10.527   5.226
  550   2HB   MET  72          HB1       MET  72  -1.993  11.563   6.047
  551   1HG   MET  72          HG2       MET  72  -0.262  12.332   7.567
  552   2HG   MET  72          HG1       MET  72   0.904  11.258   6.796
  553   1HE   MET  72          HE1       MET  72  -1.402  14.388   6.347
  554   2HE   MET  72          HE2       MET  72  -1.918  13.363   5.006
  555   3HE   MET  72          HE3       MET  72  -1.054  14.869   4.686
  556    H    ASP  73           HN       ASP  73  -3.568  11.109   7.652
  557    HA   ASP  73           HA       ASP  73  -3.383  10.916  10.537
  558   1HB   ASP  73          HB2       ASP  73  -3.220  13.222  11.012
  559   2HB   ASP  73          HB1       ASP  73  -2.002  12.943   9.773
  560    H    ASN  74           HN       ASN  74  -5.173  10.330   8.132
  561    HA   ASN  74           HA       ASN  74  -7.385  12.153   8.429
  562   1HB   ASN  74          HB2       ASN  74  -7.035   9.706   6.708
  563   2HB   ASN  74          HB1       ASN  74  -8.462  10.729   6.671
  564   1HD2  ASN  74          HD21      ASN  74  -5.146  10.393   5.771
  565   2HD2  ASN  74          HD22      ASN  74  -5.041  11.808   4.779
  566    H    SER  75           HN       SER  75  -7.636   8.605   8.254
  567    HA   SER  75           HA       SER  75  -9.283   8.662  10.680
  568   1HB   SER  75          HB2       SER  75 -10.147   7.175   8.198
  569   2HB   SER  75          HB1       SER  75 -11.098   7.536   9.639
  570    HG   SER  75           HG       SER  75 -11.195   9.674   9.034
  571    H    ALA  76           HN       ALA  76  -9.868   6.324  11.303
  572    HA   ALA  76           HA       ALA  76  -7.434   4.746  11.201
  573   1HB   ALA  76          HB1       ALA  76  -9.985   4.258  12.738
  574   2HB   ALA  76          HB2       ALA  76  -8.570   5.109  13.351
  575   3HB   ALA  76          HB3       ALA  76  -8.459   3.396  12.943
  576    H    TRP  77           HN       TRP  77  -7.134   3.180   9.794
  577    HA   TRP  77           HA       TRP  77  -9.471   1.922   8.514
  578   1HB   TRP  77          HB2       TRP  77  -6.656   2.418   7.602
  579   2HB   TRP  77          HB1       TRP  77  -7.573   1.086   6.909
  580    HD1  TRP  77           HD1      TRP  77  -9.355   4.387   7.691
  581    HE1  TRP  77           HE1      TRP  77 -10.069   5.468   5.454
  582    HE3  TRP  77           HE3      TRP  77  -6.903   1.273   4.461
  583    HZ2  TRP  77           HZ2      TRP  77  -9.633   5.048   2.699
  584    HZ3  TRP  77           HZ3      TRP  77  -7.103   1.684   2.045
  585    HH2  TRP  77           HH2      TRP  77  -8.439   3.531   1.183
  586    H    THR  78           HN       THR  78  -9.412  -0.388   8.172
  587    HA   THR  78           HA       THR  78  -8.307  -1.874  10.347
  588    HB   THR  78           HB       THR  78  -9.482  -2.945   7.769
  589    HG1  THR  78           HG1      THR  78 -10.668  -1.925  10.128
  590   1HG2  THR  78          HG21      THR  78  -9.251  -4.156  10.530
  591   2HG2  THR  78          HG22      THR  78  -8.284  -4.604   9.124
  592   3HG2  THR  78          HG23      THR  78 -10.021  -4.909   9.134
  593    H    THR  79           HN       THR  79  -6.318  -2.739  10.455
  594    HA   THR  79           HA       THR  79  -4.673  -2.322   8.074
  595    HB   THR  79           HB       THR  79  -3.982  -0.936   9.868
  596    HG1  THR  79           HG1      THR  79  -2.105  -3.071   9.903
  597   1HG2  THR  79          HG21      THR  79  -4.947  -2.130  11.752
  598   2HG2  THR  79          HG22      THR  79  -3.236  -1.812  12.044
  599   3HG2  THR  79          HG23      THR  79  -3.763  -3.425  11.562
  600    H    ASP  80           HN       ASP  80  -4.740  -4.170   6.987
  601    HA   ASP  80           HA       ASP  80  -3.453  -6.489   8.270
  602   1HB   ASP  80          HB2       ASP  80  -5.089  -6.293   5.723
  603   2HB   ASP  80          HB1       ASP  80  -4.193  -7.729   6.196
  604    H    ASN  81           HN       ASN  81  -1.751  -7.545   6.849
  605    HA   ASN  81           HA       ASN  81  -0.153  -5.401   5.734
  606   1HB   ASN  81          HB2       ASN  81   0.858  -7.152   7.252
  607   2HB   ASN  81          HB1       ASN  81   0.627  -8.313   5.965
  608   1HD2  ASN  81          HD21      ASN  81   1.611  -4.992   5.310
  609   2HD2  ASN  81          HD22      ASN  81   3.208  -5.389   4.816
  610    H    GLY  82           HN       GLY  82  -2.410  -7.553   4.594
  611   1HA   GLY  82          HA2       GLY  82  -1.243  -7.493   1.892
  612   2HA   GLY  82          HA1       GLY  82  -2.461  -8.637   2.435
  613    H    VAL  83           HN       VAL  83  -3.986  -6.508   3.798
  614    HA   VAL  83           HA       VAL  83  -4.964  -4.990   1.494
  615    HB   VAL  83           HB       VAL  83  -7.309  -5.472   2.094
  616   1HG1  VAL  83          HG11      VAL  83  -6.232  -6.773   0.330
  617   2HG1  VAL  83          HG12      VAL  83  -7.420  -7.741   1.202
  618   3HG1  VAL  83          HG13      VAL  83  -5.699  -7.957   1.523
  619   1HG2  VAL  83          HG21      VAL  83  -7.836  -7.338   3.600
  620   2HG2  VAL  83          HG22      VAL  83  -7.005  -6.031   4.443
  621   3HG2  VAL  83          HG23      VAL  83  -6.125  -7.492   3.997
  622    H    PHE  84           HN       PHE  84  -6.045  -3.059   2.041
  623    HA   PHE  84           HA       PHE  84  -6.031  -2.326   4.874
  624   1HB   PHE  84          HB2       PHE  84  -4.008  -1.514   3.158
  625   2HB   PHE  84          HB1       PHE  84  -5.122  -0.150   3.144
  626    HD1  PHE  84           HD1      PHE  84  -5.751   0.920   5.329
  627    HD2  PHE  84           HD2      PHE  84  -2.601  -1.917   4.978
  628    HE1  PHE  84           HE1      PHE  84  -4.812   1.700   7.469
  629    HE2  PHE  84           HE2      PHE  84  -1.659  -1.146   7.111
  630    HZ   PHE  84           HZ       PHE  84  -2.764   0.665   8.362
  631    H    TYR  85           HN       TYR  85  -8.067  -1.754   5.267
  632    HA   TYR  85           HA       TYR  85  -9.460  -0.042   3.349
  633   1HB   TYR  85          HB2       TYR  85 -11.477  -1.479   3.385
  634   2HB   TYR  85          HB1       TYR  85 -10.101  -2.276   2.633
  635    HD1  TYR  85           HD1      TYR  85 -12.708  -2.621   4.974
  636    HD2  TYR  85           HD2      TYR  85  -8.693  -3.822   4.230
  637    HE1  TYR  85           HE1      TYR  85 -13.004  -4.522   6.502
  638    HE2  TYR  85           HE2      TYR  85  -8.982  -5.738   5.752
  639    HH   TYR  85           HH       TYR  85 -12.011  -6.753   6.876
  640    H    LYS  86           HN       LYS  86 -11.200   1.145   4.283
  641    HA   LYS  86           HA       LYS  86 -10.754   1.616   7.059
  642   1HB   LYS  86          HB2       LYS  86 -12.187   3.465   6.908
  643   2HB   LYS  86          HB1       LYS  86 -11.343   3.411   5.377
  644   1HG   LYS  86          HG2       LYS  86 -13.987   2.091   5.519
  645   2HG   LYS  86          HG1       LYS  86 -13.949   3.852   5.584
  646   1HD   LYS  86          HD2       LYS  86 -12.357   3.565   3.503
  647   2HD   LYS  86          HD1       LYS  86 -13.187   2.009   3.366
  648   1HE   LYS  86          HE2       LYS  86 -15.356   3.237   3.452
  649   2HE   LYS  86          HE1       LYS  86 -14.450   4.752   3.411
  650   1HZ   LYS  86          HZ1       LYS  86 -14.572   2.671   1.303
  651   2HZ   LYS  86          HZ2       LYS  86 -13.513   3.992   1.266
  652   3HZ   LYS  86          HZ3       LYS  86 -15.188   4.247   1.230
  653    H    ASN  87           HN       ASN  87 -12.078   1.285   8.764
  654    HA   ASN  87           HA       ASN  87 -13.596  -1.051   8.872
  655   1HB   ASN  87          HB2       ASN  87 -12.658  -0.228  10.887
  656   2HB   ASN  87          HB1       ASN  87 -13.396   1.354  10.681
  657   1HD2  ASN  87          HD21      ASN  87 -15.497   1.674  11.300
  658   2HD2  ASN  87          HD22      ASN  87 -16.387   0.528  12.240
  659    H    ASP  88           HN       ASP  88 -14.464   2.166   8.001
  660    HA   ASP  88           HA       ASP  88 -17.321   1.633   8.256
  661   1HB   ASP  88          HB2       ASP  88 -15.965   3.853   8.868
  662   2HB   ASP  88          HB1       ASP  88 -16.285   4.215   7.172
  663    H    VAL  89           HN       VAL  89 -18.301   3.216   6.255
  664    HA   VAL  89           HA       VAL  89 -17.284   2.016   3.759
  665    HB   VAL  89           HB       VAL  89 -19.624   1.872   2.934
  666   1HG1  VAL  89          HG11      VAL  89 -19.092   0.285   5.436
  667   2HG1  VAL  89          HG12      VAL  89 -18.532  -0.110   3.811
  668   3HG1  VAL  89          HG13      VAL  89 -20.256  -0.131   4.180
  669   1HG2  VAL  89          HG21      VAL  89 -20.657   3.530   4.400
  670   2HG2  VAL  89          HG22      VAL  89 -20.378   2.485   5.794
  671   3HG2  VAL  89          HG23      VAL  89 -21.488   1.979   4.521
  672    H    GLY  90           HN       GLY  90 -18.945   3.321   1.999
  673   1HA   GLY  90          HA2       GLY  90 -19.509   5.393   1.112
  674   2HA   GLY  90          HA1       GLY  90 -18.944   6.145   2.598
  675    H    SER  91           HN       SER  91 -17.838   7.728   1.393
  676    HA   SER  91           HA       SER  91 -15.677   6.868  -0.336
  677   1HB   SER  91          HB2       SER  91 -16.620   9.630   0.496
  678   2HB   SER  91          HB1       SER  91 -15.346   9.310  -0.682
  679    HG   SER  91           HG       SER  91 -17.834   8.077  -1.060
  680    H    TRP  92           HN       TRP  92 -13.695   8.608   0.182
  681    HA   TRP  92           HA       TRP  92 -13.083   8.976   2.923
  682   1HB   TRP  92          HB2       TRP  92 -12.797   6.492   2.730
  683   2HB   TRP  92          HB1       TRP  92 -11.510   6.792   1.552
  684    HD1  TRP  92           HD1      TRP  92 -12.294   7.084   5.277
  685    HE1  TRP  92           HE1      TRP  92 -10.096   7.516   6.540
  686    HE3  TRP  92           HE3      TRP  92  -9.203   7.751   1.284
  687    HZ2  TRP  92           HZ2      TRP  92  -7.408   8.059   5.900
  688    HZ3  TRP  92           HZ3      TRP  92  -6.855   8.242   1.679
  689    HH2  TRP  92           HH2      TRP  92  -5.954   8.392   3.950
  690    H    GLY  93           HN       GLY  93 -11.681   8.338  -0.221
  691   1HA   GLY  93          HA2       GLY  93  -9.691   9.257  -1.141
  692   2HA   GLY  93          HA1       GLY  93 -10.904  10.486  -1.374
  693    H    GLY  94           HN       GLY  94  -8.006   9.586   0.274
  694   1HA   GLY  94          HA2       GLY  94  -7.602  12.354   1.074
  695   2HA   GLY  94          HA1       GLY  94  -7.642  11.175   2.379
  696    H    THR  95           HN       THR  95  -5.647  10.694   3.040
  697    HA   THR  95           HA       THR  95  -3.569  10.335   0.997
  698    HB   THR  95           HB       THR  95  -2.024  11.278   2.929
  699    HG1  THR  95           HG1      THR  95  -3.838  13.211   3.444
  700   1HG2  THR  95          HG21      THR  95  -2.127  13.481   1.862
  701   2HG2  THR  95          HG22      THR  95  -3.657  13.044   1.101
  702   3HG2  THR  95          HG23      THR  95  -2.178  12.190   0.661
  703    H    ILE  96           HN       ILE  96  -2.553   8.471   1.116
  704    HA   ILE  96           HA       ILE  96  -2.436   7.031   3.703
  705    HB   ILE  96           HB       ILE  96  -2.088   5.557   1.137
  706   1HG1  ILE  96          HG12      ILE  96  -4.214   7.110   1.145
  707   2HG1  ILE  96          HG11      ILE  96  -4.321   5.452   0.563
  708   1HG2  ILE  96          HG21      ILE  96  -1.765   4.441   3.278
  709   2HG2  ILE  96          HG22      ILE  96  -3.139   3.762   2.404
  710   3HG2  ILE  96          HG23      ILE  96  -3.412   4.869   3.750
  711   1HD1  ILE  96          HD11      ILE  96  -5.103   6.433   3.295
  712   2HD1  ILE  96          HD12      ILE  96  -5.195   4.762   2.737
  713   3HD1  ILE  96          HD13      ILE  96  -6.199   6.000   1.983
  714    H    GLY  97           HN       GLY  97  -0.405   6.536   4.391
  715   1HA   GLY  97          HA2       GLY  97   1.775   7.250   2.536
  716   2HA   GLY  97          HA1       GLY  97   1.832   7.515   4.271
  717    H    ILE  98           HN       ILE  98   3.672   6.012   2.559
  718    HA   ILE  98           HA       ILE  98   3.295   3.280   3.469
  719    HB   ILE  98           HB       ILE  98   5.391   4.566   1.718
  720   1HG1  ILE  98          HG12      ILE  98   4.569   2.722   0.152
  721   2HG1  ILE  98          HG11      ILE  98   3.253   2.490   1.308
  722   1HG2  ILE  98          HG21      ILE  98   6.453   2.367   1.489
  723   2HG2  ILE  98          HG22      ILE  98   5.388   1.730   2.743
  724   3HG2  ILE  98          HG23      ILE  98   6.562   2.985   3.136
  725   1HD1  ILE  98          HD11      ILE  98   2.542   4.798   0.944
  726   2HD1  ILE  98          HD12      ILE  98   2.564   3.882  -0.563
  727   3HD1  ILE  98          HD13      ILE  98   3.859   5.025  -0.207
  728    H    TYR  99           HN       TYR  99   3.765   2.884   5.507
  729    HA   TYR  99           HA       TYR  99   6.176   4.078   6.691
  730   1HB   TYR  99          HB2       TYR  99   3.982   2.535   8.108
  731   2HB   TYR  99          HB1       TYR  99   5.257   3.485   8.853
  732    HD1  TYR  99           HD1      TYR  99   4.707   5.599   9.644
  733    HD2  TYR  99           HD2      TYR  99   2.381   3.928   6.506
  734    HE1  TYR  99           HE1      TYR  99   3.219   7.554   9.711
  735    HE2  TYR  99           HE2      TYR  99   0.881   5.871   6.572
  736    HH   TYR  99           HH       TYR  99   0.211   7.638   8.016
  737    H    VAL 100           HN       VAL 100   7.831   2.707   7.386
  738    HA   VAL 100           HA       VAL 100   7.715   0.002   6.354
  739    HB   VAL 100           HB       VAL 100   9.778   1.423   6.147
  740   1HG1  VAL 100          HG11      VAL 100  10.081   0.816   9.083
  741   2HG1  VAL 100          HG12      VAL 100   9.773   2.404   8.381
  742   3HG1  VAL 100          HG13      VAL 100  11.292   1.571   8.048
  743   1HG2  VAL 100          HG21      VAL 100   9.840  -0.983   5.813
  744   2HG2  VAL 100          HG22      VAL 100  10.078  -1.231   7.544
  745   3HG2  VAL 100          HG23      VAL 100  11.323  -0.423   6.588
  746    H    ASP 101           HN       ASP 101   7.532  -1.832   7.549
  747    HA   ASP 101           HA       ASP 101   6.575  -1.531  10.248
  748   1HB   ASP 101          HB2       ASP 101   5.557  -3.164   8.701
  749   2HB   ASP 101          HB1       ASP 101   7.083  -4.049   8.649
  750    H    GLY 102           HN       GLY 102   7.956  -1.245  11.867
  751   1HA   GLY 102          HA2       GLY 102   9.569  -1.822  13.404
  752   2HA   GLY 102          HA1       GLY 102   9.832  -3.302  12.497
  753    H    GLN 103           HN       GLN 103  10.141  -0.041  11.237
  754    HA   GLN 103           HA       GLN 103  11.819   0.952  10.078
  755   1HB   GLN 103          HB2       GLN 103  13.638   1.695  11.481
  756   2HB   GLN 103          HB1       GLN 103  12.117   1.745  12.353
  757   1HG   GLN 103          HG2       GLN 103  12.699  -0.223  13.598
  758   2HG   GLN 103          HG1       GLN 103  14.157  -0.450  12.631
  759   1HE2  GLN 103          HE21      GLN 103  15.891   0.957  12.900
  760   2HE2  GLN 103          HE22      GLN 103  16.056   1.941  14.320
  761    H    GLN 104           HN       GLN 104  12.531  -0.072   8.325
  762    HA   GLN 104           HA       GLN 104  14.248  -2.296   8.262
  763   1HB   GLN 104          HB2       GLN 104  13.012  -1.601   6.291
  764   2HB   GLN 104          HB1       GLN 104  13.847  -0.056   6.265
  765   1HG   GLN 104          HG2       GLN 104  14.732  -1.482   4.551
  766   2HG   GLN 104          HG1       GLN 104  15.957  -1.224   5.789
  767   1HE2  GLN 104          HE21      GLN 104  13.812  -3.519   4.313
  768   2HE2  GLN 104          HE22      GLN 104  14.515  -4.932   5.010
  769    H    THR 105           HN       THR 105  14.791   1.073   8.822
  770    HA   THR 105           HA       THR 105  16.607   2.300   9.408
  771    HB   THR 105           HB       THR 105  18.179  -0.259   9.731
  772    HG1  THR 105           HG1      THR 105  16.493  -0.775  10.972
  773   1HG2  THR 105          HG21      THR 105  19.219   0.979  11.583
  774   2HG2  THR 105          HG22      THR 105  18.188   2.367  11.233
  775   3HG2  THR 105          HG23      THR 105  19.396   1.847  10.058
  776    H    ASN 106           HN       ASN 106  16.159   0.957   6.700
  777    HA   ASN 106           HA       ASN 106  16.944   1.097   4.604
  778   1HB   ASN 106          HB2       ASN 106  17.239   3.487   5.285
  779   2HB   ASN 106          HB1       ASN 106  18.922   3.119   5.649
  780   1HD2  ASN 106          HD21      ASN 106  20.359   3.218   4.056
  781   2HD2  ASN 106          HD22      ASN 106  19.976   3.387   2.368
  782    H    THR 107           HN       THR 107  17.710  -0.960   4.463
  783    HA   THR 107           HA       THR 107  20.577  -1.386   4.809
  784    HB   THR 107           HB       THR 107  18.498  -3.354   3.806
  785    HG1  THR 107           HG1      THR 107  17.907  -3.624   5.824
  786   1HG2  THR 107          HG21      THR 107  20.130  -5.043   4.554
  787   2HG2  THR 107          HG22      THR 107  21.251  -3.754   4.989
  788   3HG2  THR 107          HG23      THR 107  20.797  -3.996   3.303
  789    HA   PRO 108           HA       PRO 108  21.855   0.303   0.984
  790   1HB   PRO 108          HB2       PRO 108  23.075  -2.437   0.790
  791   2HB   PRO 108          HB1       PRO 108  23.766  -0.873   0.324
  792   1HG   PRO 108          HG2       PRO 108  24.321  -1.987   2.700
  793   2HG   PRO 108          HG1       PRO 108  24.149  -0.234   2.509
  794   1HD   PRO 108          HD2       PRO 108  22.411  -2.119   3.922
  795   2HD   PRO 108          HD1       PRO 108  22.440  -0.346   3.999
  796    HA   PRO 109           HA       PRO 109  18.821  -1.780  -1.662
  797   1HB   PRO 109          HB2       PRO 109  17.174   0.362  -1.851
  798   2HB   PRO 109          HB1       PRO 109  17.151  -0.750  -0.483
  799   1HG   PRO 109          HG2       PRO 109  18.016   2.021  -0.568
  800   2HG   PRO 109          HG1       PRO 109  17.738   0.985   0.832
  801   1HD   PRO 109          HD2       PRO 109  20.253   1.659  -0.499
  802   2HD   PRO 109          HD1       PRO 109  19.973   0.920   1.100
  803    H    GLY 110           HN       GLY 110  17.451  -0.112  -3.431
  804   1HA   GLY 110          HA2       GLY 110  19.154   1.607  -4.923
  805   2HA   GLY 110          HA1       GLY 110  19.003   0.030  -5.692
  806    H    ASN 111           HN       ASN 111  17.268  -0.357  -6.925
  807    HA   ASN 111           HA       ASN 111  15.067   1.584  -6.866
  808   1HB   ASN 111          HB2       ASN 111  16.378   0.054  -8.969
  809   2HB   ASN 111          HB1       ASN 111  14.628  -0.134  -9.010
  810   1HD2  ASN 111          HD21      ASN 111  13.331   1.640  -9.445
  811   2HD2  ASN 111          HD22      ASN 111  13.975   3.110 -10.113
  812    H    TYR 112           HN       TYR 112  13.407   1.019  -5.627
  813    HA   TYR 112           HA       TYR 112  12.707  -1.826  -5.464
  814   1HB   TYR 112          HB2       TYR 112  12.251   0.429  -3.508
  815   2HB   TYR 112          HB1       TYR 112  11.335  -1.071  -3.426
  816    HD1  TYR 112           HD1      TYR 112  12.174  -1.680  -1.253
  817    HD2  TYR 112           HD2      TYR 112  14.854  -1.005  -4.471
  818    HE1  TYR 112           HE1      TYR 112  13.979  -2.718   0.035
  819    HE2  TYR 112           HE2      TYR 112  16.678  -2.028  -3.202
  820    HH   TYR 112           HH       TYR 112  17.284  -2.614  -1.005
  821    H    THR 113           HN       THR 113  10.748  -2.519  -5.998
  822    HA   THR 113           HA       THR 113   9.014  -0.584  -7.386
  823    HB   THR 113           HB       THR 113   9.498  -3.485  -8.049
  824    HG1  THR 113           HG1      THR 113  11.031  -1.419  -8.561
  825   1HG2  THR 113          HG21      THR 113   8.280  -2.991 -10.124
  826   2HG2  THR 113          HG22      THR 113   7.986  -1.349  -9.554
  827   3HG2  THR 113          HG23      THR 113   7.270  -2.719  -8.705
  828    H    LEU 114           HN       LEU 114   7.462  -0.293  -5.831
  829    HA   LEU 114           HA       LEU 114   6.104  -2.717  -4.879
  830   1HB   LEU 114          HB2       LEU 114   5.107  -1.113  -3.140
  831   2HB   LEU 114          HB1       LEU 114   6.772  -1.624  -2.943
  832    HG   LEU 114           HG       LEU 114   6.282   0.911  -4.395
  833   1HD1  LEU 114          HD11      LEU 114   6.132   2.157  -2.287
  834   2HD1  LEU 114          HD12      LEU 114   6.042   0.634  -1.402
  835   3HD1  LEU 114          HD13      LEU 114   4.748   1.088  -2.511
  836   1HD2  LEU 114          HD21      LEU 114   8.327   0.061  -2.348
  837   2HD2  LEU 114          HD22      LEU 114   8.334   1.569  -3.264
  838   3HD2  LEU 114          HD23      LEU 114   8.548   0.029  -4.098
  839    H    THR 115           HN       THR 115   4.790  -3.027  -6.599
  840    HA   THR 115           HA       THR 115   3.112  -0.930  -7.636
  841    HB   THR 115           HB       THR 115   2.693  -3.836  -8.244
  842    HG1  THR 115           HG1      THR 115   4.458  -3.369  -9.896
  843   1HG2  THR 115          HG21      THR 115   2.741  -1.366  -9.983
  844   2HG2  THR 115          HG22      THR 115   1.287  -2.102  -9.307
  845   3HG2  THR 115          HG23      THR 115   2.260  -2.989 -10.480
  846    H    LEU 116           HN       LEU 116   1.128  -0.425  -6.895
  847    HA   LEU 116           HA       LEU 116  -0.152  -2.308  -5.020
  848   1HB   LEU 116          HB2       LEU 116  -0.282   0.705  -5.097
  849   2HB   LEU 116          HB1       LEU 116  -1.179  -0.307  -3.983
  850    HG   LEU 116           HG       LEU 116   1.836  -0.128  -4.101
  851   1HD1  LEU 116          HD11      LEU 116  -0.125   1.104  -2.166
  852   2HD1  LEU 116          HD12      LEU 116   0.865   1.968  -3.342
  853   3HD1  LEU 116          HD13      LEU 116   1.631   1.119  -1.999
  854   1HD2  LEU 116          HD21      LEU 116   1.739  -1.337  -1.972
  855   2HD2  LEU 116          HD22      LEU 116   1.035  -2.280  -3.283
  856   3HD2  LEU 116          HD23      LEU 116  -0.014  -1.463  -2.123
  857    H    THR 117           HN       THR 117  -1.802  -3.287  -5.978
  858    HA   THR 117           HA       THR 117  -3.315  -1.951  -8.072
  859    HB   THR 117           HB       THR 117  -3.623  -4.770  -7.009
  860    HG1  THR 117           HG1      THR 117  -2.323  -5.323  -8.837
  861   1HG2  THR 117          HG21      THR 117  -4.546  -3.491  -9.590
  862   2HG2  THR 117          HG22      THR 117  -5.580  -3.919  -8.227
  863   3HG2  THR 117          HG23      THR 117  -4.760  -5.183  -9.140
  864    H    GLY 118           HN       GLY 118  -4.877  -0.635  -7.407
  865   1HA   GLY 118          HA2       GLY 118  -6.056  -0.832  -4.810
  866   2HA   GLY 118          HA1       GLY 118  -6.484   0.319  -6.062
  867    H    GLY 119           HN       GLY 119  -8.538  -0.449  -4.706
  868   1HA   GLY 119          HA2       GLY 119 -10.450  -1.273  -6.371
  869   2HA   GLY 119          HA1       GLY 119  -9.760  -2.811  -5.862
  870    H    TYR 120           HN       TYR 120 -12.104  -2.973  -5.113
  871    HA   TYR 120           HA       TYR 120 -12.348  -1.721  -2.471
  872   1HB   TYR 120          HB2       TYR 120 -14.720  -2.198  -2.518
  873   2HB   TYR 120          HB1       TYR 120 -14.265  -1.333  -3.975
  874    HD1  TYR 120           HD1      TYR 120 -15.316  -4.590  -2.615
  875    HD2  TYR 120           HD2      TYR 120 -14.542  -2.336  -6.147
  876    HE1  TYR 120           HE1      TYR 120 -16.371  -6.353  -3.966
  877    HE2  TYR 120           HE2      TYR 120 -15.605  -4.089  -7.503
  878    HH   TYR 120           HH       TYR 120 -17.476  -6.571  -6.178
  879    H    TRP 121           HN       TRP 121 -13.944  -3.366  -1.136
  880    HA   TRP 121           HA       TRP 121 -12.646  -5.985  -1.037
  881   1HB   TRP 121          HB2       TRP 121 -11.157  -4.793   0.346
  882   2HB   TRP 121          HB1       TRP 121 -12.434  -3.787   1.016
  883    HD1  TRP 121           HD1      TRP 121 -14.026  -4.943   2.850
  884    HE1  TRP 121           HE1      TRP 121 -13.571  -6.836   4.519
  885    HE3  TRP 121           HE3      TRP 121  -9.866  -6.886   0.709
  886    HZ2  TRP 121           HZ2      TRP 121 -11.683  -8.876   4.875
  887    HZ3  TRP 121           HZ3      TRP 121  -8.781  -8.826   1.784
  888    HH2  TRP 121           HH2      TRP 121  -9.678  -9.791   3.815
  889    H    ALA 122           HN       ALA 122 -13.876  -7.515   0.161
  890    HA   ALA 122           HA       ALA 122 -16.475  -6.576   1.137
  891   1HB   ALA 122          HB1       ALA 122 -16.002  -9.095  -0.450
  892   2HB   ALA 122          HB2       ALA 122 -16.782  -7.628  -1.046
  893   3HB   ALA 122          HB3       ALA 122 -17.542  -8.576   0.233
  894    H    LYS 123           HN       LYS 123 -17.223  -7.463   2.981
  895    HA   LYS 123           HA       LYS 123 -17.417  -8.670   4.868
  896   1HB   LYS 123          HB2       LYS 123 -15.702 -10.580   3.324
  897   2HB   LYS 123          HB1       LYS 123 -16.111 -10.887   5.009
  898   1HG   LYS 123          HG2       LYS 123 -17.926 -10.751   2.630
  899   2HG   LYS 123          HG1       LYS 123 -17.753 -12.037   3.829
  900   1HD   LYS 123          HD2       LYS 123 -18.656 -10.440   5.538
  901   2HD   LYS 123          HD1       LYS 123 -19.004  -9.322   4.219
  902   1HE   LYS 123          HE2       LYS 123 -21.021 -10.458   4.625
  903   2HE   LYS 123          HE1       LYS 123 -20.346 -11.207   3.177
  904   1HZ   LYS 123          HZ1       LYS 123 -19.522 -13.022   4.527
  905   2HZ   LYS 123          HZ2       LYS 123 -21.189 -12.846   4.753
  906   3HZ   LYS 123          HZ3       LYS 123 -20.113 -12.286   5.934
  907    H    ASP 124           HN       ASP 124 -15.206 -10.256   6.128
  908    HA   ASP 124           HA       ASP 124 -13.431  -8.004   6.772
  909   1HB   ASP 124          HB2       ASP 124 -14.969  -9.692   8.737
  910   2HB   ASP 124          HB1       ASP 124 -13.572  -8.727   9.197
  911    H    ASN 125           HN       ASN 125 -11.527  -8.595   6.233
  912    HA   ASN 125           HA       ASN 125  -9.520  -9.598   6.164
  913   1HB   ASN 125          HB2       ASN 125 -10.438 -11.071   8.626
  914   2HB   ASN 125          HB1       ASN 125  -8.777 -10.844   8.090
  915   1HD2  ASN 125          HD21      ASN 125  -7.801  -8.814   8.318
  916   2HD2  ASN 125          HD22      ASN 125  -8.485  -7.581   9.315
  917    H    LYS 126           HN       LYS 126 -12.245 -11.507   5.703
  918    HA   LYS 126           HA       LYS 126 -10.943 -14.030   5.373
  919   1HB   LYS 126          HB2       LYS 126 -13.055 -14.805   4.479
  920   2HB   LYS 126          HB1       LYS 126 -13.347 -13.825   5.905
  921   1HG   LYS 126          HG2       LYS 126 -14.967 -12.998   4.551
  922   2HG   LYS 126          HG1       LYS 126 -13.646 -11.918   4.099
  923   1HD   LYS 126          HD2       LYS 126 -13.139 -13.394   2.185
  924   2HD   LYS 126          HD1       LYS 126 -14.516 -14.410   2.624
  925   1HE   LYS 126          HE2       LYS 126 -16.008 -12.485   2.316
  926   2HE   LYS 126          HE1       LYS 126 -14.625 -11.492   1.849
  927   1HZ   LYS 126          HZ1       LYS 126 -14.265 -13.014  -0.034
  928   2HZ   LYS 126          HZ2       LYS 126 -15.794 -12.295  -0.101
  929   3HZ   LYS 126          HZ3       LYS 126 -15.637 -13.903   0.411
  930    H    GLN 127           HN       GLN 127 -10.715 -11.279   3.692
  931    HA   GLN 127           HA       GLN 127  -9.796 -10.681   1.726
  932   1HB   GLN 127          HB2       GLN 127  -8.334 -12.644   1.900
  933   2HB   GLN 127          HB1       GLN 127  -9.574 -13.635   1.145
  934   1HG   GLN 127          HG2       GLN 127  -9.419 -12.220  -0.874
  935   2HG   GLN 127          HG1       GLN 127  -8.093 -11.336  -0.116
  936   1HE2  GLN 127          HE21      GLN 127  -6.603 -11.964  -1.688
  937   2HE2  GLN 127          HE22      GLN 127  -5.987 -13.576  -1.792
  938    H    GLY 128           HN       GLY 128 -11.832  -9.764   1.264
  939   1HA   GLY 128          HA2       GLY 128 -13.178 -11.192  -0.932
  940   2HA   GLY 128          HA1       GLY 128 -14.008 -10.084   0.155
  941    H    PHE 129           HN       PHE 129 -10.813  -9.608  -1.265
  942    HA   PHE 129           HA       PHE 129 -11.649  -6.937  -1.946
  943   1HB   PHE 129          HB2       PHE 129  -9.364  -6.441  -2.330
  944   2HB   PHE 129          HB1       PHE 129  -9.377  -7.539  -0.968
  945    HD1  PHE 129           HD1      PHE 129  -8.204  -9.580  -1.039
  946    HD2  PHE 129           HD2      PHE 129  -8.717  -7.299  -4.592
  947    HE1  PHE 129           HE1      PHE 129  -6.613 -11.048  -2.203
  948    HE2  PHE 129           HE2      PHE 129  -7.125  -8.763  -5.759
  949    HZ   PHE 129           HZ       PHE 129  -5.985 -10.567  -4.538
  950    H    THR 130           HN       THR 130 -11.577  -6.013  -4.004
  951    HA   THR 130           HA       THR 130 -11.266  -7.841  -6.284
  952    HB   THR 130           HB       THR 130 -13.450  -5.757  -6.039
  953    HG1  THR 130           HG1      THR 130 -13.436  -8.031  -4.885
  954   1HG2  THR 130          HG21      THR 130 -12.915  -7.841  -8.161
  955   2HG2  THR 130          HG22      THR 130 -12.724  -6.098  -8.342
  956   3HG2  THR 130          HG23      THR 130 -14.328  -6.787  -8.093
  957    HA   PRO 131           HA       PRO 131  -8.631  -4.472  -7.606
  958   1HB   PRO 131          HB2       PRO 131  -8.274  -5.307 -10.176
  959   2HB   PRO 131          HB1       PRO 131  -7.403  -5.982  -8.797
  960   1HG   PRO 131          HG2       PRO 131  -9.782  -7.065 -10.243
  961   2HG   PRO 131          HG1       PRO 131  -8.364  -7.926  -9.616
  962   1HD   PRO 131          HD2       PRO 131 -10.756  -7.893  -8.332
  963   2HD   PRO 131          HD1       PRO 131  -9.204  -8.007  -7.479
  964    H    SER 132           HN       SER 132  -9.606  -2.583  -7.847
  965    HA   SER 132           HA       SER 132 -11.321  -2.148 -10.174
  966   1HB   SER 132          HB2       SER 132 -12.072  -1.195  -7.399
  967   2HB   SER 132          HB1       SER 132 -13.027  -1.047  -8.872
  968    HG   SER 132           HG       SER 132 -13.053  -3.394  -8.909
  969    H    GLY 133           HN       GLY 133 -10.149  -0.698 -11.253
  970   1HA   GLY 133          HA2       GLY 133  -9.710   1.780 -11.208
  971   2HA   GLY 133          HA1       GLY 133  -8.858   1.452  -9.699
  972    H    THR 134           HN       THR 134  -6.757   1.642 -10.029
  973    HA   THR 134           HA       THR 134  -5.573   0.291 -12.355
  974    HB   THR 134           HB       THR 134  -4.679   2.999 -11.335
  975    HG1  THR 134           HG1      THR 134  -6.283   2.335 -13.610
  976   1HG2  THR 134          HG21      THR 134  -3.411   3.103 -13.426
  977   2HG2  THR 134          HG22      THR 134  -4.007   1.504 -13.876
  978   3HG2  THR 134          HG23      THR 134  -2.939   1.686 -12.483
  979    H    THR 135           HN       THR 135  -3.314  -0.325 -12.004
  980    HA   THR 135           HA       THR 135  -2.680  -0.616  -9.166
  981    HB   THR 135           HB       THR 135  -2.591  -2.672 -10.518
  982    HG1  THR 135           HG1      THR 135  -1.146  -3.161  -9.089
  983   1HG2  THR 135          HG21      THR 135  -1.915  -1.779 -12.672
  984   2HG2  THR 135          HG22      THR 135  -0.780  -3.020 -12.141
  985   3HG2  THR 135          HG23      THR 135  -0.347  -1.317 -12.010
  986    H    GLY 136           HN       GLY 136  -1.550   0.965  -8.306
  987   1HA   GLY 136          HA2       GLY 136   0.068   2.684 -10.021
  988   2HA   GLY 136          HA1       GLY 136  -0.385   3.003  -8.353
  989    H    THR 137           HN       THR 137   2.142   2.310 -10.309
  990    HA   THR 137           HA       THR 137   3.585   0.586  -8.485
  991    HB   THR 137           HB       THR 137   4.714   2.066 -10.864
  992    HG1  THR 137           HG1      THR 137   2.936   0.885 -11.607
  993   1HG2  THR 137          HG21      THR 137   6.349   1.020  -9.381
  994   2HG2  THR 137          HG22      THR 137   6.279   0.172 -10.926
  995   3HG2  THR 137          HG23      THR 137   5.495  -0.518  -9.506
  996    H    THR 138           HN       THR 138   4.026   1.631  -6.594
  997    HA   THR 138           HA       THR 138   4.927   4.368  -6.562
  998    HB   THR 138           HB       THR 138   5.071   2.363  -4.294
  999    HG1  THR 138           HG1      THR 138   2.909   2.979  -5.457
 1000   1HG2  THR 138          HG21      THR 138   4.934   4.379  -2.887
 1001   2HG2  THR 138          HG22      THR 138   4.962   5.382  -4.337
 1002   3HG2  THR 138          HG23      THR 138   6.362   4.394  -3.921
 1003    H    LYS 139           HN       LYS 139   6.895   4.837  -7.284
 1004    HA   LYS 139           HA       LYS 139   8.897   2.706  -7.259
 1005   1HB   LYS 139          HB2       LYS 139   8.213   3.899  -9.393
 1006   2HB   LYS 139          HB1       LYS 139   9.013   5.325  -8.747
 1007   1HG   LYS 139          HG2       LYS 139  11.134   4.293  -8.821
 1008   2HG   LYS 139          HG1       LYS 139  10.427   2.699  -9.102
 1009   1HD   LYS 139          HD2       LYS 139  10.355   5.049 -10.994
 1010   2HD   LYS 139          HD1       LYS 139  11.339   3.594 -11.166
 1011   1HE   LYS 139          HE2       LYS 139   9.340   2.231 -11.355
 1012   2HE   LYS 139          HE1       LYS 139   8.322   3.647 -11.102
 1013   1HZ   LYS 139          HZ1       LYS 139  10.137   3.181 -13.406
 1014   2HZ   LYS 139          HZ2       LYS 139   9.214   4.582 -13.158
 1015   3HZ   LYS 139          HZ3       LYS 139   8.444   3.092 -13.424
 1016    H    LEU 140           HN       LEU 140  10.107   2.671  -5.601
 1017    HA   LEU 140           HA       LEU 140  10.971   5.186  -4.386
 1018   1HB   LEU 140          HB2       LEU 140   9.857   3.991  -2.744
 1019   2HB   LEU 140          HB1       LEU 140  10.451   2.444  -3.308
 1020    HG   LEU 140           HG       LEU 140  12.649   2.932  -2.391
 1021   1HD1  LEU 140          HD11      LEU 140  12.651   5.366  -2.640
 1022   2HD1  LEU 140          HD12      LEU 140  13.005   4.906  -0.975
 1023   3HD1  LEU 140          HD13      LEU 140  11.400   5.499  -1.404
 1024   1HD2  LEU 140          HD21      LEU 140  11.014   1.813  -0.989
 1025   2HD2  LEU 140          HD22      LEU 140  10.429   3.373  -0.411
 1026   3HD2  LEU 140          HD23      LEU 140  12.069   2.849  -0.028
 1027    H    THR 141           HN       THR 141  12.841   5.789  -5.170
 1028    HA   THR 141           HA       THR 141  14.957   3.789  -5.615
 1029    HB   THR 141           HB       THR 141  14.923   6.634  -6.642
 1030    HG1  THR 141           HG1      THR 141  13.782   4.280  -7.702
 1031   1HG2  THR 141          HG21      THR 141  17.111   5.515  -6.567
 1032   2HG2  THR 141          HG22      THR 141  16.584   5.800  -8.226
 1033   3HG2  THR 141          HG23      THR 141  16.459   4.186  -7.524
 1034    H    VAL 142           HN       VAL 142  16.500   3.739  -4.076
 1035    HA   VAL 142           HA       VAL 142  16.430   5.879  -2.096
 1036    HB   VAL 142           HB       VAL 142  17.857   3.235  -1.941
 1037   1HG1  VAL 142          HG11      VAL 142  17.161   5.244   0.188
 1038   2HG1  VAL 142          HG12      VAL 142  18.773   4.922  -0.455
 1039   3HG1  VAL 142          HG13      VAL 142  17.919   3.676   0.458
 1040   1HG2  VAL 142          HG21      VAL 142  15.460   2.908  -2.186
 1041   2HG2  VAL 142          HG22      VAL 142  15.160   4.034  -0.863
 1042   3HG2  VAL 142          HG23      VAL 142  15.981   2.504  -0.550
 1043    H    THR 143           HN       THR 143  17.768   7.485  -2.305
 1044    HA   THR 143           HA       THR 143  20.597   6.971  -2.369
 1045    HB   THR 143           HB       THR 143  19.378   8.796  -4.464
 1046    HG1  THR 143           HG1      THR 143  19.933   6.151  -4.492
 1047   1HG2  THR 143          HG21      THR 143  21.501   9.644  -3.607
 1048   2HG2  THR 143          HG22      THR 143  21.698   9.042  -5.252
 1049   3HG2  THR 143          HG23      THR 143  22.258   8.076  -3.886
  Start of MODEL    7
    1    H    GLU   1           H        GLU   1 -20.726   2.668 -11.776
    2    HA   GLU   1           HA       GLU   1 -19.799   4.634 -10.739
    3   1HB   GLU   1          HB2       GLU   1 -21.466   5.460  -8.806
    4   2HB   GLU   1          HB1       GLU   1 -21.357   6.237 -10.376
    5   1HG   GLU   1          HG2       GLU   1 -23.671   5.933  -9.732
    6   2HG   GLU   1          HG1       GLU   1 -23.295   4.959 -11.150
    7    H    GLU   2           HN       GLU   2 -18.647   2.767 -10.152
    8    HA   GLU   2           HA       GLU   2 -19.347   1.790  -7.468
    9   1HB   GLU   2          HB2       GLU   2 -18.248  -0.305  -7.987
   10   2HB   GLU   2          HB1       GLU   2 -19.512   0.017  -9.169
   11   1HG   GLU   2          HG2       GLU   2 -17.820   0.845 -10.729
   12   2HG   GLU   2          HG1       GLU   2 -16.580   0.460  -9.540
   13    H    CYS   3           HN       CYS   3 -17.275   1.008  -6.305
   14    HA   CYS   3           HA       CYS   3 -15.682   3.295  -5.964
   15   1HB   CYS   3          HB2       CYS   3 -15.320   0.469  -4.983
   16   2HB   CYS   3          HB1       CYS   3 -14.241   1.785  -4.538
   17    H    GLN   4           HN       GLN   4 -14.813   3.800  -8.008
   18    HA   GLN   4           HA       GLN   4 -12.679   2.106  -8.997
   19   1HB   GLN   4          HB2       GLN   4 -14.118   3.468 -10.533
   20   2HB   GLN   4          HB1       GLN   4 -13.467   4.924  -9.796
   21   1HG   GLN   4          HG2       GLN   4 -11.210   4.195 -10.521
   22   2HG   GLN   4          HG1       GLN   4 -11.970   2.871 -11.400
   23   1HE2  GLN   4          HE21      GLN   4 -10.367   5.000 -12.484
   24   2HE2  GLN   4          HE22      GLN   4 -11.367   5.857 -13.605
   25    H    VAL   5           HN       VAL   5 -10.913   2.060  -7.744
   26    HA   VAL   5           HA       VAL   5 -10.179   4.453  -6.244
   27    HB   VAL   5           HB       VAL   5  -8.936   1.694  -6.194
   28   1HG1  VAL   5          HG11      VAL   5  -7.867   2.436  -4.125
   29   2HG1  VAL   5          HG12      VAL   5  -8.578   4.038  -4.325
   30   3HG1  VAL   5          HG13      VAL   5  -7.387   3.449  -5.488
   31   1HG2  VAL   5          HG21      VAL   5 -10.912   2.984  -4.312
   32   2HG2  VAL   5          HG22      VAL   5 -10.118   1.430  -4.055
   33   3HG2  VAL   5          HG23      VAL   5 -11.234   1.638  -5.406
   34    H    ARG   6           HN       ARG   6  -8.980   5.889  -7.260
   35    HA   ARG   6           HA       ARG   6  -7.247   4.978  -9.417
   36   1HB   ARG   6          HB2       ARG   6  -8.107   7.767  -8.636
   37   2HB   ARG   6          HB1       ARG   6  -7.038   7.388  -9.981
   38   1HG   ARG   6          HG2       ARG   6  -8.919   5.919 -10.859
   39   2HG   ARG   6          HG1       ARG   6  -9.948   6.727  -9.674
   40   1HD   ARG   6          HD2       ARG   6  -8.345   8.106 -11.825
   41   2HD   ARG   6          HD1       ARG   6 -10.070   7.755 -11.912
   42    HE   ARG   6           HE       ARG   6  -9.645   9.210  -9.586
   43   1HH1  ARG   6          HH11      ARG   6  -9.277   9.668 -13.034
   44   2HH1  ARG   6          HH12      ARG   6  -9.621  11.372 -12.975
   45   1HH2  ARG   6          HH21      ARG   6 -10.086  11.478  -9.509
   46   2HH2  ARG   6          HH22      ARG   6 -10.073  12.398 -10.985
   47    H    VAL   7           HN       VAL   7  -5.504   4.146  -8.465
   48    HA   VAL   7           HA       VAL   7  -3.870   5.916  -6.789
   49    HB   VAL   7           HB       VAL   7  -3.489   2.973  -7.406
   50   1HG1  VAL   7          HG11      VAL   7  -1.390   4.128  -6.926
   51   2HG1  VAL   7          HG12      VAL   7  -1.817   3.015  -5.628
   52   3HG1  VAL   7          HG13      VAL   7  -2.070   4.747  -5.422
   53   1HG2  VAL   7          HG21      VAL   7  -5.473   3.335  -6.041
   54   2HG2  VAL   7          HG22      VAL   7  -4.530   4.297  -4.904
   55   3HG2  VAL   7          HG23      VAL   7  -4.194   2.576  -5.092
   56    H    GLY   8           HN       GLY   8  -2.418   7.094  -7.878
   57   1HA   GLY   8          HA2       GLY   8  -1.734   6.313 -10.602
   58   2HA   GLY   8          HA1       GLY   8  -1.409   7.872  -9.856
   59    H    ASP   9           HN       ASP   9   0.411   6.234 -11.372
   60    HA   ASP   9           HA       ASP   9   2.293   5.077  -9.565
   61   1HB   ASP   9          HB2       ASP   9   3.767   4.890 -11.464
   62   2HB   ASP   9          HB1       ASP   9   2.142   4.462 -11.986
   63    H    LEU  10           HN       LEU  10   4.175   5.934  -8.761
   64    HA   LEU  10           HA       LEU  10   4.965   8.634  -9.375
   65   1HB   LEU  10          HB2       LEU  10   4.699   9.553  -7.161
   66   2HB   LEU  10          HB1       LEU  10   3.141   9.010  -7.747
   67    HG   LEU  10           HG       LEU  10   4.745   7.196  -5.993
   68   1HD1  LEU  10          HD11      LEU  10   3.008   9.463  -5.021
   69   2HD1  LEU  10          HD12      LEU  10   4.760   9.350  -4.839
   70   3HD1  LEU  10          HD13      LEU  10   3.712   8.195  -4.016
   71   1HD2  LEU  10          HD21      LEU  10   1.786   7.677  -6.306
   72   2HD2  LEU  10          HD22      LEU  10   2.540   6.436  -5.306
   73   3HD2  LEU  10          HD23      LEU  10   2.700   6.371  -7.061
   74    H    THR  11           HN       THR  11   7.056   9.098  -8.641
   75    HA   THR  11           HA       THR  11   8.432   6.791  -7.452
   76    HB   THR  11           HB       THR  11   9.269   7.359  -9.692
   77    HG1  THR  11           HG1      THR  11  10.678   6.833  -7.658
   78   1HG2  THR  11          HG21      THR  11   8.782   9.756  -9.708
   79   2HG2  THR  11          HG22      THR  11  10.479   9.454 -10.081
   80   3HG2  THR  11          HG23      THR  11  10.016  10.021  -8.477
   81    H    VAL  12           HN       VAL  12   9.468   7.007  -5.581
   82    HA   VAL  12           HA       VAL  12   9.540   9.685  -4.343
   83    HB   VAL  12           HB       VAL  12   9.248   7.015  -2.940
   84   1HG1  VAL  12          HG11      VAL  12   9.107   9.821  -1.848
   85   2HG1  VAL  12          HG12      VAL  12  10.429   8.679  -1.603
   86   3HG1  VAL  12          HG13      VAL  12   8.833   8.338  -0.934
   87   1HG2  VAL  12          HG21      VAL  12   7.199   9.174  -3.425
   88   2HG2  VAL  12          HG22      VAL  12   6.962   7.746  -2.419
   89   3HG2  VAL  12          HG23      VAL  12   7.217   7.570  -4.155
   90    H    ALA  13           HN       ALA  13  11.526  10.395  -3.822
   91    HA   ALA  13           HA       ALA  13  13.737   8.455  -3.924
   92   1HB   ALA  13          HB1       ALA  13  13.778  11.446  -4.313
   93   2HB   ALA  13          HB2       ALA  13  13.884  10.227  -5.582
   94   3HB   ALA  13          HB3       ALA  13  15.182  10.382  -4.397
   95    H    LYS  14           HN       LYS  14  14.134   7.748  -1.922
   96    HA   LYS  14           HA       LYS  14  15.192   9.429   0.075
   97   1HB   LYS  14          HB2       LYS  14  12.301   9.021   0.156
   98   2HB   LYS  14          HB1       LYS  14  13.096   8.488   1.631
   99   1HG   LYS  14          HG2       LYS  14  13.886  10.618   2.125
  100   2HG   LYS  14          HG1       LYS  14  13.671  11.187   0.468
  101   1HD   LYS  14          HD2       LYS  14  11.413  10.436   2.323
  102   2HD   LYS  14          HD1       LYS  14  11.993  12.085   2.073
  103   1HE   LYS  14          HE2       LYS  14  10.868  10.264  -0.056
  104   2HE   LYS  14          HE1       LYS  14  10.016  11.605   0.709
  105   1HZ   LYS  14          HZ1       LYS  14  12.516  11.884  -0.877
  106   2HZ   LYS  14          HZ2       LYS  14  11.585  13.143  -0.228
  107   3HZ   LYS  14          HZ3       LYS  14  10.958  12.179  -1.474
  108    H    THR  15           HN       THR  15  15.072   8.095   2.309
  109    HA   THR  15           HA       THR  15  16.145   5.457   1.607
  110    HB   THR  15           HB       THR  15  17.234   5.588   3.856
  111    HG1  THR  15           HG1      THR  15  17.147   7.594   4.947
  112   1HG2  THR  15          HG21      THR  15  17.807   7.934   2.038
  113   2HG2  THR  15          HG22      THR  15  18.451   6.304   1.844
  114   3HG2  THR  15          HG23      THR  15  18.905   7.270   3.247
  115    H    ARG  16           HN       ARG  16  15.836   3.743   3.325
  116    HA   ARG  16           HA       ARG  16  13.049   3.718   4.204
  117   1HB   ARG  16          HB2       ARG  16  15.133   1.532   4.492
  118   2HB   ARG  16          HB1       ARG  16  13.411   1.383   4.849
  119   1HG   ARG  16          HG2       ARG  16  13.647   0.357   2.777
  120   2HG   ARG  16          HG1       ARG  16  13.041   1.965   2.386
  121   1HD   ARG  16          HD2       ARG  16  15.462   2.642   2.054
  122   2HD   ARG  16          HD1       ARG  16  15.848   0.926   2.115
  123    HE   ARG  16           HE       ARG  16  14.430   0.659   0.147
  124   1HH1  ARG  16          HH11      ARG  16  15.617   3.835   0.935
  125   2HH1  ARG  16          HH12      ARG  16  15.363   4.492  -0.647
  126   1HH2  ARG  16          HH21      ARG  16  14.121   1.498  -1.989
  127   2HH2  ARG  16          HH22      ARG  16  14.537   3.145  -2.320
  128    H    GLY  17           HN       GLY  17  16.044   4.629   5.322
  129   1HA   GLY  17          HA2       GLY  17  15.826   3.935   8.077
  130   2HA   GLY  17          HA1       GLY  17  16.903   5.144   7.390
  131    H    GLN  18           HN       GLN  18  14.518   6.439   6.103
  132    HA   GLN  18           HA       GLN  18  13.764   8.339   8.004
  133   1HB   GLN  18          HB2       GLN  18  12.159   7.367   5.629
  134   2HB   GLN  18          HB1       GLN  18  11.900   8.871   6.496
  135   1HG   GLN  18          HG2       GLN  18  14.301   8.143   4.841
  136   2HG   GLN  18          HG1       GLN  18  13.016   9.280   4.410
  137   1HE2  GLN  18          HE21      GLN  18  12.868  11.248   5.596
  138   2HE2  GLN  18          HE22      GLN  18  14.253  11.897   6.418
  139    H    LEU  19           HN       LEU  19  12.391   5.275   7.064
  140    HA   LEU  19           HA       LEU  19   9.983   5.641   8.583
  141   1HB   LEU  19          HB2       LEU  19  10.822   2.992   7.498
  142   2HB   LEU  19          HB1       LEU  19   9.222   3.707   7.592
  143    HG   LEU  19           HG       LEU  19  11.368   4.569   5.649
  144   1HD1  LEU  19          HD11      LEU  19  10.028   3.439   3.955
  145   2HD1  LEU  19          HD12      LEU  19   8.926   2.860   5.201
  146   3HD1  LEU  19          HD13      LEU  19  10.598   2.302   5.176
  147   1HD2  LEU  19          HD21      LEU  19   8.451   5.287   5.878
  148   2HD2  LEU  19          HD22      LEU  19   9.514   5.754   4.552
  149   3HD2  LEU  19          HD23      LEU  19   9.822   6.353   6.183
  150    H    THR  20           HN       THR  20  10.421   5.740  10.704
  151    HA   THR  20           HA       THR  20  11.764   3.478  11.974
  152    HB   THR  20           HB       THR  20  11.345   5.116  14.036
  153    HG1  THR  20           HG1      THR  20  11.936   7.217  12.443
  154   1HG2  THR  20          HG21      THR  20  13.542   4.364  13.294
  155   2HG2  THR  20          HG22      THR  20  13.570   6.095  13.634
  156   3HG2  THR  20          HG23      THR  20  13.510   5.524  11.967
  157    H    ASP  21           HN       ASP  21   9.879   2.232  11.329
  158    HA   ASP  21           HA       ASP  21   7.908   1.192  11.633
  159   1HB   ASP  21          HB2       ASP  21   8.053   2.587  14.302
  160   2HB   ASP  21          HB1       ASP  21   6.689   1.570  13.852
  161    H    ALA  22           HN       ALA  22   6.788   3.983  13.469
  162    HA   ALA  22           HA       ALA  22   4.772   4.394  11.403
  163   1HB   ALA  22          HB1       ALA  22   4.014   4.179  13.710
  164   2HB   ALA  22          HB2       ALA  22   3.615   5.765  13.050
  165   3HB   ALA  22          HB3       ALA  22   4.972   5.590  14.163
  166    H    ALA  23           HN       ALA  23   6.713   5.187  10.110
  167    HA   ALA  23           HA       ALA  23   6.558   8.106  10.141
  168   1HB   ALA  23          HB1       ALA  23   8.939   8.353   9.702
  169   2HB   ALA  23          HB2       ALA  23   9.163   6.609   9.837
  170   3HB   ALA  23          HB3       ALA  23   8.680   7.548  11.250
  171    HA   PRO  24           HA       PRO  24   5.887   6.877   5.873
  172   1HB   PRO  24          HB2       PRO  24   4.302   8.898   5.211
  173   2HB   PRO  24          HB1       PRO  24   3.752   7.660   6.346
  174   1HG   PRO  24          HG2       PRO  24   4.727  10.430   6.893
  175   2HG   PRO  24          HG1       PRO  24   3.417   9.525   7.673
  176   1HD   PRO  24          HD2       PRO  24   6.032   9.800   8.647
  177   2HD   PRO  24          HD1       PRO  24   4.841   8.606   9.186
  178    H    ILE  25           HN       ILE  25   6.691   7.498   3.892
  179    HA   ILE  25           HA       ILE  25   8.250   9.998   3.830
  180    HB   ILE  25           HB       ILE  25   9.437   8.790   1.869
  181   1HG1  ILE  25          HG12      ILE  25   8.419   6.441   3.465
  182   2HG1  ILE  25          HG11      ILE  25   7.958   6.865   1.821
  183   1HG2  ILE  25          HG21      ILE  25  10.510   9.509   3.925
  184   2HG2  ILE  25          HG22      ILE  25  11.120   7.933   3.415
  185   3HG2  ILE  25          HG23      ILE  25   9.956   8.044   4.734
  186   1HD1  ILE  25          HD11      ILE  25  10.718   6.070   2.704
  187   2HD1  ILE  25          HD12      ILE  25  10.229   6.470   1.058
  188   3HD1  ILE  25          HD13      ILE  25   9.566   5.042   1.852
  189    H    GLY  26           HN       GLY  26   6.569   7.761   1.593
  190   1HA   GLY  26          HA2       GLY  26   5.944  10.130  -0.051
  191   2HA   GLY  26          HA1       GLY  26   6.166   8.511  -0.695
  192    HA   PRO  27           HA       PRO  27   1.711   8.914   1.356
  193   1HB   PRO  27          HB2       PRO  27   1.327  11.755   0.640
  194   2HB   PRO  27          HB1       PRO  27   0.801  10.875   2.077
  195   1HG   PRO  27          HG2       PRO  27   2.825  12.626   2.173
  196   2HG   PRO  27          HG1       PRO  27   2.822  11.145   3.150
  197   1HD   PRO  27          HD2       PRO  27   4.328  11.759   0.636
  198   2HD   PRO  27          HD1       PRO  27   4.834  10.827   2.058
  199    H    VAL  28           HN       VAL  28   0.441   8.024  -0.107
  200    HA   VAL  28           HA       VAL  28   0.632   8.896  -2.897
  201    HB   VAL  28           HB       VAL  28  -0.652   6.397  -1.773
  202   1HG1  VAL  28          HG11      VAL  28   0.044   7.157  -4.605
  203   2HG1  VAL  28          HG12      VAL  28  -1.579   7.057  -3.922
  204   3HG1  VAL  28          HG13      VAL  28  -0.600   5.600  -4.086
  205   1HG2  VAL  28          HG21      VAL  28   1.321   5.210  -2.594
  206   2HG2  VAL  28          HG22      VAL  28   1.754   6.400  -1.366
  207   3HG2  VAL  28          HG23      VAL  28   2.049   6.745  -3.070
  208    H    THR  29           HN       THR  29  -0.956  10.016  -3.809
  209    HA   THR  29           HA       THR  29  -3.314  10.705  -2.387
  210    HB   THR  29           HB       THR  29  -2.762  11.146  -5.321
  211    HG1  THR  29           HG1      THR  29  -0.967  11.904  -4.131
  212   1HG2  THR  29          HG21      THR  29  -4.330  12.693  -3.276
  213   2HG2  THR  29          HG22      THR  29  -5.005  11.682  -4.551
  214   3HG2  THR  29          HG23      THR  29  -4.115  13.147  -4.965
  215    H    VAL  30           HN       VAL  30  -4.718   9.073  -2.048
  216    HA   VAL  30           HA       VAL  30  -5.430   7.316  -4.299
  217    HB   VAL  30           HB       VAL  30  -5.973   6.994  -1.340
  218   1HG1  VAL  30          HG11      VAL  30  -6.708   4.727  -1.927
  219   2HG1  VAL  30          HG12      VAL  30  -6.505   5.108  -3.638
  220   3HG1  VAL  30          HG13      VAL  30  -7.720   5.958  -2.683
  221   1HG2  VAL  30          HG21      VAL  30  -4.011   5.608  -3.170
  222   2HG2  VAL  30          HG22      VAL  30  -4.345   5.141  -1.503
  223   3HG2  VAL  30          HG23      VAL  30  -3.623   6.713  -1.851
  224    H    GLN  31           HN       GLN  31  -7.183   7.918  -5.372
  225    HA   GLN  31           HA       GLN  31  -9.354   9.181  -3.852
  226   1HB   GLN  31          HB2       GLN  31  -8.508  10.728  -5.477
  227   2HB   GLN  31          HB1       GLN  31  -8.578   9.516  -6.749
  228   1HG   GLN  31          HG2       GLN  31 -10.925   9.575  -6.823
  229   2HG   GLN  31          HG1       GLN  31 -11.029  10.450  -5.298
  230   1HE2  GLN  31          HE21      GLN  31  -8.667  11.313  -7.701
  231   2HE2  GLN  31          HE22      GLN  31  -9.411  12.810  -8.174
  232    H    ALA  32           HN       ALA  32 -10.755   7.664  -3.345
  233    HA   ALA  32           HA       ALA  32 -11.488   5.598  -5.269
  234   1HB   ALA  32          HB1       ALA  32 -12.741   4.598  -3.428
  235   2HB   ALA  32          HB2       ALA  32 -12.370   5.987  -2.407
  236   3HB   ALA  32          HB3       ALA  32 -11.075   4.920  -2.948
  237    H    LEU  33           HN       LEU  33 -12.958   6.166  -6.717
  238    HA   LEU  33           HA       LEU  33 -14.957   8.197  -6.000
  239   1HB   LEU  33          HB2       LEU  33 -13.366   8.470  -7.977
  240   2HB   LEU  33          HB1       LEU  33 -14.257   7.177  -8.752
  241    HG   LEU  33           HG       LEU  33 -14.834   9.561  -9.418
  242   1HD1  LEU  33          HD11      LEU  33 -16.257   7.674 -10.000
  243   2HD1  LEU  33          HD12      LEU  33 -17.223   9.095  -9.602
  244   3HD1  LEU  33          HD13      LEU  33 -17.060   7.783  -8.434
  245   1HD2  LEU  33          HD21      LEU  33 -14.847  10.553  -7.203
  246   2HD2  LEU  33          HD22      LEU  33 -16.193   9.514  -6.729
  247   3HD2  LEU  33          HD23      LEU  33 -16.421  10.740  -7.977
  248    H    GLY  34           HN       GLY  34 -17.046   7.630  -5.776
  249   1HA   GLY  34          HA2       GLY  34 -19.037   6.617  -6.532
  250   2HA   GLY  34          HA1       GLY  34 -18.077   5.407  -7.365
  251    H    CYS  35           HN       CYS  35 -17.512   6.236  -4.013
  252    HA   CYS  35           HA       CYS  35 -18.225   3.498  -3.325
  253   1HB   CYS  35          HB2       CYS  35 -16.600   5.596  -1.919
  254   2HB   CYS  35          HB1       CYS  35 -17.145   4.141  -1.090
  255    H    ASN  36           HN       ASN  36 -18.554   6.519  -1.443
  256    HA   ASN  36           HA       ASN  36 -20.273   7.394  -0.256
  257   1HB   ASN  36          HB2       ASN  36 -21.659   7.204  -2.233
  258   2HB   ASN  36          HB1       ASN  36 -21.983   5.508  -1.891
  259   1HD2  ASN  36          HD21      ASN  36 -23.503   4.966  -0.362
  260   2HD2  ASN  36          HD22      ASN  36 -24.552   6.130   0.375
  261    H    ALA  37           HN       ALA  37 -20.484   3.851  -0.480
  262    HA   ALA  37           HA       ALA  37 -20.334   3.676   2.401
  263   1HB   ALA  37          HB1       ALA  37 -22.331   2.277   2.641
  264   2HB   ALA  37          HB2       ALA  37 -22.730   2.563   0.946
  265   3HB   ALA  37          HB3       ALA  37 -22.737   3.903   2.093
  266    H    ARG  38           HN       ARG  38 -18.324   2.807   1.617
  267    HA   ARG  38           HA       ARG  38 -18.419  -0.068   1.308
  268   1HB   ARG  38          HB2       ARG  38 -18.605   0.883  -1.018
  269   2HB   ARG  38          HB1       ARG  38 -17.028   1.621  -0.775
  270   1HG   ARG  38          HG2       ARG  38 -16.499  -0.287  -1.942
  271   2HG   ARG  38          HG1       ARG  38 -16.251  -0.801  -0.273
  272   1HD   ARG  38          HD2       ARG  38 -18.783  -1.263  -1.840
  273   2HD   ARG  38          HD1       ARG  38 -17.484  -2.442  -1.692
  274    HE   ARG  38           HE       ARG  38 -17.960  -2.247   0.806
  275   1HH1  ARG  38          HH11      ARG  38 -20.386  -1.777  -1.663
  276   2HH1  ARG  38          HH12      ARG  38 -21.689  -2.383  -0.679
  277   1HH2  ARG  38          HH21      ARG  38 -19.663  -3.016   2.119
  278   2HH2  ARG  38          HH22      ARG  38 -21.274  -3.080   1.477
  279    H    GLN  39           HN       GLN  39 -16.472  -1.046   1.974
  280    HA   GLN  39           HA       GLN  39 -14.487   0.688   3.164
  281   1HB   GLN  39          HB2       GLN  39 -14.593  -2.342   2.992
  282   2HB   GLN  39          HB1       GLN  39 -13.465  -1.400   3.962
  283   1HG   GLN  39          HG2       GLN  39 -15.240  -0.550   5.335
  284   2HG   GLN  39          HG1       GLN  39 -16.454  -1.302   4.308
  285   1HE2  GLN  39          HE21      GLN  39 -14.944  -3.764   4.013
  286   2HE2  GLN  39          HE22      GLN  39 -15.095  -4.606   5.516
  287    H    VAL  40           HN       VAL  40 -12.464   1.054   2.339
  288    HA   VAL  40           HA       VAL  40 -12.000   0.068  -0.399
  289    HB   VAL  40           HB       VAL  40 -11.095   2.657   0.882
  290   1HG1  VAL  40          HG11      VAL  40 -10.165   3.225  -1.312
  291   2HG1  VAL  40          HG12      VAL  40 -10.596   1.624  -1.911
  292   3HG1  VAL  40          HG13      VAL  40  -9.386   1.793  -0.638
  293   1HG2  VAL  40          HG21      VAL  40 -12.531   3.713  -0.808
  294   2HG2  VAL  40          HG22      VAL  40 -13.452   2.665   0.271
  295   3HG2  VAL  40          HG23      VAL  40 -13.047   2.118  -1.358
  296    H    ALA  41           HN       ALA  41 -10.209  -1.113  -0.742
  297    HA   ALA  41           HA       ALA  41  -8.309  -1.352   1.478
  298   1HB   ALA  41          HB1       ALA  41  -9.175  -3.508  -0.437
  299   2HB   ALA  41          HB2       ALA  41  -9.812  -3.300   1.191
  300   3HB   ALA  41          HB3       ALA  41  -8.109  -3.696   0.958
  301    H    LEU  42           HN       LEU  42  -6.158  -1.733   0.962
  302    HA   LEU  42           HA       LEU  42  -5.380  -1.039  -1.775
  303   1HB   LEU  42          HB2       LEU  42  -3.667  -1.164   0.706
  304   2HB   LEU  42          HB1       LEU  42  -3.234  -0.455  -0.840
  305    HG   LEU  42           HG       LEU  42  -5.467   0.579   0.899
  306   1HD1  LEU  42          HD11      LEU  42  -3.361   0.784   2.079
  307   2HD1  LEU  42          HD12      LEU  42  -3.925   2.364   1.535
  308   3HD1  LEU  42          HD13      LEU  42  -2.627   1.544   0.668
  309   1HD2  LEU  42          HD21      LEU  42  -5.296   2.564  -0.508
  310   2HD2  LEU  42          HD22      LEU  42  -5.651   1.135  -1.478
  311   3HD2  LEU  42          HD23      LEU  42  -4.017   1.797  -1.449
  312    H    LYS  43           HN       LYS  43  -5.270  -2.840  -2.962
  313    HA   LYS  43           HA       LYS  43  -4.045  -5.241  -1.813
  314   1HB   LYS  43          HB2       LYS  43  -5.826  -4.761  -4.174
  315   2HB   LYS  43          HB1       LYS  43  -4.787  -6.170  -4.162
  316   1HG   LYS  43          HG2       LYS  43  -7.036  -6.702  -3.393
  317   2HG   LYS  43          HG1       LYS  43  -5.840  -6.966  -2.126
  318   1HD   LYS  43          HD2       LYS  43  -7.829  -5.919  -1.215
  319   2HD   LYS  43          HD1       LYS  43  -6.460  -4.815  -1.120
  320   1HE   LYS  43          HE2       LYS  43  -8.338  -3.560  -1.833
  321   2HE   LYS  43          HE1       LYS  43  -7.275  -3.752  -3.224
  322   1HZ   LYS  43          HZ1       LYS  43  -9.540  -4.099  -3.881
  323   2HZ   LYS  43          HZ2       LYS  43  -9.774  -5.258  -2.674
  324   3HZ   LYS  43          HZ3       LYS  43  -8.727  -5.582  -3.966
  325    H    ALA  44           HN       ALA  44  -1.998  -5.683  -2.243
  326    HA   ALA  44           HA       ALA  44  -0.580  -4.005  -4.124
  327   1HB   ALA  44          HB1       ALA  44   1.424  -5.167  -3.256
  328   2HB   ALA  44          HB2       ALA  44   0.368  -6.170  -2.258
  329   3HB   ALA  44          HB3       ALA  44   0.440  -4.430  -1.991
  330    H    ASP  45           HN       ASP  45   0.859  -4.894  -5.748
  331    HA   ASP  45           HA       ASP  45  -0.450  -7.038  -7.207
  332   1HB   ASP  45          HB2       ASP  45   0.247  -4.939  -8.352
  333   2HB   ASP  45          HB1       ASP  45   1.925  -5.332  -7.993
  334    H    THR  46           HN       THR  46   0.765  -8.852  -8.072
  335    HA   THR  46           HA       THR  46   1.906 -10.305  -6.010
  336    HB   THR  46           HB       THR  46   0.791 -11.230  -8.061
  337    HG1  THR  46           HG1      THR  46   3.338 -12.414  -7.558
  338   1HG2  THR  46          HG21      THR  46   2.051  -9.977  -9.752
  339   2HG2  THR  46          HG22      THR  46   2.163 -11.715 -10.017
  340   3HG2  THR  46          HG23      THR  46   3.517 -10.847  -9.299
  341    H    ASP  47           HN       ASP  47   3.485  -8.115  -8.187
  342    HA   ASP  47           HA       ASP  47   6.106  -9.086  -8.133
  343   1HB   ASP  47          HB2       ASP  47   4.878  -6.394  -8.459
  344   2HB   ASP  47          HB1       ASP  47   6.605  -6.465  -8.123
  345    H    ASN  48           HN       ASN  48   4.310  -7.249  -5.751
  346    HA   ASN  48           HA       ASN  48   6.545  -7.562  -3.859
  347   1HB   ASN  48          HB2       ASN  48   6.040  -5.345  -2.947
  348   2HB   ASN  48          HB1       ASN  48   6.435  -5.218  -4.658
  349   1HD2  ASN  48          HD21      ASN  48   4.062  -4.746  -2.245
  350   2HD2  ASN  48          HD22      ASN  48   2.850  -4.052  -3.265
  351    H    PHE  49           HN       PHE  49   3.878  -8.883  -4.512
  352    HA   PHE  49           HA       PHE  49   2.744  -8.869  -1.796
  353   1HB   PHE  49          HB2       PHE  49   1.372  -7.494  -3.331
  354   2HB   PHE  49          HB1       PHE  49   1.218  -8.861  -4.407
  355    HD1  PHE  49           HD1      PHE  49   0.319  -7.649  -1.006
  356    HD2  PHE  49           HD2      PHE  49  -0.547 -10.334  -4.199
  357    HE1  PHE  49           HE1      PHE  49  -1.840  -8.175   0.018
  358    HE2  PHE  49           HE2      PHE  49  -2.705 -10.879  -3.154
  359    HZ   PHE  49           HZ       PHE  49  -3.365  -9.786  -1.046
  360    H    GLU  50           HN       GLU  50   3.444 -10.832  -1.155
  361    HA   GLU  50           HA       GLU  50   3.316 -13.068  -3.022
  362   1HB   GLU  50          HB2       GLU  50   4.578 -12.744  -0.304
  363   2HB   GLU  50          HB1       GLU  50   4.495 -14.292  -1.135
  364   1HG   GLU  50          HG2       GLU  50   5.781 -11.836  -2.299
  365   2HG   GLU  50          HG1       GLU  50   6.654 -13.069  -1.389
  366    H    GLN  51           HN       GLN  51   1.190 -13.525  -3.161
  367    HA   GLN  51           HA       GLN  51  -0.702 -14.679  -2.712
  368   1HB   GLN  51          HB2       GLN  51   0.637 -15.455  -0.119
  369   2HB   GLN  51          HB1       GLN  51  -0.803 -16.199  -0.799
  370   1HG   GLN  51          HG2       GLN  51   1.965 -16.230  -1.980
  371   2HG   GLN  51          HG1       GLN  51   1.127 -17.579  -1.217
  372   1HE2  GLN  51          HE21      GLN  51   1.394 -15.598  -4.058
  373   2HE2  GLN  51          HE22      GLN  51   0.389 -16.573  -5.076
  374    H    GLY  52           HN       GLY  52   0.436 -13.036   0.226
  375   1HA   GLY  52          HA2       GLY  52  -1.782 -11.265   0.260
  376   2HA   GLY  52          HA1       GLY  52  -2.002 -12.551   1.445
  377    H    LYS  53           HN       LYS  53   1.092 -11.228   0.509
  378    HA   LYS  53           HA       LYS  53   1.184  -9.528   2.896
  379   1HB   LYS  53          HB2       LYS  53   3.386 -11.406   2.001
  380   2HB   LYS  53          HB1       LYS  53   3.537 -10.214   3.279
  381   1HG   LYS  53          HG2       LYS  53   1.624 -12.535   3.328
  382   2HG   LYS  53          HG1       LYS  53   3.206 -12.511   4.111
  383   1HD   LYS  53          HD2       LYS  53   2.538 -10.716   5.548
  384   2HD   LYS  53          HD1       LYS  53   1.018 -10.519   4.674
  385   1HE   LYS  53          HE2       LYS  53   1.842 -12.932   6.285
  386   2HE   LYS  53          HE1       LYS  53   0.677 -11.703   6.776
  387   1HZ   LYS  53          HZ1       LYS  53  -0.600 -13.453   5.952
  388   2HZ   LYS  53          HZ2       LYS  53   0.426 -13.719   4.629
  389   3HZ   LYS  53          HZ3       LYS  53  -0.564 -12.342   4.669
  390    H    PHE  54           HN       PHE  54   2.003  -7.525   2.390
  391    HA   PHE  54           HA       PHE  54   3.386  -7.374  -0.181
  392   1HB   PHE  54          HB2       PHE  54   2.566  -4.997  -0.338
  393   2HB   PHE  54          HB1       PHE  54   1.375  -6.265  -0.551
  394    HD1  PHE  54           HD1      PHE  54  -0.702  -5.634   0.244
  395    HD2  PHE  54           HD2      PHE  54   2.783  -4.455   2.383
  396    HE1  PHE  54           HE1      PHE  54  -2.112  -4.592   1.967
  397    HE2  PHE  54           HE2      PHE  54   1.375  -3.404   4.106
  398    HZ   PHE  54           HZ       PHE  54  -1.171  -3.367   3.747
  399    H    PHE  55           HN       PHE  55   5.190  -6.379  -0.394
  400    HA   PHE  55           HA       PHE  55   6.313  -4.785   1.781
  401   1HB   PHE  55          HB2       PHE  55   8.478  -6.003   1.562
  402   2HB   PHE  55          HB1       PHE  55   7.203  -7.032   2.195
  403    HD1  PHE  55           HD1      PHE  55   9.631  -6.556  -0.411
  404    HD2  PHE  55           HD2      PHE  55   6.083  -8.652   0.645
  405    HE1  PHE  55           HE1      PHE  55  10.082  -8.195  -2.188
  406    HE2  PHE  55           HE2      PHE  55   6.530 -10.301  -1.132
  407    HZ   PHE  55           HZ       PHE  55   8.552 -10.046  -2.567
  408    H    LEU  56           HN       LEU  56   8.617  -4.027   0.845
  409    HA   LEU  56           HA       LEU  56   8.157  -3.172  -1.930
  410   1HB   LEU  56          HB2       LEU  56  10.369  -2.194  -0.143
  411   2HB   LEU  56          HB1       LEU  56   9.685  -1.411  -1.553
  412    HG   LEU  56           HG       LEU  56   8.474  -1.636   1.194
  413   1HD1  LEU  56          HD11      LEU  56   9.234   0.720  -0.517
  414   2HD1  LEU  56          HD12      LEU  56  10.112   0.133   0.894
  415   3HD1  LEU  56          HD13      LEU  56   8.490   0.800   1.079
  416   1HD2  LEU  56          HD21      LEU  56   6.721  -2.041  -0.448
  417   2HD2  LEU  56          HD22      LEU  56   7.188  -0.578  -1.315
  418   3HD2  LEU  56          HD23      LEU  56   6.527  -0.463   0.315
  419    H    ILE  57           HN       ILE  57   9.355  -4.071  -3.544
  420    HA   ILE  57           HA       ILE  57  11.507  -5.879  -2.682
  421    HB   ILE  57           HB       ILE  57   9.677  -7.027  -3.827
  422   1HG1  ILE  57          HG12      ILE  57  11.011  -8.151  -5.607
  423   2HG1  ILE  57          HG11      ILE  57  12.229  -6.893  -5.447
  424   1HG2  ILE  57          HG21      ILE  57  10.337  -5.295  -6.202
  425   2HG2  ILE  57          HG22      ILE  57   8.874  -5.199  -5.220
  426   3HG2  ILE  57          HG23      ILE  57   9.197  -6.641  -6.184
  427   1HD1  ILE  57          HD11      ILE  57  12.878  -8.902  -4.256
  428   2HD1  ILE  57          HD12      ILE  57  11.400  -8.828  -3.296
  429   3HD1  ILE  57          HD13      ILE  57  12.622  -7.566  -3.134
  430    H    SER  58           HN       SER  58  13.500  -5.672  -3.420
  431    HA   SER  58           HA       SER  58  14.195  -3.195  -4.724
  432   1HB   SER  58          HB2       SER  58  15.513  -3.857  -2.805
  433   2HB   SER  58          HB1       SER  58  15.864  -5.424  -3.529
  434    HG   SER  58           HG       SER  58  17.303  -3.260  -3.725
  435    H    ASP  59           HN       ASP  59  15.352  -3.006  -6.638
  436    HA   ASP  59           HA       ASP  59  14.867  -4.831  -8.719
  437   1HB   ASP  59          HB2       ASP  59  15.287  -2.550  -9.273
  438   2HB   ASP  59          HB1       ASP  59  16.820  -2.550  -8.410
  439    H    ASN  60           HN       ASN  60  17.384  -4.589  -6.353
  440    HA   ASN  60           HA       ASN  60  19.214  -6.387  -7.633
  441   1HB   ASN  60          HB2       ASN  60  19.005  -5.497  -4.748
  442   2HB   ASN  60          HB1       ASN  60  20.335  -6.439  -5.413
  443   1HD2  ASN  60          HD21      ASN  60  21.765  -5.461  -6.859
  444   2HD2  ASN  60          HD22      ASN  60  21.901  -3.740  -6.973
  445    H    ASN  61           HN       ASN  61  16.291  -6.755  -6.024
  446    HA   ASN  61           HA       ASN  61  15.048  -8.519  -5.338
  447   1HB   ASN  61          HB2       ASN  61  17.087 -10.084  -6.927
  448   2HB   ASN  61          HB1       ASN  61  15.614 -10.773  -6.259
  449   1HD2  ASN  61          HD21      ASN  61  14.059  -8.335  -6.841
  450   2HD2  ASN  61          HD22      ASN  61  13.777  -8.371  -8.549
  451    H    ARG  62           HN       ARG  62  17.507  -7.677  -3.744
  452    HA   ARG  62           HA       ARG  62  18.164 -10.189  -2.407
  453   1HB   ARG  62          HB2       ARG  62  19.350  -7.423  -2.264
  454   2HB   ARG  62          HB1       ARG  62  19.793  -8.694  -1.135
  455   1HG   ARG  62          HG2       ARG  62  20.017  -9.081  -4.098
  456   2HG   ARG  62          HG1       ARG  62  21.296  -8.309  -3.160
  457   1HD   ARG  62          HD2       ARG  62  21.762 -10.675  -3.441
  458   2HD   ARG  62          HD1       ARG  62  21.455 -10.303  -1.747
  459    HE   ARG  62           HE       ARG  62  19.071 -11.137  -2.393
  460   1HH1  ARG  62          HH11      ARG  62  22.126 -12.437  -3.498
  461   2HH1  ARG  62          HH12      ARG  62  21.515 -14.058  -3.678
  462   1HH2  ARG  62          HH21      ARG  62  18.265 -13.256  -2.603
  463   2HH2  ARG  62          HH22      ARG  62  19.318 -14.514  -3.177
  464    H    ASP  63           HN       ASP  63  17.528  -6.888  -1.268
  465    HA   ASP  63           HA       ASP  63  16.339  -8.078   1.133
  466   1HB   ASP  63          HB2       ASP  63  17.845  -5.568   0.612
  467   2HB   ASP  63          HB1       ASP  63  16.627  -5.546   1.886
  468    H    LYS  64           HN       LYS  64  14.555  -7.003   2.146
  469    HA   LYS  64           HA       LYS  64  12.844  -5.440   0.391
  470   1HB   LYS  64          HB2       LYS  64  10.908  -6.968   0.904
  471   2HB   LYS  64          HB1       LYS  64  12.106  -7.622  -0.195
  472   1HG   LYS  64          HG2       LYS  64  11.585  -9.409   1.182
  473   2HG   LYS  64          HG1       LYS  64  13.084  -8.791   1.869
  474   1HD   LYS  64          HD2       LYS  64  10.753  -7.524   3.057
  475   2HD   LYS  64          HD1       LYS  64  10.708  -9.284   3.222
  476   1HE   LYS  64          HE2       LYS  64  12.925  -9.279   4.214
  477   2HE   LYS  64          HE1       LYS  64  13.043  -7.535   3.993
  478   1HZ   LYS  64          HZ1       LYS  64  11.149  -8.969   5.781
  479   2HZ   LYS  64          HZ2       LYS  64  11.133  -7.295   5.510
  480   3HZ   LYS  64          HZ3       LYS  64  12.471  -8.020   6.250
  481    H    LEU  65           HN       LEU  65  10.756  -4.875   1.645
  482    HA   LEU  65           HA       LEU  65  10.932  -5.051   4.506
  483   1HB   LEU  65          HB2       LEU  65  10.875  -2.687   4.971
  484   2HB   LEU  65          HB1       LEU  65  12.323  -3.106   4.085
  485    HG   LEU  65           HG       LEU  65   9.979  -2.038   2.572
  486   1HD1  LEU  65          HD11      LEU  65  10.764   0.240   2.958
  487   2HD1  LEU  65          HD12      LEU  65  11.966  -0.360   4.100
  488   3HD1  LEU  65          HD13      LEU  65  10.248  -0.514   4.470
  489   1HD2  LEU  65          HD21      LEU  65  11.752  -1.131   1.159
  490   2HD2  LEU  65          HD22      LEU  65  11.941  -2.872   1.370
  491   3HD2  LEU  65          HD23      LEU  65  12.968  -1.756   2.271
  492    H    TYR  66           HN       TYR  66   8.950  -5.372   5.254
  493    HA   TYR  66           HA       TYR  66   6.674  -5.048   3.542
  494   1HB   TYR  66          HB2       TYR  66   6.841  -5.714   6.493
  495   2HB   TYR  66          HB1       TYR  66   5.369  -5.775   5.530
  496    HD1  TYR  66           HD1      TYR  66   8.644  -7.351   6.111
  497    HD2  TYR  66           HD2      TYR  66   4.940  -7.612   4.027
  498    HE1  TYR  66           HE1      TYR  66   9.162  -9.671   5.490
  499    HE2  TYR  66           HE2      TYR  66   5.451  -9.934   3.405
  500    HH   TYR  66           HH       TYR  66   7.429 -11.378   3.126
  501    H    VAL  67           HN       VAL  67   4.978  -3.554   3.774
  502    HA   VAL  67           HA       VAL  67   5.700  -1.178   5.354
  503    HB   VAL  67           HB       VAL  67   4.664   0.200   3.546
  504   1HG1  VAL  67          HG11      VAL  67   7.061   0.069   3.801
  505   2HG1  VAL  67          HG12      VAL  67   6.648   0.096   2.086
  506   3HG1  VAL  67          HG13      VAL  67   7.110  -1.421   2.859
  507   1HG2  VAL  67          HG21      VAL  67   4.846  -2.380   1.991
  508   2HG2  VAL  67          HG22      VAL  67   4.514  -0.795   1.297
  509   3HG2  VAL  67          HG23      VAL  67   3.367  -1.521   2.424
  510    H    ASN  68           HN       ASN  68   4.022   0.152   6.029
  511    HA   ASN  68           HA       ASN  68   1.324  -1.021   5.872
  512   1HB   ASN  68          HB2       ASN  68   2.762   0.330   8.131
  513   2HB   ASN  68          HB1       ASN  68   1.020   0.532   8.000
  514   1HD2  ASN  68          HD21      ASN  68   2.540  -2.416   6.956
  515   2HD2  ASN  68          HD22      ASN  68   1.978  -3.402   8.268
  516    H    ILE  69           HN       ILE  69   0.196   0.101   4.446
  517    HA   ILE  69           HA       ILE  69   0.891   2.889   3.964
  518    HB   ILE  69           HB       ILE  69  -1.341   1.692   2.442
  519   1HG1  ILE  69          HG12      ILE  69   1.507   0.756   2.031
  520   2HG1  ILE  69          HG11      ILE  69   0.198  -0.239   2.655
  521   1HG2  ILE  69          HG21      ILE  69   1.143   3.224   1.683
  522   2HG2  ILE  69          HG22      ILE  69  -0.464   3.904   1.941
  523   3HG2  ILE  69          HG23      ILE  69  -0.175   2.811   0.588
  524   1HD1  ILE  69          HD11      ILE  69  -0.979  -0.014   0.531
  525   2HD1  ILE  69          HD12      ILE  69   0.629  -0.703   0.314
  526   3HD1  ILE  69          HD13      ILE  69   0.332   0.988  -0.090
  527    H    ARG  70           HN       ARG  70   0.069   3.854   5.817
  528    HA   ARG  70           HA       ARG  70  -2.827   3.554   6.251
  529   1HB   ARG  70          HB2       ARG  70  -1.379   2.727   8.114
  530   2HB   ARG  70          HB1       ARG  70  -0.720   4.349   8.281
  531   1HG   ARG  70          HG2       ARG  70  -2.831   5.215   8.973
  532   2HG   ARG  70          HG1       ARG  70  -3.644   3.701   8.576
  533   1HD   ARG  70          HD2       ARG  70  -3.356   3.824  10.953
  534   2HD   ARG  70          HD1       ARG  70  -2.292   2.573  10.317
  535    HE   ARG  70           HE       ARG  70  -0.999   5.120  10.584
  536   1HH1  ARG  70          HH11      ARG  70  -1.956   2.221  12.306
  537   2HH1  ARG  70          HH12      ARG  70  -0.722   2.388  13.525
  538   1HH2  ARG  70          HH21      ARG  70   0.612   5.347  12.170
  539   2HH2  ARG  70          HH22      ARG  70   0.759   4.159  13.437
  540    HA   PRO  71           HA       PRO  71  -3.581   7.757   5.094
  541   1HB   PRO  71          HB2       PRO  71  -5.021   7.748   7.716
  542   2HB   PRO  71          HB1       PRO  71  -5.538   8.379   6.149
  543   1HG   PRO  71          HG2       PRO  71  -6.441   6.037   7.030
  544   2HG   PRO  71          HG1       PRO  71  -6.044   6.273   5.319
  545   1HD   PRO  71          HD2       PRO  71  -4.582   4.754   7.403
  546   2HD   PRO  71          HD1       PRO  71  -4.632   4.507   5.646
  547    H    MET  72           HN       MET  72  -2.570   9.620   5.422
  548    HA   MET  72           HA       MET  72  -0.585   9.960   7.379
  549   1HB   MET  72          HB2       MET  72  -0.688  11.173   5.197
  550   2HB   MET  72          HB1       MET  72  -2.053  12.103   5.816
  551   1HG   MET  72          HG2       MET  72  -0.573  12.948   7.629
  552   2HG   MET  72          HG1       MET  72   0.776  12.127   6.844
  553   1HE   MET  72          HE1       MET  72  -2.280  14.001   5.189
  554   2HE   MET  72          HE2       MET  72  -1.604  15.616   4.989
  555   3HE   MET  72          HE3       MET  72  -1.884  14.973   6.606
  556    H    ASP  73           HN       ASP  73  -3.760  11.512   7.053
  557    HA   ASP  73           HA       ASP  73  -4.311  11.052   9.857
  558   1HB   ASP  73          HB2       ASP  73  -3.854  13.773   8.742
  559   2HB   ASP  73          HB1       ASP  73  -5.235  13.573   9.814
  560    H    ASN  74           HN       ASN  74  -6.185   9.965   9.645
  561    HA   ASN  74           HA       ASN  74  -8.474  11.121   8.417
  562   1HB   ASN  74          HB2       ASN  74  -6.733   9.714   6.672
  563   2HB   ASN  74          HB1       ASN  74  -8.169   8.719   6.893
  564   1HD2  ASN  74          HD21      ASN  74  -6.870  11.628   5.596
  565   2HD2  ASN  74          HD22      ASN  74  -8.290  12.133   4.745
  566    H    SER  75           HN       SER  75  -9.895   8.827   7.786
  567    HA   SER  75           HA       SER  75 -10.783   7.933  10.270
  568   1HB   SER  75          HB2       SER  75 -11.868   6.096   8.733
  569   2HB   SER  75          HB1       SER  75 -12.374   7.781   8.597
  570    HG   SER  75           HG       SER  75 -11.826   7.599   6.585
  571    H    ALA  76           HN       ALA  76 -10.994   5.565  10.835
  572    HA   ALA  76           HA       ALA  76  -8.323   4.552  11.203
  573   1HB   ALA  76          HB1       ALA  76 -10.958   3.410  12.118
  574   2HB   ALA  76          HB2       ALA  76  -9.961   4.544  13.030
  575   3HB   ALA  76          HB3       ALA  76  -9.355   2.927  12.674
  576    H    TRP  77           HN       TRP  77  -7.357   3.228   9.881
  577    HA   TRP  77           HA       TRP  77  -8.964   1.453   8.169
  578   1HB   TRP  77          HB2       TRP  77  -6.169   2.569   7.864
  579   2HB   TRP  77          HB1       TRP  77  -6.761   1.230   6.888
  580    HD1  TRP  77           HD1      TRP  77  -8.564   4.584   7.739
  581    HE1  TRP  77           HE1      TRP  77  -9.241   5.685   5.501
  582    HE3  TRP  77           HE3      TRP  77  -6.468   1.219   4.510
  583    HZ2  TRP  77           HZ2      TRP  77  -8.912   5.183   2.742
  584    HZ3  TRP  77           HZ3      TRP  77  -6.692   1.603   2.093
  585    HH2  TRP  77           HH2      TRP  77  -7.888   3.539   1.230
  586    H    THR  78           HN       THR  78  -8.791  -0.693   8.385
  587    HA   THR  78           HA       THR  78  -7.307  -1.800  10.580
  588    HB   THR  78           HB       THR  78  -8.786  -3.262   8.375
  589    HG1  THR  78           HG1      THR  78 -10.565  -3.220   9.855
  590   1HG2  THR  78          HG21      THR  78  -8.013  -4.089  11.177
  591   2HG2  THR  78          HG22      THR  78  -7.327  -4.711   9.676
  592   3HG2  THR  78          HG23      THR  78  -9.013  -5.035  10.077
  593    H    THR  79           HN       THR  79  -5.216  -2.311  10.462
  594    HA   THR  79           HA       THR  79  -3.932  -2.401   7.868
  595    HB   THR  79           HB       THR  79  -2.798  -1.018   9.403
  596    HG1  THR  79           HG1      THR  79  -0.764  -2.005   9.453
  597   1HG2  THR  79          HG21      THR  79  -3.719  -1.820  11.498
  598   2HG2  THR  79          HG22      THR  79  -1.958  -1.813  11.593
  599   3HG2  THR  79          HG23      THR  79  -2.821  -3.330  11.349
  600    H    ASP  80           HN       ASP  80  -3.804  -4.213   6.828
  601    HA   ASP  80           HA       ASP  80  -2.747  -6.559   8.252
  602   1HB   ASP  80          HB2       ASP  80  -5.174  -6.844   7.521
  603   2HB   ASP  80          HB1       ASP  80  -4.608  -6.703   5.860
  604    H    ASN  81           HN       ASN  81  -1.385  -7.925   6.756
  605    HA   ASN  81           HA       ASN  81   0.195  -6.131   5.126
  606   1HB   ASN  81          HB2       ASN  81   0.593  -8.952   6.053
  607   2HB   ASN  81          HB1       ASN  81   1.603  -8.268   4.786
  608   1HD2  ASN  81          HD21      ASN  81   2.997  -6.576   5.264
  609   2HD2  ASN  81          HD22      ASN  81   3.466  -6.218   6.891
  610    H    GLY  82           HN       GLY  82  -2.427  -8.129   4.550
  611   1HA   GLY  82          HA2       GLY  82  -1.619  -8.514   1.760
  612   2HA   GLY  82          HA1       GLY  82  -2.984  -9.295   2.535
  613    H    VAL  83           HN       VAL  83  -3.952  -6.880   3.784
  614    HA   VAL  83           HA       VAL  83  -4.760  -5.249   1.500
  615    HB   VAL  83           HB       VAL  83  -7.138  -5.348   2.205
  616   1HG1  VAL  83          HG11      VAL  83  -7.638  -7.554   1.250
  617   2HG1  VAL  83          HG12      VAL  83  -5.945  -8.011   1.437
  618   3HG1  VAL  83          HG13      VAL  83  -6.391  -6.711   0.332
  619   1HG2  VAL  83          HG21      VAL  83  -7.882  -7.187   3.662
  620   2HG2  VAL  83          HG22      VAL  83  -6.832  -6.050   4.511
  621   3HG2  VAL  83          HG23      VAL  83  -6.198  -7.605   3.973
  622    H    PHE  84           HN       PHE  84  -5.648  -3.209   2.119
  623    HA   PHE  84           HA       PHE  84  -5.384  -2.532   4.955
  624   1HB   PHE  84          HB2       PHE  84  -3.335  -1.939   3.305
  625   2HB   PHE  84          HB1       PHE  84  -4.348  -0.532   3.002
  626    HD1  PHE  84           HD1      PHE  84  -5.330   0.540   5.242
  627    HD2  PHE  84           HD2      PHE  84  -1.758  -1.753   4.963
  628    HE1  PHE  84           HE1      PHE  84  -4.490   1.611   7.289
  629    HE2  PHE  84           HE2      PHE  84  -0.910  -0.685   7.012
  630    HZ   PHE  84           HZ       PHE  84  -2.259   0.931   8.203
  631    H    TYR  85           HN       TYR  85  -7.400  -1.882   5.435
  632    HA   TYR  85           HA       TYR  85  -8.792  -0.157   3.532
  633   1HB   TYR  85          HB2       TYR  85 -10.813  -1.525   3.594
  634   2HB   TYR  85          HB1       TYR  85  -9.460  -2.435   2.944
  635    HD1  TYR  85           HD1      TYR  85 -12.181  -2.553   5.139
  636    HD2  TYR  85           HD2      TYR  85  -8.149  -3.872   4.768
  637    HE1  TYR  85           HE1      TYR  85 -12.621  -4.359   6.760
  638    HE2  TYR  85           HE2      TYR  85  -8.582  -5.679   6.377
  639    HH   TYR  85           HH       TYR  85 -10.191  -6.146   8.242
  640    H    LYS  86           HN       LYS  86 -10.253   1.220   4.413
  641    HA   LYS  86           HA       LYS  86 -10.152   1.631   7.231
  642   1HB   LYS  86          HB2       LYS  86 -11.679   3.465   6.870
  643   2HB   LYS  86          HB1       LYS  86 -10.430   3.502   5.640
  644   1HG   LYS  86          HG2       LYS  86 -11.956   2.617   3.999
  645   2HG   LYS  86          HG1       LYS  86 -13.209   2.412   5.227
  646   1HD   LYS  86          HD2       LYS  86 -13.144   4.865   5.624
  647   2HD   LYS  86          HD1       LYS  86 -12.002   5.015   4.289
  648   1HE   LYS  86          HE2       LYS  86 -14.819   3.942   4.092
  649   2HE   LYS  86          HE1       LYS  86 -14.290   5.549   3.597
  650   1HZ   LYS  86          HZ1       LYS  86 -13.433   2.967   2.426
  651   2HZ   LYS  86          HZ2       LYS  86 -12.797   4.474   1.994
  652   3HZ   LYS  86          HZ3       LYS  86 -14.429   4.130   1.701
  653    H    ASN  87           HN       ASN  87 -11.675   1.215   8.767
  654    HA   ASN  87           HA       ASN  87 -13.487  -0.934   8.168
  655   1HB   ASN  87          HB2       ASN  87 -14.110  -0.697  10.610
  656   2HB   ASN  87          HB1       ASN  87 -12.435  -1.094  10.279
  657   1HD2  ASN  87          HD21      ASN  87 -13.799   2.140   9.946
  658   2HD2  ASN  87          HD22      ASN  87 -12.899   2.832  11.245
  659    H    ASP  88           HN       ASP  88 -13.642   2.315   7.791
  660    HA   ASP  88           HA       ASP  88 -16.458   2.650   8.385
  661   1HB   ASP  88          HB2       ASP  88 -14.476   4.491   7.020
  662   2HB   ASP  88          HB1       ASP  88 -16.139   4.916   7.420
  663    H    VAL  89           HN       VAL  89 -18.082   2.769   6.884
  664    HA   VAL  89           HA       VAL  89 -17.375   1.841   4.200
  665    HB   VAL  89           HB       VAL  89 -19.879   1.482   3.951
  666   1HG1  VAL  89          HG11      VAL  89 -18.338  -0.351   4.347
  667   2HG1  VAL  89          HG12      VAL  89 -19.841  -0.617   5.230
  668   3HG1  VAL  89          HG13      VAL  89 -18.403  -0.058   6.085
  669   1HG2  VAL  89          HG21      VAL  89 -20.666   2.914   5.747
  670   2HG2  VAL  89          HG22      VAL  89 -19.802   1.938   6.934
  671   3HG2  VAL  89          HG23      VAL  89 -21.160   1.248   6.046
  672    H    GLY  90           HN       GLY  90 -16.948   3.435   2.860
  673   1HA   GLY  90          HA2       GLY  90 -18.858   5.078   1.766
  674   2HA   GLY  90          HA1       GLY  90 -18.125   6.038   3.042
  675    H    SER  91           HN       SER  91 -17.530   7.404   1.164
  676    HA   SER  91           HA       SER  91 -15.398   6.437  -0.507
  677   1HB   SER  91          HB2       SER  91 -16.446   9.250  -0.083
  678   2HB   SER  91          HB1       SER  91 -15.363   8.732  -1.378
  679    HG   SER  91           HG       SER  91 -17.223   8.481  -2.383
  680    H    TRP  92           HN       TRP  92 -13.433   8.262  -0.522
  681    HA   TRP  92           HA       TRP  92 -12.586   8.852   2.174
  682   1HB   TRP  92          HB2       TRP  92 -12.138   6.382   1.775
  683   2HB   TRP  92          HB1       TRP  92 -10.922   6.902   0.602
  684    HD1  TRP  92           HD1      TRP  92 -11.698   7.061   4.364
  685    HE1  TRP  92           HE1      TRP  92  -9.504   7.558   5.612
  686    HE3  TRP  92           HE3      TRP  92  -8.689   7.816   0.347
  687    HZ2  TRP  92           HZ2      TRP  92  -6.826   8.186   4.938
  688    HZ3  TRP  92           HZ3      TRP  92  -6.345   8.366   0.717
  689    HH2  TRP  92           HH2      TRP  92  -5.412   8.545   2.965
  690    H    GLY  93           HN       GLY  93 -11.179   8.259  -1.007
  691   1HA   GLY  93          HA2       GLY  93  -9.542   9.453  -2.161
  692   2HA   GLY  93          HA1       GLY  93 -10.824  10.636  -2.120
  693    H    GLY  94           HN       GLY  94  -7.777   9.651  -0.688
  694   1HA   GLY  94          HA2       GLY  94  -7.189  12.386   0.001
  695   2HA   GLY  94          HA1       GLY  94  -7.412  11.349   1.403
  696    H    THR  95           HN       THR  95  -5.251  11.600   2.054
  697    HA   THR  95           HA       THR  95  -3.293  10.329   0.270
  698    HB   THR  95           HB       THR  95  -1.623  11.710   1.724
  699    HG1  THR  95           HG1      THR  95  -3.133  13.844   1.925
  700   1HG2  THR  95          HG21      THR  95  -3.367  12.983  -0.389
  701   2HG2  THR  95          HG22      THR  95  -1.924  12.010  -0.672
  702   3HG2  THR  95          HG23      THR  95  -1.789  13.576   0.128
  703    H    ILE  96           HN       ILE  96  -2.484   8.508   0.929
  704    HA   ILE  96           HA       ILE  96  -2.368   7.886   3.806
  705    HB   ILE  96           HB       ILE  96  -1.944   5.516   2.984
  706   1HG1  ILE  96          HG12      ILE  96  -2.938   6.730   0.403
  707   2HG1  ILE  96          HG11      ILE  96  -1.299   6.162   0.699
  708   1HG2  ILE  96          HG21      ILE  96  -4.596   6.791   2.321
  709   2HG2  ILE  96          HG22      ILE  96  -4.092   6.186   3.899
  710   3HG2  ILE  96          HG23      ILE  96  -4.317   5.066   2.555
  711   1HD1  ILE  96          HD11      ILE  96  -3.789   4.475   0.672
  712   2HD1  ILE  96          HD12      ILE  96  -2.160   3.892   1.010
  713   3HD1  ILE  96          HD13      ILE  96  -2.552   4.540  -0.583
  714    H    GLY  97           HN       GLY  97  -0.365   7.055   4.641
  715   1HA   GLY  97          HA2       GLY  97   1.938   7.842   2.965
  716   2HA   GLY  97          HA1       GLY  97   1.907   7.937   4.721
  717    H    ILE  98           HN       ILE  98   3.805   6.504   2.954
  718    HA   ILE  98           HA       ILE  98   3.192   3.746   3.671
  719    HB   ILE  98           HB       ILE  98   5.349   4.938   1.926
  720   1HG1  ILE  98          HG12      ILE  98   3.070   3.039   1.375
  721   2HG1  ILE  98          HG11      ILE  98   3.067   4.758   0.999
  722   1HG2  ILE  98          HG21      ILE  98   6.122   2.671   1.479
  723   2HG2  ILE  98          HG22      ILE  98   4.974   2.032   2.654
  724   3HG2  ILE  98          HG23      ILE  98   6.302   3.062   3.189
  725   1HD1  ILE  98          HD11      ILE  98   3.510   3.436  -0.980
  726   2HD1  ILE  98          HD12      ILE  98   4.901   2.692  -0.193
  727   3HD1  ILE  98          HD13      ILE  98   4.915   4.418  -0.561
  728    H    TYR  99           HN       TYR  99   3.678   3.162   5.610
  729    HA   TYR  99           HA       TYR  99   6.117   4.167   6.909
  730   1HB   TYR  99          HB2       TYR  99   3.906   2.554   8.202
  731   2HB   TYR  99          HB1       TYR  99   5.143   3.515   8.996
  732    HD1  TYR  99           HD1      TYR  99   4.743   5.775   9.545
  733    HD2  TYR  99           HD2      TYR  99   2.081   3.765   6.915
  734    HE1  TYR  99           HE1      TYR  99   3.199   7.680   9.663
  735    HE2  TYR  99           HE2      TYR  99   0.526   5.665   7.031
  736    HH   TYR  99           HH       TYR  99   1.404   8.678   8.487
  737    H    VAL 100           HN       VAL 100   7.575   2.605   7.846
  738    HA   VAL 100           HA       VAL 100   7.609   0.092   6.409
  739    HB   VAL 100           HB       VAL 100   9.702   1.403   6.879
  740   1HG1  VAL 100          HG11      VAL 100   9.229   2.046   9.178
  741   2HG1  VAL 100          HG12      VAL 100  10.747   1.155   9.073
  742   3HG1  VAL 100          HG13      VAL 100   9.294   0.355   9.675
  743   1HG2  VAL 100          HG21      VAL 100   9.770  -0.934   6.200
  744   2HG2  VAL 100          HG22      VAL 100   9.627  -1.437   7.885
  745   3HG2  VAL 100          HG23      VAL 100  11.064  -0.571   7.343
  746    H    ASP 101           HN       ASP 101   7.134  -1.894   7.262
  747    HA   ASP 101           HA       ASP 101   5.815  -2.043   9.809
  748   1HB   ASP 101          HB2       ASP 101   5.133  -3.511   7.955
  749   2HB   ASP 101          HB1       ASP 101   6.729  -4.258   7.952
  750    H    GLY 102           HN       GLY 102   7.427  -1.242  11.194
  751   1HA   GLY 102          HA2       GLY 102   9.048  -1.641  12.823
  752   2HA   GLY 102          HA1       GLY 102   9.390  -3.190  12.065
  753    H    GLN 103           HN       GLN 103  10.545  -0.127  12.626
  754    HA   GLN 103           HA       GLN 103  11.851   0.973  10.617
  755   1HB   GLN 103          HB2       GLN 103  12.149   1.493  13.027
  756   2HB   GLN 103          HB1       GLN 103  13.264   0.140  13.151
  757   1HG   GLN 103          HG2       GLN 103  14.445   1.446  11.166
  758   2HG   GLN 103          HG1       GLN 103  13.631   2.808  11.934
  759   1HE2  GLN 103          HE21      GLN 103  14.104   3.250  14.156
  760   2HE2  GLN 103          HE22      GLN 103  15.624   2.761  14.836
  761    H    GLN 104           HN       GLN 104  12.651   0.040   8.843
  762    HA   GLN 104           HA       GLN 104  14.048  -2.467   8.894
  763   1HB   GLN 104          HB2       GLN 104  12.555  -1.618   7.022
  764   2HB   GLN 104          HB1       GLN 104  13.860  -0.523   6.589
  765   1HG   GLN 104          HG2       GLN 104  14.015  -2.384   5.151
  766   2HG   GLN 104          HG1       GLN 104  15.329  -2.532   6.318
  767   1HE2  GLN 104          HE21      GLN 104  15.509  -4.742   5.999
  768   2HE2  GLN 104          HE22      GLN 104  14.335  -5.866   6.590
  769    H    THR 105           HN       THR 105  14.926   0.747   9.379
  770    HA   THR 105           HA       THR 105  16.897   1.804   9.766
  771    HB   THR 105           HB       THR 105  18.329  -0.847   9.580
  772    HG1  THR 105           HG1      THR 105  16.778   0.161  11.766
  773   1HG2  THR 105          HG21      THR 105  19.702   0.117  11.370
  774   2HG2  THR 105          HG22      THR 105  18.711   1.577  11.347
  775   3HG2  THR 105          HG23      THR 105  19.698   1.157   9.946
  776    H    ASN 106           HN       ASN 106  15.970   0.882   6.978
  777    HA   ASN 106           HA       ASN 106  16.594   1.054   4.810
  778   1HB   ASN 106          HB2       ASN 106  17.228   3.343   5.542
  779   2HB   ASN 106          HB1       ASN 106  18.856   2.761   5.869
  780   1HD2  ASN 106          HD21      ASN 106  20.257   2.433   4.181
  781   2HD2  ASN 106          HD22      ASN 106  19.908   2.901   2.552
  782    H    THR 107           HN       THR 107  17.078  -1.218   4.914
  783    HA   THR 107           HA       THR 107  19.821  -2.053   5.127
  784    HB   THR 107           HB       THR 107  17.963  -3.561   5.767
  785    HG1  THR 107           HG1      THR 107  18.721  -5.292   4.017
  786   1HG2  THR 107          HG21      THR 107  17.301  -3.555   2.821
  787   2HG2  THR 107          HG22      THR 107  16.303  -2.902   4.121
  788   3HG2  THR 107          HG23      THR 107  16.599  -4.638   4.024
  789    HA   PRO 108           HA       PRO 108  21.774  -1.093   1.355
  790   1HB   PRO 108          HB2       PRO 108  21.616  -4.036   0.807
  791   2HB   PRO 108          HB1       PRO 108  22.964  -2.923   0.556
  792   1HG   PRO 108          HG2       PRO 108  22.759  -4.522   2.744
  793   2HG   PRO 108          HG1       PRO 108  23.578  -2.952   2.761
  794   1HD   PRO 108          HD2       PRO 108  21.128  -3.734   4.100
  795   2HD   PRO 108          HD1       PRO 108  22.037  -2.219   4.245
  796    HA   PRO 109           HA       PRO 109  18.017  -1.425  -1.163
  797   1HB   PRO 109          HB2       PRO 109  17.352   1.151  -1.149
  798   2HB   PRO 109          HB1       PRO 109  17.130   0.148   0.287
  799   1HG   PRO 109          HG2       PRO 109  19.128   2.258  -0.241
  800   2HG   PRO 109          HG1       PRO 109  18.486   1.676   1.302
  801   1HD   PRO 109          HD2       PRO 109  20.951   0.937   0.005
  802   2HD   PRO 109          HD1       PRO 109  20.314   0.380   1.568
  803    H    GLY 110           HN       GLY 110  17.338   0.643  -2.783
  804   1HA   GLY 110          HA2       GLY 110  19.245   1.863  -4.372
  805   2HA   GLY 110          HA1       GLY 110  18.945   0.274  -5.076
  806    H    ASN 111           HN       ASN 111  16.996  -0.187  -5.995
  807    HA   ASN 111           HA       ASN 111  14.991   1.971  -6.005
  808   1HB   ASN 111          HB2       ASN 111  16.202   1.756  -8.198
  809   2HB   ASN 111          HB1       ASN 111  15.593   0.107  -8.315
  810   1HD2  ASN 111          HD21      ASN 111  14.414   0.486 -10.152
  811   2HD2  ASN 111          HD22      ASN 111  12.989   1.458 -10.168
  812    H    TYR 112           HN       TYR 112  13.148   1.318  -5.099
  813    HA   TYR 112           HA       TYR 112  12.624  -1.566  -4.977
  814   1HB   TYR 112          HB2       TYR 112  12.029   0.650  -3.046
  815   2HB   TYR 112          HB1       TYR 112  11.045  -0.808  -3.045
  816    HD1  TYR 112           HD1      TYR 112  11.729  -2.646  -1.776
  817    HD2  TYR 112           HD2      TYR 112  14.604   0.278  -2.896
  818    HE1  TYR 112           HE1      TYR 112  13.411  -3.769  -0.379
  819    HE2  TYR 112           HE2      TYR 112  16.294  -0.841  -1.511
  820    HH   TYR 112           HH       TYR 112  16.418  -2.338   0.383
  821    H    THR 113           HN       THR 113  10.912  -2.344  -5.873
  822    HA   THR 113           HA       THR 113   9.062  -0.474  -7.171
  823    HB   THR 113           HB       THR 113   9.738  -3.342  -7.829
  824    HG1  THR 113           HG1      THR 113  11.135  -1.224  -8.292
  825   1HG2  THR 113          HG21      THR 113   8.044  -1.344  -9.348
  826   2HG2  THR 113          HG22      THR 113   7.439  -2.751  -8.475
  827   3HG2  THR 113          HG23      THR 113   8.461  -2.969  -9.894
  828    H    LEU 114           HN       LEU 114   7.102  -0.337  -6.331
  829    HA   LEU 114           HA       LEU 114   5.847  -2.752  -5.269
  830   1HB   LEU 114          HB2       LEU 114   4.764  -1.180  -3.523
  831   2HB   LEU 114          HB1       LEU 114   6.381  -1.791  -3.238
  832    HG   LEU 114           HG       LEU 114   6.150   0.856  -4.576
  833   1HD1  LEU 114          HD11      LEU 114   5.906   1.987  -2.414
  834   2HD1  LEU 114          HD12      LEU 114   5.655   0.427  -1.630
  835   3HD1  LEU 114          HD13      LEU 114   4.480   1.021  -2.803
  836   1HD2  LEU 114          HD21      LEU 114   8.118   1.315  -3.176
  837   2HD2  LEU 114          HD22      LEU 114   8.334  -0.113  -4.187
  838   3HD2  LEU 114          HD23      LEU 114   7.977  -0.295  -2.471
  839    H    THR 115           HN       THR 115   3.960  -3.086  -6.173
  840    HA   THR 115           HA       THR 115   2.751  -0.879  -7.695
  841    HB   THR 115           HB       THR 115   2.423  -3.815  -8.332
  842    HG1  THR 115           HG1      THR 115   4.120  -3.600  -9.780
  843   1HG2  THR 115          HG21      THR 115   1.838  -2.932 -10.562
  844   2HG2  THR 115          HG22      THR 115   2.034  -1.289  -9.949
  845   3HG2  THR 115          HG23      THR 115   0.761  -2.325  -9.304
  846    H    LEU 116           HN       LEU 116   0.681  -0.377  -7.245
  847    HA   LEU 116           HA       LEU 116  -0.691  -2.125  -5.321
  848   1HB   LEU 116          HB2       LEU 116  -0.512   0.880  -5.345
  849   2HB   LEU 116          HB1       LEU 116  -1.634  -0.010  -4.335
  850    HG   LEU 116           HG       LEU 116   0.159   0.541  -2.925
  851   1HD1  LEU 116          HD11      LEU 116  -0.531  -1.776  -2.695
  852   2HD1  LEU 116          HD12      LEU 116   1.176  -1.565  -2.309
  853   3HD1  LEU 116          HD13      LEU 116   0.701  -2.259  -3.860
  854   1HD2  LEU 116          HD21      LEU 116   2.035  -0.383  -5.081
  855   2HD2  LEU 116          HD22      LEU 116   2.517   0.113  -3.459
  856   3HD2  LEU 116          HD23      LEU 116   1.768   1.278  -4.551
  857    H    THR 117           HN       THR 117  -2.563  -2.851  -6.036
  858    HA   THR 117           HA       THR 117  -3.783  -1.563  -8.357
  859    HB   THR 117           HB       THR 117  -4.475  -4.214  -7.076
  860    HG1  THR 117           HG1      THR 117  -2.293  -3.588  -8.362
  861   1HG2  THR 117          HG21      THR 117  -5.143  -3.059  -9.788
  862   2HG2  THR 117          HG22      THR 117  -6.271  -3.285  -8.450
  863   3HG2  THR 117          HG23      THR 117  -5.545  -4.685  -9.238
  864    H    GLY 118           HN       GLY 118  -5.363  -0.156  -8.041
  865   1HA   GLY 118          HA2       GLY 118  -6.656   0.229  -5.554
  866   2HA   GLY 118          HA1       GLY 118  -7.132   0.952  -7.084
  867    H    GLY 119           HN       GLY 119  -8.705  -0.234  -4.862
  868   1HA   GLY 119          HA2       GLY 119 -10.838  -1.226  -6.264
  869   2HA   GLY 119          HA1       GLY 119  -9.874  -2.642  -5.861
  870    H    TYR 120           HN       TYR 120 -12.503  -2.158  -4.907
  871    HA   TYR 120           HA       TYR 120 -12.146  -1.208  -2.190
  872   1HB   TYR 120          HB2       TYR 120 -14.579  -1.433  -1.967
  873   2HB   TYR 120          HB1       TYR 120 -14.138  -0.437  -3.345
  874    HD1  TYR 120           HD1      TYR 120 -15.645  -3.586  -2.262
  875    HD2  TYR 120           HD2      TYR 120 -14.567  -1.209  -5.641
  876    HE1  TYR 120           HE1      TYR 120 -17.029  -5.014  -3.699
  877    HE2  TYR 120           HE2      TYR 120 -15.962  -2.641  -7.080
  878    HH   TYR 120           HH       TYR 120 -18.132  -5.021  -5.773
  879    H    TRP 121           HN       TRP 121 -13.780  -2.616  -0.695
  880    HA   TRP 121           HA       TRP 121 -12.948  -5.403  -0.848
  881   1HB   TRP 121          HB2       TRP 121 -11.140  -4.629   0.396
  882   2HB   TRP 121          HB1       TRP 121 -12.084  -3.369   1.177
  883    HD1  TRP 121           HD1      TRP 121 -13.932  -4.365   3.005
  884    HE1  TRP 121           HE1      TRP 121 -13.589  -6.191   4.767
  885    HE3  TRP 121           HE3      TRP 121  -9.873  -6.681   0.985
  886    HZ2  TRP 121           HZ2      TRP 121 -11.833  -8.296   5.247
  887    HZ3  TRP 121           HZ3      TRP 121  -8.918  -8.601   2.192
  888    HH2  TRP 121           HH2      TRP 121  -9.882  -9.389   4.262
  889    H    ALA 122           HN       ALA 122 -14.193  -6.791   0.468
  890    HA   ALA 122           HA       ALA 122 -16.619  -5.613   1.613
  891   1HB   ALA 122          HB1       ALA 122 -16.477  -8.148  -0.012
  892   2HB   ALA 122          HB2       ALA 122 -17.135  -6.606  -0.560
  893   3HB   ALA 122          HB3       ALA 122 -17.923  -7.486   0.753
  894    H    LYS 123           HN       LYS 123 -17.403  -6.569   3.435
  895    HA   LYS 123           HA       LYS 123 -17.512  -7.668   5.374
  896   1HB   LYS 123          HB2       LYS 123 -17.476  -9.665   3.770
  897   2HB   LYS 123          HB1       LYS 123 -15.801  -9.877   4.280
  898   1HG   LYS 123          HG2       LYS 123 -16.390 -10.386   6.459
  899   2HG   LYS 123          HG1       LYS 123 -17.972  -9.625   6.314
  900   1HD   LYS 123          HD2       LYS 123 -18.685 -11.431   4.812
  901   2HD   LYS 123          HD1       LYS 123 -17.106 -12.199   5.007
  902   1HE   LYS 123          HE2       LYS 123 -18.873 -13.162   6.467
  903   2HE   LYS 123          HE1       LYS 123 -17.486 -12.527   7.353
  904   1HZ   LYS 123          HZ1       LYS 123 -19.548 -11.880   8.412
  905   2HZ   LYS 123          HZ2       LYS 123 -20.100 -11.157   6.984
  906   3HZ   LYS 123          HZ3       LYS 123 -18.763 -10.506   7.800
  907    H    ASP 124           HN       ASP 124 -15.207  -9.495   6.349
  908    HA   ASP 124           HA       ASP 124 -13.310  -7.359   7.002
  909   1HB   ASP 124          HB2       ASP 124 -14.879  -8.955   9.033
  910   2HB   ASP 124          HB1       ASP 124 -13.460  -7.994   9.430
  911    H    ASN 125           HN       ASN 125 -11.402  -8.031   6.676
  912    HA   ASN 125           HA       ASN 125  -9.538  -9.265   6.385
  913   1HB   ASN 125          HB2       ASN 125 -10.247  -9.161   9.033
  914   2HB   ASN 125          HB1       ASN 125  -9.821 -10.849   8.786
  915   1HD2  ASN 125          HD21      ASN 125  -7.716 -11.367   8.107
  916   2HD2  ASN 125          HD22      ASN 125  -6.407 -10.253   8.305
  917    H    LYS 126           HN       LYS 126 -12.203 -10.824   5.666
  918    HA   LYS 126           HA       LYS 126 -11.047 -13.494   5.633
  919   1HB   LYS 126          HB2       LYS 126 -13.196 -14.181   4.600
  920   2HB   LYS 126          HB1       LYS 126 -13.383 -13.420   6.168
  921   1HG   LYS 126          HG2       LYS 126 -15.118 -12.555   4.891
  922   2HG   LYS 126          HG1       LYS 126 -13.896 -11.282   4.871
  923   1HD   LYS 126          HD2       LYS 126 -13.405 -11.601   2.657
  924   2HD   LYS 126          HD1       LYS 126 -13.864 -13.305   2.689
  925   1HE   LYS 126          HE2       LYS 126 -15.894 -11.125   3.021
  926   2HE   LYS 126          HE1       LYS 126 -15.376 -11.659   1.419
  927   1HZ   LYS 126          HZ1       LYS 126 -16.072 -13.906   1.974
  928   2HZ   LYS 126          HZ2       LYS 126 -17.372 -12.826   2.146
  929   3HZ   LYS 126          HZ3       LYS 126 -16.561 -13.408   3.521
  930    H    GLN 127           HN       GLN 127 -10.690 -10.812   3.956
  931    HA   GLN 127           HA       GLN 127  -9.765 -10.236   2.010
  932   1HB   GLN 127          HB2       GLN 127  -9.349 -13.188   1.825
  933   2HB   GLN 127          HB1       GLN 127  -9.026 -12.164   0.429
  934   1HG   GLN 127          HG2       GLN 127  -7.514 -10.799   1.804
  935   2HG   GLN 127          HG1       GLN 127  -7.785 -11.901   3.157
  936   1HE2  GLN 127          HE21      GLN 127  -7.564 -12.963  -0.156
  937   2HE2  GLN 127          HE22      GLN 127  -6.054 -13.783  -0.004
  938    H    GLY 128           HN       GLY 128 -12.397  -9.969   2.133
  939   1HA   GLY 128          HA2       GLY 128 -13.382 -10.769  -0.485
  940   2HA   GLY 128          HA1       GLY 128 -14.219  -9.746   0.695
  941    H    PHE 129           HN       PHE 129 -11.978  -9.778  -1.981
  942    HA   PHE 129           HA       PHE 129 -11.929  -6.847  -1.809
  943   1HB   PHE 129          HB2       PHE 129  -9.519  -6.817  -2.370
  944   2HB   PHE 129          HB1       PHE 129  -9.833  -7.596  -0.826
  945    HD1  PHE 129           HD1      PHE 129  -9.559 -10.022  -0.587
  946    HD2  PHE 129           HD2      PHE 129  -8.603  -8.024  -4.220
  947    HE1  PHE 129           HE1      PHE 129  -8.289 -11.992  -1.331
  948    HE2  PHE 129           HE2      PHE 129  -7.332  -9.991  -4.971
  949    HZ   PHE 129           HZ       PHE 129  -7.142 -11.961  -3.513
  950    H    THR 130           HN       THR 130 -12.190  -5.835  -3.709
  951    HA   THR 130           HA       THR 130 -12.192  -7.494  -6.149
  952    HB   THR 130           HB       THR 130 -13.794  -4.967  -5.686
  953    HG1  THR 130           HG1      THR 130 -14.422  -7.704  -5.215
  954   1HG2  THR 130          HG21      THR 130 -13.424  -5.545  -8.036
  955   2HG2  THR 130          HG22      THR 130 -15.115  -5.782  -7.590
  956   3HG2  THR 130          HG23      THR 130 -14.040  -7.173  -7.739
  957    HA   PRO 131           HA       PRO 131  -9.167  -4.490  -7.645
  958   1HB   PRO 131          HB2       PRO 131  -9.341  -5.775 -10.230
  959   2HB   PRO 131          HB1       PRO 131  -8.017  -5.833  -9.066
  960   1HG   PRO 131          HG2       PRO 131  -9.589  -7.985  -9.698
  961   2HG   PRO 131          HG1       PRO 131  -8.736  -7.801  -8.155
  962   1HD   PRO 131          HD2       PRO 131 -11.617  -7.298  -8.806
  963   2HD   PRO 131          HD1       PRO 131 -10.898  -8.025  -7.351
  964    H    SER 132           HN       SER 132 -10.144  -2.545  -7.908
  965    HA   SER 132           HA       SER 132 -11.715  -2.087 -10.311
  966   1HB   SER 132          HB2       SER 132 -12.788  -1.399  -7.562
  967   2HB   SER 132          HB1       SER 132 -13.576  -1.062  -9.100
  968    HG   SER 132           HG       SER 132 -13.647  -3.357  -9.435
  969    H    GLY 133           HN       GLY 133 -10.241  -0.655 -11.107
  970   1HA   GLY 133          HA2       GLY 133 -10.314   1.937 -10.880
  971   2HA   GLY 133          HA1       GLY 133  -9.450   1.586  -9.390
  972    H    THR 134           HN       THR 134  -7.518   2.437  -9.818
  973    HA   THR 134           HA       THR 134  -6.228   1.853 -12.385
  974    HB   THR 134           HB       THR 134  -5.190   3.750 -10.295
  975    HG1  THR 134           HG1      THR 134  -7.134   4.341 -12.312
  976   1HG2  THR 134          HG21      THR 134  -3.735   3.247 -12.195
  977   2HG2  THR 134          HG22      THR 134  -4.286   4.921 -12.251
  978   3HG2  THR 134          HG23      THR 134  -5.018   3.716 -13.310
  979    H    THR 135           HN       THR 135  -4.282   0.769 -12.513
  980    HA   THR 135           HA       THR 135  -3.250  -0.413 -10.041
  981    HB   THR 135           HB       THR 135  -2.310  -0.908 -12.877
  982    HG1  THR 135           HG1      THR 135  -4.635  -1.487 -12.065
  983   1HG2  THR 135          HG21      THR 135  -1.397  -2.979 -11.928
  984   2HG2  THR 135          HG22      THR 135  -1.965  -2.496 -10.329
  985   3HG2  THR 135          HG23      THR 135  -0.711  -1.556 -11.142
  986    H    GLY 136           HN       GLY 136  -2.135   1.182  -9.015
  987   1HA   GLY 136          HA2       GLY 136  -0.353   2.896 -10.581
  988   2HA   GLY 136          HA1       GLY 136  -0.849   3.162  -8.915
  989    H    THR 137           HN       THR 137   1.814   3.276  -9.922
  990    HA   THR 137           HA       THR 137   2.978   1.040  -8.407
  991    HB   THR 137           HB       THR 137   4.284   2.398 -10.772
  992    HG1  THR 137           HG1      THR 137   2.296   0.709 -10.843
  993   1HG2  THR 137          HG21      THR 137   4.974  -0.134  -9.272
  994   2HG2  THR 137          HG22      THR 137   5.831   1.403  -9.144
  995   3HG2  THR 137          HG23      THR 137   5.839   0.513 -10.667
  996    H    THR 138           HN       THR 138   3.747   1.831  -6.550
  997    HA   THR 138           HA       THR 138   4.906   4.510  -6.502
  998    HB   THR 138           HB       THR 138   4.887   2.602  -4.154
  999    HG1  THR 138           HG1      THR 138   2.740   3.763  -5.430
 1000   1HG2  THR 138          HG21      THR 138   4.783   5.611  -4.399
 1001   2HG2  THR 138          HG22      THR 138   6.184   4.650  -3.918
 1002   3HG2  THR 138          HG23      THR 138   4.754   4.706  -2.886
 1003    H    LYS 139           HN       LYS 139   7.008   4.781  -6.926
 1004    HA   LYS 139           HA       LYS 139   8.745   2.411  -6.673
 1005   1HB   LYS 139          HB2       LYS 139   8.316   2.966  -9.001
 1006   2HB   LYS 139          HB1       LYS 139   8.820   4.624  -8.721
 1007   1HG   LYS 139          HG2       LYS 139  11.080   4.000  -8.466
 1008   2HG   LYS 139          HG1       LYS 139  10.665   2.288  -8.329
 1009   1HD   LYS 139          HD2       LYS 139  11.592   2.875 -10.547
 1010   2HD   LYS 139          HD1       LYS 139   9.950   2.233 -10.637
 1011   1HE   LYS 139          HE2       LYS 139   9.144   4.621 -10.675
 1012   2HE   LYS 139          HE1       LYS 139  10.827   5.106 -10.872
 1013   1HZ   LYS 139          HZ1       LYS 139   9.704   4.964 -12.993
 1014   2HZ   LYS 139          HZ2       LYS 139   9.298   3.343 -12.709
 1015   3HZ   LYS 139          HZ3       LYS 139  10.924   3.787 -12.902
 1016    H    LEU 140           HN       LEU 140  10.018   2.585  -5.083
 1017    HA   LEU 140           HA       LEU 140  10.755   5.241  -4.104
 1018   1HB   LEU 140          HB2       LEU 140   9.599   4.048  -2.446
 1019   2HB   LEU 140          HB1       LEU 140  10.448   2.554  -2.799
 1020    HG   LEU 140           HG       LEU 140  12.520   3.596  -1.909
 1021   1HD1  LEU 140          HD11      LEU 140  10.639   5.779  -1.025
 1022   2HD1  LEU 140          HD12      LEU 140  11.941   5.936  -2.205
 1023   3HD1  LEU 140          HD13      LEU 140  12.318   5.607  -0.514
 1024   1HD2  LEU 140          HD21      LEU 140  11.206   2.098  -0.532
 1025   2HD2  LEU 140          HD22      LEU 140  10.174   3.436  -0.025
 1026   3HD2  LEU 140          HD23      LEU 140  11.872   3.401   0.454
 1027    H    THR 141           HN       THR 141  12.616   5.863  -4.914
 1028    HA   THR 141           HA       THR 141  14.841   3.949  -5.112
 1029    HB   THR 141           HB       THR 141  14.745   6.723  -6.308
 1030    HG1  THR 141           HG1      THR 141  13.756   4.260  -7.354
 1031   1HG2  THR 141          HG21      THR 141  16.309   4.246  -7.051
 1032   2HG2  THR 141          HG22      THR 141  16.944   5.629  -6.160
 1033   3HG2  THR 141          HG23      THR 141  16.424   5.820  -7.835
 1034    H    VAL 142           HN       VAL 142  16.809   4.419  -4.066
 1035    HA   VAL 142           HA       VAL 142  16.538   6.330  -1.883
 1036    HB   VAL 142           HB       VAL 142  17.361   4.141  -1.276
 1037   1HG1  VAL 142          HG11      VAL 142  18.405   3.469  -3.353
 1038   2HG1  VAL 142          HG12      VAL 142  19.561   3.333  -2.027
 1039   3HG1  VAL 142          HG13      VAL 142  19.659   4.692  -3.149
 1040   1HG2  VAL 142          HG21      VAL 142  18.151   6.017   0.039
 1041   2HG2  VAL 142          HG22      VAL 142  19.513   6.241  -1.059
 1042   3HG2  VAL 142          HG23      VAL 142  19.405   4.781  -0.074
 1043    H    THR 143           HN       THR 143  17.440   8.243  -1.824
 1044    HA   THR 143           HA       THR 143  19.720   8.830  -3.568
 1045    HB   THR 143           HB       THR 143  18.744  11.136  -3.901
 1046    HG1  THR 143           HG1      THR 143  17.162  10.909  -2.184
 1047   1HG2  THR 143          HG21      THR 143  17.204  10.456  -5.696
 1048   2HG2  THR 143          HG22      THR 143  17.181   8.816  -5.046
 1049   3HG2  THR 143          HG23      THR 143  18.677   9.485  -5.697
  Start of MODEL    8
    1    H    GLU   1           H        GLU   1 -23.735   3.195 -11.396
    2    HA   GLU   1           HA       GLU   1 -21.489   3.899 -11.994
    3   1HB   GLU   1          HB2       GLU   1 -22.399   3.952  -9.132
    4   2HB   GLU   1          HB1       GLU   1 -20.930   4.781  -9.633
    5   1HG   GLU   1          HG2       GLU   1 -23.682   5.261 -10.756
    6   2HG   GLU   1          HG1       GLU   1 -22.855   6.283  -9.579
    7    H    GLU   2           HN       GLU   2 -19.355   4.074 -10.324
    8    HA   GLU   2           HA       GLU   2 -18.383   1.299 -10.270
    9   1HB   GLU   2          HB2       GLU   2 -17.666   2.489 -12.329
   10   2HB   GLU   2          HB1       GLU   2 -16.890   3.707 -11.328
   11   1HG   GLU   2          HG2       GLU   2 -15.371   2.027 -10.437
   12   2HG   GLU   2          HG1       GLU   2 -16.161   0.789 -11.413
   13    H    CYS   3           HN       CYS   3 -17.012   0.770  -8.643
   14    HA   CYS   3           HA       CYS   3 -16.356   2.854  -6.676
   15   1HB   CYS   3          HB2       CYS   3 -17.501   0.889  -5.759
   16   2HB   CYS   3          HB1       CYS   3 -16.287  -0.172  -6.457
   17    H    GLN   4           HN       GLN   4 -14.607   3.806  -7.607
   18    HA   GLN   4           HA       GLN   4 -12.448   2.052  -8.553
   19   1HB   GLN   4          HB2       GLN   4 -13.234   3.327 -10.367
   20   2HB   GLN   4          HB1       GLN   4 -13.350   4.790  -9.403
   21   1HG   GLN   4          HG2       GLN   4 -10.926   4.917  -9.280
   22   2HG   GLN   4          HG1       GLN   4 -10.795   3.425 -10.209
   23   1HE2  GLN   4          HE21      GLN   4 -12.973   4.071 -12.002
   24   2HE2  GLN   4          HE22      GLN   4 -12.382   5.316 -13.054
   25    H    VAL   5           HN       VAL   5 -10.763   1.907  -7.284
   26    HA   VAL   5           HA       VAL   5 -10.094   4.092  -5.469
   27    HB   VAL   5           HB       VAL   5  -8.637   1.455  -5.799
   28   1HG1  VAL   5          HG11      VAL   5  -7.800   1.936  -3.545
   29   2HG1  VAL   5          HG12      VAL   5  -8.652   3.481  -3.567
   30   3HG1  VAL   5          HG13      VAL   5  -7.336   3.182  -4.702
   31   1HG2  VAL   5          HG21      VAL   5  -9.904   0.662  -3.861
   32   2HG2  VAL   5          HG22      VAL   5 -10.970   1.037  -5.215
   33   3HG2  VAL   5          HG23      VAL   5 -10.840   2.157  -3.861
   34    H    ARG   6           HN       ARG   6  -8.942   5.703  -6.293
   35    HA   ARG   6           HA       ARG   6  -7.295   5.256  -8.643
   36   1HB   ARG   6          HB2       ARG   6  -8.286   7.685  -7.210
   37   2HB   ARG   6          HB1       ARG   6  -6.919   7.821  -8.307
   38   1HG   ARG   6          HG2       ARG   6  -8.300   6.851 -10.102
   39   2HG   ARG   6          HG1       ARG   6  -9.672   6.821  -8.991
   40   1HD   ARG   6          HD2       ARG   6  -9.731   9.175  -8.842
   41   2HD   ARG   6          HD1       ARG   6  -8.149   9.339  -9.606
   42    HE   ARG   6           HE       ARG   6  -9.756   8.079 -11.459
   43   1HH1  ARG   6          HH11      ARG   6  -9.850  11.130  -9.713
   44   2HH1  ARG   6          HH12      ARG   6 -10.571  11.997 -11.039
   45   1HH2  ARG   6          HH21      ARG   6 -10.691   9.217 -13.181
   46   2HH2  ARG   6          HH22      ARG   6 -11.048  10.912 -13.008
   47    H    VAL   7           HN       VAL   7  -5.374   4.445  -8.308
   48    HA   VAL   7           HA       VAL   7  -3.601   5.836  -6.414
   49    HB   VAL   7           HB       VAL   7  -3.402   2.921  -7.223
   50   1HG1  VAL   7          HG11      VAL   7  -1.810   4.529  -5.224
   51   2HG1  VAL   7          HG12      VAL   7  -1.233   3.934  -6.781
   52   3HG1  VAL   7          HG13      VAL   7  -1.658   2.794  -5.505
   53   1HG2  VAL   7          HG21      VAL   7  -4.286   4.137  -4.608
   54   2HG2  VAL   7          HG22      VAL   7  -3.993   2.420  -4.886
   55   3HG2  VAL   7          HG23      VAL   7  -5.297   3.243  -5.742
   56    H    GLY   8           HN       GLY   8  -2.203   7.023  -7.556
   57   1HA   GLY   8          HA2       GLY   8  -1.543   6.213 -10.293
   58   2HA   GLY   8          HA1       GLY   8  -1.247   7.792  -9.581
   59    H    ASP   9           HN       ASP   9   0.833   7.011 -10.864
   60    HA   ASP   9           HA       ASP   9   2.585   5.546  -9.031
   61   1HB   ASP   9          HB2       ASP   9   4.102   5.248 -10.834
   62   2HB   ASP   9          HB1       ASP   9   2.503   4.938 -11.498
   63    H    LEU  10           HN       LEU  10   4.509   6.421  -8.289
   64    HA   LEU  10           HA       LEU  10   5.233   9.143  -8.873
   65   1HB   LEU  10          HB2       LEU  10   4.992  10.013  -6.624
   66   2HB   LEU  10          HB1       LEU  10   3.433   9.487  -7.225
   67    HG   LEU  10           HG       LEU  10   5.093   7.734  -5.430
   68   1HD1  LEU  10          HD11      LEU  10   4.801   9.854  -4.275
   69   2HD1  LEU  10          HD12      LEU  10   3.792   8.604  -3.543
   70   3HD1  LEU  10          HD13      LEU  10   3.070   9.811  -4.607
   71   1HD2  LEU  10          HD21      LEU  10   2.135   7.881  -6.005
   72   2HD2  LEU  10          HD22      LEU  10   2.905   6.768  -4.873
   73   3HD2  LEU  10          HD23      LEU  10   3.251   6.650  -6.599
   74    H    THR  11           HN       THR  11   7.331   9.628  -8.137
   75    HA   THR  11           HA       THR  11   8.784   7.294  -7.089
   76    HB   THR  11           HB       THR  11   9.863   9.428  -8.941
   77    HG1  THR  11           HG1      THR  11   8.321   7.916  -9.900
   78   1HG2  THR  11          HG21      THR  11  11.080   6.843  -7.945
   79   2HG2  THR  11          HG22      THR  11  11.586   8.473  -7.498
   80   3HG2  THR  11          HG23      THR  11  11.793   7.907  -9.155
   81    H    VAL  12           HN       VAL  12   9.485   7.587  -5.106
   82    HA   VAL  12           HA       VAL  12  10.362  10.285  -4.287
   83    HB   VAL  12           HB       VAL  12   9.555   8.088  -2.387
   84   1HG1  VAL  12          HG11      VAL  12   9.901  11.061  -2.042
   85   2HG1  VAL  12          HG12      VAL  12  10.973   9.799  -1.437
   86   3HG1  VAL  12          HG13      VAL  12   9.338   9.949  -0.793
   87   1HG2  VAL  12          HG21      VAL  12   7.617   8.636  -3.775
   88   2HG2  VAL  12          HG22      VAL  12   7.827  10.346  -3.394
   89   3HG2  VAL  12          HG23      VAL  12   7.399   9.205  -2.119
   90    H    ALA  13           HN       ALA  13  12.501  10.371  -4.418
   91    HA   ALA  13           HA       ALA  13  14.093   7.969  -4.211
   92   1HB   ALA  13          HB1       ALA  13  14.581   9.659  -5.912
   93   2HB   ALA  13          HB2       ALA  13  15.956   9.393  -4.838
   94   3HB   ALA  13          HB3       ALA  13  14.946  10.825  -4.640
   95    H    LYS  14           HN       LYS  14  14.156   7.252  -2.136
   96    HA   LYS  14           HA       LYS  14  15.638   8.848  -0.214
   97   1HB   LYS  14          HB2       LYS  14  12.840   7.842   0.349
   98   2HB   LYS  14          HB1       LYS  14  13.956   8.378   1.597
   99   1HG   LYS  14          HG2       LYS  14  12.908  10.080  -0.657
  100   2HG   LYS  14          HG1       LYS  14  12.328  10.100   1.011
  101   1HD   LYS  14          HD2       LYS  14  14.376  10.958   1.813
  102   2HD   LYS  14          HD1       LYS  14  15.199  10.621   0.288
  103   1HE   LYS  14          HE2       LYS  14  13.692  12.272  -0.810
  104   2HE   LYS  14          HE1       LYS  14  13.055  12.680   0.785
  105   1HZ   LYS  14          HZ1       LYS  14  15.191  13.437   1.478
  106   2HZ   LYS  14          HZ2       LYS  14  14.846  14.189  -0.007
  107   3HZ   LYS  14          HZ3       LYS  14  15.928  12.881   0.053
  108    H    THR  15           HN       THR  15  15.762   7.475   1.927
  109    HA   THR  15           HA       THR  15  16.470   4.739   1.154
  110    HB   THR  15           HB       THR  15  17.720   4.702   3.312
  111    HG1  THR  15           HG1      THR  15  17.898   7.296   3.816
  112   1HG2  THR  15          HG21      THR  15  18.421   7.001   1.484
  113   2HG2  THR  15          HG22      THR  15  18.875   5.313   1.248
  114   3HG2  THR  15          HG23      THR  15  19.521   6.217   2.619
  115    H    ARG  16           HN       ARG  16  16.067   3.063   2.931
  116    HA   ARG  16           HA       ARG  16  13.296   3.320   3.857
  117   1HB   ARG  16          HB2       ARG  16  15.201   0.972   4.139
  118   2HB   ARG  16          HB1       ARG  16  13.484   0.960   4.524
  119   1HG   ARG  16          HG2       ARG  16  13.508  -0.055   2.455
  120   2HG   ARG  16          HG1       ARG  16  13.188   1.630   2.032
  121   1HD   ARG  16          HD2       ARG  16  15.724   1.859   1.762
  122   2HD   ARG  16          HD1       ARG  16  15.760   0.099   1.778
  123    HE   ARG  16           HE       ARG  16  14.497   0.106  -0.236
  124   1HH1  ARG  16          HH11      ARG  16  15.688   3.210   0.776
  125   2HH1  ARG  16          HH12      ARG  16  15.429   3.986  -0.754
  126   1HH2  ARG  16          HH21      ARG  16  14.176   1.102  -2.305
  127   2HH2  ARG  16          HH22      ARG  16  14.573   2.773  -2.508
  128    H    GLY  17           HN       GLY  17  16.403   3.887   4.941
  129   1HA   GLY  17          HA2       GLY  17  15.907   3.478   7.753
  130   2HA   GLY  17          HA1       GLY  17  17.315   4.257   7.037
  131    H    GLN  18           HN       GLN  18  15.582   6.000   5.415
  132    HA   GLN  18           HA       GLN  18  15.300   8.245   7.070
  133   1HB   GLN  18          HB2       GLN  18  15.524   8.326   4.615
  134   2HB   GLN  18          HB1       GLN  18  13.944   7.583   4.441
  135   1HG   GLN  18          HG2       GLN  18  13.832   9.961   4.025
  136   2HG   GLN  18          HG1       GLN  18  12.907   9.538   5.467
  137   1HE2  GLN  18          HE21      GLN  18  13.600  10.228   7.459
  138   2HE2  GLN  18          HE22      GLN  18  14.826  11.437   7.657
  139    H    LEU  19           HN       LEU  19  13.225   5.582   6.368
  140    HA   LEU  19           HA       LEU  19  10.755   6.644   7.212
  141   1HB   LEU  19          HB2       LEU  19  11.768   3.801   7.112
  142   2HB   LEU  19          HB1       LEU  19  10.127   4.229   7.529
  143    HG   LEU  19           HG       LEU  19  10.632   3.416   5.129
  144   1HD1  LEU  19          HD11      LEU  19   9.042   5.937   5.593
  145   2HD1  LEU  19          HD12      LEU  19   8.481   4.290   5.880
  146   3HD1  LEU  19          HD13      LEU  19   8.851   4.823   4.240
  147   1HD2  LEU  19          HD21      LEU  19  11.433   6.304   4.835
  148   2HD2  LEU  19          HD22      LEU  19  11.143   5.164   3.521
  149   3HD2  LEU  19          HD23      LEU  19  12.489   4.906   4.633
  150    H    THR  20           HN       THR  20  13.069   4.549   8.794
  151    HA   THR  20           HA       THR  20  13.486   4.026  10.979
  152    HB   THR  20           HB       THR  20  12.333   6.729  11.694
  153    HG1  THR  20           HG1      THR  20  14.406   6.175  10.021
  154   1HG2  THR  20          HG21      THR  20  14.056   6.693  13.431
  155   2HG2  THR  20          HG22      THR  20  14.624   5.128  12.849
  156   3HG2  THR  20          HG23      THR  20  13.016   5.273  13.558
  157    H    ASP  21           HN       ASP  21  11.304   2.919  10.034
  158    HA   ASP  21           HA       ASP  21   9.504   1.718  10.676
  159   1HB   ASP  21          HB2       ASP  21  10.377   1.741  12.991
  160   2HB   ASP  21          HB1       ASP  21   9.556   3.273  13.272
  161    H    ALA  22           HN       ALA  22   8.717   4.784  12.325
  162    HA   ALA  22           HA       ALA  22   6.380   4.878  10.549
  163   1HB   ALA  22          HB1       ALA  22   5.850   4.485  12.910
  164   2HB   ALA  22          HB2       ALA  22   5.178   6.005  12.317
  165   3HB   ALA  22          HB3       ALA  22   6.624   6.016  13.325
  166    H    ALA  23           HN       ALA  23   7.539   6.072   8.950
  167    HA   ALA  23           HA       ALA  23   7.010   8.892   9.398
  168   1HB   ALA  23          HB1       ALA  23   9.644   7.990   8.236
  169   2HB   ALA  23          HB2       ALA  23   9.425   8.680   9.845
  170   3HB   ALA  23          HB3       ALA  23   9.089   9.656   8.412
  171    HA   PRO  24           HA       PRO  24   5.160   7.810   5.444
  172   1HB   PRO  24          HB2       PRO  24   3.828  10.161   5.134
  173   2HB   PRO  24          HB1       PRO  24   3.247   8.860   6.182
  174   1HG   PRO  24          HG2       PRO  24   4.759  11.344   6.908
  175   2HG   PRO  24          HG1       PRO  24   3.362  10.611   7.719
  176   1HD   PRO  24          HD2       PRO  24   5.885  10.285   8.625
  177   2HD   PRO  24          HD1       PRO  24   4.657   9.015   8.773
  178    H    ILE  25           HN       ILE  25   7.061   7.804   4.229
  179    HA   ILE  25           HA       ILE  25   8.277  10.338   3.491
  180    HB   ILE  25           HB       ILE  25   9.022   7.524   2.705
  181   1HG1  ILE  25          HG12      ILE  25   9.221   7.896   5.098
  182   2HG1  ILE  25          HG11      ILE  25  10.811   7.820   4.361
  183   1HG2  ILE  25          HG21      ILE  25  11.168   8.509   2.032
  184   2HG2  ILE  25          HG22      ILE  25  10.529  10.116   2.376
  185   3HG2  ILE  25          HG23      ILE  25   9.826   9.145   1.081
  186   1HD1  ILE  25          HD11      ILE  25  10.681   9.568   6.052
  187   2HD1  ILE  25          HD12      ILE  25   9.379  10.339   5.149
  188   3HD1  ILE  25          HD13      ILE  25  10.997  10.240   4.452
  189    H    GLY  26           HN       GLY  26   6.597   7.652   1.858
  190   1HA   GLY  26          HA2       GLY  26   6.233   9.510  -0.400
  191   2HA   GLY  26          HA1       GLY  26   6.422   7.781  -0.625
  192    HA   PRO  27           HA       PRO  27   1.925   8.270   1.426
  193   1HB   PRO  27          HB2       PRO  27   1.280  11.009   1.418
  194   2HB   PRO  27          HB1       PRO  27   1.614  10.021   2.843
  195   1HG   PRO  27          HG2       PRO  27   3.436  11.830   1.319
  196   2HG   PRO  27          HG1       PRO  27   3.337  11.548   3.069
  197   1HD   PRO  27          HD2       PRO  27   5.307  10.438   1.679
  198   2HD   PRO  27          HD1       PRO  27   4.454   9.500   2.918
  199    H    VAL  28           HN       VAL  28   0.648   7.715  -0.210
  200    HA   VAL  28           HA       VAL  28   0.708   9.324  -2.662
  201    HB   VAL  28           HB       VAL  28   1.323   7.009  -3.053
  202   1HG1  VAL  28          HG11      VAL  28  -0.249   5.167  -2.633
  203   2HG1  VAL  28          HG12      VAL  28  -1.329   6.295  -1.812
  204   3HG1  VAL  28          HG13      VAL  28   0.271   5.961  -1.146
  205   1HG2  VAL  28          HG21      VAL  28  -1.469   7.537  -4.068
  206   2HG2  VAL  28          HG22      VAL  28  -0.308   6.405  -4.760
  207   3HG2  VAL  28          HG23      VAL  28   0.022   8.136  -4.792
  208    H    THR  29           HN       THR  29  -1.135  10.194  -3.495
  209    HA   THR  29           HA       THR  29  -3.348  10.424  -1.666
  210    HB   THR  29           HB       THR  29  -2.680  12.461  -2.708
  211    HG1  THR  29           HG1      THR  29  -4.839  12.588  -2.524
  212   1HG2  THR  29          HG21      THR  29  -2.748  12.828  -5.132
  213   2HG2  THR  29          HG22      THR  29  -3.154  11.129  -5.378
  214   3HG2  THR  29          HG23      THR  29  -1.587  11.573  -4.701
  215    H    VAL  30           HN       VAL  30  -4.606   8.734  -1.574
  216    HA   VAL  30           HA       VAL  30  -5.440   7.325  -3.995
  217    HB   VAL  30           HB       VAL  30  -5.866   6.752  -1.051
  218   1HG1  VAL  30          HG11      VAL  30  -7.823   5.999  -2.296
  219   2HG1  VAL  30          HG12      VAL  30  -6.864   4.616  -1.770
  220   3HG1  VAL  30          HG13      VAL  30  -6.791   5.152  -3.448
  221   1HG2  VAL  30          HG21      VAL  30  -3.608   6.323  -1.843
  222   2HG2  VAL  30          HG22      VAL  30  -4.235   5.358  -3.181
  223   3HG2  VAL  30          HG23      VAL  30  -4.438   4.798  -1.520
  224    H    GLN  31           HN       GLN  31  -7.176   8.095  -5.009
  225    HA   GLN  31           HA       GLN  31  -9.218   9.503  -3.450
  226   1HB   GLN  31          HB2       GLN  31  -8.234  10.593  -5.488
  227   2HB   GLN  31          HB1       GLN  31  -8.962   9.320  -6.457
  228   1HG   GLN  31          HG2       GLN  31 -11.183  10.012  -5.634
  229   2HG   GLN  31          HG1       GLN  31 -10.417  11.338  -4.761
  230   1HE2  GLN  31          HE21      GLN  31 -11.492  12.928  -5.904
  231   2HE2  GLN  31          HE22      GLN  31 -11.142  13.275  -7.564
  232    H    ALA  32           HN       ALA  32 -11.099   8.564  -3.002
  233    HA   ALA  32           HA       ALA  32 -11.662   5.963  -4.207
  234   1HB   ALA  32          HB1       ALA  32 -12.932   7.298  -1.816
  235   2HB   ALA  32          HB2       ALA  32 -11.680   6.057  -1.768
  236   3HB   ALA  32          HB3       ALA  32 -13.282   5.670  -2.395
  237    H    LEU  33           HN       LEU  33 -12.532   6.422  -6.154
  238    HA   LEU  33           HA       LEU  33 -14.560   8.446  -6.479
  239   1HB   LEU  33          HB2       LEU  33 -12.773   7.774  -8.177
  240   2HB   LEU  33          HB1       LEU  33 -13.724   6.334  -8.457
  241    HG   LEU  33           HG       LEU  33 -14.862   9.096  -8.843
  242   1HD1  LEU  33          HD11      LEU  33 -12.878   8.872 -10.253
  243   2HD1  LEU  33          HD12      LEU  33 -14.352   8.849 -11.220
  244   3HD1  LEU  33          HD13      LEU  33 -13.495   7.346 -10.883
  245   1HD2  LEU  33          HD21      LEU  33 -16.486   7.279  -8.668
  246   2HD2  LEU  33          HD22      LEU  33 -15.634   6.387  -9.926
  247   3HD2  LEU  33          HD23      LEU  33 -16.428   7.913 -10.313
  248    H    GLY  34           HN       GLY  34 -16.592   8.097  -5.908
  249   1HA   GLY  34          HA2       GLY  34 -18.617   7.006  -5.621
  250   2HA   GLY  34          HA1       GLY  34 -17.955   5.636  -6.505
  251    H    CYS  35           HN       CYS  35 -18.270   3.921  -5.251
  252    HA   CYS  35           HA       CYS  35 -17.871   2.415  -3.596
  253   1HB   CYS  35          HB2       CYS  35 -15.842   4.481  -2.725
  254   2HB   CYS  35          HB1       CYS  35 -15.941   2.850  -2.077
  255    H    ASN  36           HN       ASN  36 -19.858   4.622  -3.266
  256    HA   ASN  36           HA       ASN  36 -19.728   5.781  -0.716
  257   1HB   ASN  36          HB2       ASN  36 -21.201   6.505  -2.630
  258   2HB   ASN  36          HB1       ASN  36 -22.275   5.173  -2.217
  259   1HD2  ASN  36          HD21      ASN  36 -20.486   7.184   0.044
  260   2HD2  ASN  36          HD22      ASN  36 -21.869   7.914   0.785
  261    H    ALA  37           HN       ALA  37 -20.941   2.655  -1.705
  262    HA   ALA  37           HA       ALA  37 -21.645   2.129   1.110
  263   1HB   ALA  37          HB1       ALA  37 -23.252   0.468   0.308
  264   2HB   ALA  37          HB2       ALA  37 -22.831   0.861  -1.359
  265   3HB   ALA  37          HB3       ALA  37 -23.613   2.069  -0.339
  266    H    ARG  38           HN       ARG  38 -19.042   1.892  -0.255
  267    HA   ARG  38           HA       ARG  38 -18.694  -1.033  -0.169
  268   1HB   ARG  38          HB2       ARG  38 -18.621   0.125  -2.468
  269   2HB   ARG  38          HB1       ARG  38 -17.092   0.805  -1.933
  270   1HG   ARG  38          HG2       ARG  38 -16.346  -1.026  -3.049
  271   2HG   ARG  38          HG1       ARG  38 -16.532  -1.716  -1.436
  272   1HD   ARG  38          HD2       ARG  38 -18.606  -1.858  -3.617
  273   2HD   ARG  38          HD1       ARG  38 -17.454  -3.136  -3.254
  274    HE   ARG  38           HE       ARG  38 -19.494  -2.212  -1.328
  275   1HH1  ARG  38          HH11      ARG  38 -17.657  -4.740  -2.895
  276   2HH1  ARG  38          HH12      ARG  38 -18.470  -6.028  -2.072
  277   1HH2  ARG  38          HH21      ARG  38 -20.578  -3.923  -0.224
  278   2HH2  ARG  38          HH22      ARG  38 -20.117  -5.572  -0.553
  279    H    GLN  39           HN       GLN  39 -16.659  -1.799   0.557
  280    HA   GLN  39           HA       GLN  39 -15.186   0.034   2.276
  281   1HB   GLN  39          HB2       GLN  39 -15.142  -2.970   1.928
  282   2HB   GLN  39          HB1       GLN  39 -14.014  -2.109   2.966
  283   1HG   GLN  39          HG2       GLN  39 -15.724  -1.416   4.427
  284   2HG   GLN  39          HG1       GLN  39 -16.987  -1.868   3.284
  285   1HE2  GLN  39          HE21      GLN  39 -15.780  -4.390   2.588
  286   2HE2  GLN  39          HE22      GLN  39 -16.009  -5.445   3.939
  287    H    VAL  40           HN       VAL  40 -13.215   0.801   1.767
  288    HA   VAL  40           HA       VAL  40 -12.164   0.054  -0.872
  289    HB   VAL  40           HB       VAL  40 -11.663   2.538   0.780
  290   1HG1  VAL  40          HG11      VAL  40 -10.522   3.398  -1.224
  291   2HG1  VAL  40          HG12      VAL  40 -10.696   1.818  -1.987
  292   3HG1  VAL  40          HG13      VAL  40  -9.704   1.995  -0.540
  293   1HG2  VAL  40          HG21      VAL  40 -12.939   3.691  -0.968
  294   2HG2  VAL  40          HG22      VAL  40 -13.910   2.470  -0.147
  295   3HG2  VAL  40          HG23      VAL  40 -13.255   2.144  -1.752
  296    H    ALA  41           HN       ALA  41 -10.461  -1.253  -0.882
  297    HA   ALA  41           HA       ALA  41  -8.584  -1.168   1.360
  298   1HB   ALA  41          HB1       ALA  41  -8.076  -3.484   0.905
  299   2HB   ALA  41          HB2       ALA  41  -9.135  -3.470  -0.506
  300   3HB   ALA  41          HB3       ALA  41  -9.820  -3.302   1.108
  301    H    LEU  42           HN       LEU  42  -6.344  -1.743   0.740
  302    HA   LEU  42           HA       LEU  42  -5.716  -0.987  -2.031
  303   1HB   LEU  42          HB2       LEU  42  -4.128  -0.530   0.496
  304   2HB   LEU  42          HB1       LEU  42  -3.521  -0.224  -1.123
  305    HG   LEU  42           HG       LEU  42  -6.031   1.101  -0.139
  306   1HD1  LEU  42          HD11      LEU  42  -4.305   1.648   1.482
  307   2HD1  LEU  42          HD12      LEU  42  -4.649   3.047   0.463
  308   3HD1  LEU  42          HD13      LEU  42  -3.194   2.088   0.183
  309   1HD2  LEU  42          HD21      LEU  42  -3.991   1.836  -2.237
  310   2HD2  LEU  42          HD22      LEU  42  -5.438   2.760  -1.831
  311   3HD2  LEU  42          HD23      LEU  42  -5.589   1.150  -2.536
  312    H    LYS  43           HN       LYS  43  -5.251  -2.783  -3.115
  313    HA   LYS  43           HA       LYS  43  -3.762  -4.886  -1.713
  314   1HB   LYS  43          HB2       LYS  43  -5.394  -5.087  -4.252
  315   2HB   LYS  43          HB1       LYS  43  -4.567  -6.421  -3.446
  316   1HG   LYS  43          HG2       LYS  43  -6.608  -4.737  -2.090
  317   2HG   LYS  43          HG1       LYS  43  -7.047  -6.193  -2.989
  318   1HD   LYS  43          HD2       LYS  43  -6.038  -7.569  -1.433
  319   2HD   LYS  43          HD1       LYS  43  -4.928  -6.306  -0.886
  320   1HE   LYS  43          HE2       LYS  43  -6.639  -6.796   0.797
  321   2HE   LYS  43          HE1       LYS  43  -6.758  -5.138   0.205
  322   1HZ   LYS  43          HZ1       LYS  43  -8.570  -5.810  -1.229
  323   2HZ   LYS  43          HZ2       LYS  43  -8.931  -6.195   0.378
  324   3HZ   LYS  43          HZ3       LYS  43  -8.447  -7.410  -0.695
  325    H    ALA  44           HN       ALA  44  -1.767  -5.053  -2.105
  326    HA   ALA  44           HA       ALA  44  -0.462  -3.539  -4.126
  327   1HB   ALA  44          HB1       ALA  44   0.627  -3.939  -2.013
  328   2HB   ALA  44          HB2       ALA  44   1.578  -4.660  -3.312
  329   3HB   ALA  44          HB3       ALA  44   0.576  -5.680  -2.279
  330    H    ASP  45           HN       ASP  45   0.841  -4.382  -5.816
  331    HA   ASP  45           HA       ASP  45  -0.445  -6.470  -7.291
  332   1HB   ASP  45          HB2       ASP  45   0.653  -4.482  -8.346
  333   2HB   ASP  45          HB1       ASP  45   2.214  -5.122  -7.835
  334    H    THR  46           HN       THR  46   0.656  -8.448  -8.018
  335    HA   THR  46           HA       THR  46   1.441  -9.918  -5.777
  336    HB   THR  46           HB       THR  46   0.360 -10.825  -7.852
  337    HG1  THR  46           HG1      THR  46   2.434 -11.991  -6.400
  338   1HG2  THR  46          HG21      THR  46   3.192 -10.779  -8.893
  339   2HG2  THR  46          HG22      THR  46   1.826  -9.868  -9.535
  340   3HG2  THR  46          HG23      THR  46   1.842 -11.627  -9.649
  341    H    ASP  47           HN       ASP  47   3.348  -8.003  -7.908
  342    HA   ASP  47           HA       ASP  47   5.860  -9.242  -7.587
  343   1HB   ASP  47          HB2       ASP  47   5.018  -6.420  -8.172
  344   2HB   ASP  47          HB1       ASP  47   6.716  -6.816  -7.931
  345    H    ASN  48           HN       ASN  48   4.075  -6.979  -5.581
  346    HA   ASN  48           HA       ASN  48   6.155  -7.251  -3.512
  347   1HB   ASN  48          HB2       ASN  48   5.621  -4.928  -2.794
  348   2HB   ASN  48          HB1       ASN  48   6.305  -4.990  -4.413
  349   1HD2  ASN  48          HD21      ASN  48   3.754  -3.935  -2.501
  350   2HD2  ASN  48          HD22      ASN  48   2.724  -3.362  -3.767
  351    H    PHE  49           HN       PHE  49   3.506  -8.544  -4.173
  352    HA   PHE  49           HA       PHE  49   2.378  -8.361  -1.457
  353   1HB   PHE  49          HB2       PHE  49   0.834  -7.348  -3.129
  354   2HB   PHE  49          HB1       PHE  49   0.846  -8.846  -4.035
  355    HD1  PHE  49           HD1      PHE  49  -0.673  -6.986  -1.381
  356    HD2  PHE  49           HD2      PHE  49  -0.165 -10.926  -2.938
  357    HE1  PHE  49           HE1      PHE  49  -2.592  -7.764  -0.057
  358    HE2  PHE  49           HE2      PHE  49  -2.092 -11.686  -1.638
  359    HZ   PHE  49           HZ       PHE  49  -3.391 -10.103  -0.309
  360    H    GLU  50           HN       GLU  50   3.081 -10.181  -0.501
  361    HA   GLU  50           HA       GLU  50   3.153 -12.657  -2.084
  362   1HB   GLU  50          HB2       GLU  50   4.710 -13.512  -0.348
  363   2HB   GLU  50          HB1       GLU  50   5.326 -12.092  -1.178
  364   1HG   GLU  50          HG2       GLU  50   4.912 -10.704   0.691
  365   2HG   GLU  50          HG1       GLU  50   3.925 -11.933   1.474
  366    H    GLN  51           HN       GLN  51   1.279 -13.706  -1.852
  367    HA   GLN  51           HA       GLN  51  -0.307 -15.027  -0.891
  368   1HB   GLN  51          HB2       GLN  51   1.441 -15.875   0.594
  369   2HB   GLN  51          HB1       GLN  51   1.210 -14.507   1.672
  370   1HG   GLN  51          HG2       GLN  51  -1.168 -15.305   1.971
  371   2HG   GLN  51          HG1       GLN  51  -0.676 -16.780   1.140
  372   1HE2  GLN  51          HE21      GLN  51   1.466 -15.013   3.257
  373   2HE2  GLN  51          HE22      GLN  51   1.478 -16.179   4.538
  374    H    GLY  52           HN       GLY  52   0.466 -12.385   1.341
  375   1HA   GLY  52          HA2       GLY  52  -1.918 -10.960   0.910
  376   2HA   GLY  52          HA1       GLY  52  -2.093 -11.949   2.361
  377    H    LYS  53           HN       LYS  53   0.907 -10.570   1.217
  378    HA   LYS  53           HA       LYS  53   0.875  -8.576   3.387
  379   1HB   LYS  53          HB2       LYS  53   3.461  -9.862   2.627
  380   2HB   LYS  53          HB1       LYS  53   2.976  -9.171   4.165
  381   1HG   LYS  53          HG2       LYS  53   1.867 -11.773   3.153
  382   2HG   LYS  53          HG1       LYS  53   3.360 -11.673   4.081
  383   1HD   LYS  53          HD2       LYS  53   2.152 -10.646   5.932
  384   2HD   LYS  53          HD1       LYS  53   0.655 -10.702   4.995
  385   1HE   LYS  53          HE2       LYS  53   0.775 -12.552   6.589
  386   2HE   LYS  53          HE1       LYS  53   0.779 -13.135   4.926
  387   1HZ   LYS  53          HZ1       LYS  53   3.118 -12.909   6.740
  388   2HZ   LYS  53          HZ2       LYS  53   3.228 -13.316   5.098
  389   3HZ   LYS  53          HZ3       LYS  53   2.404 -14.339   6.171
  390    H    PHE  54           HN       PHE  54   1.516  -6.545   2.639
  391    HA   PHE  54           HA       PHE  54   2.918  -6.548   0.063
  392   1HB   PHE  54          HB2       PHE  54   2.325  -4.041   0.036
  393   2HB   PHE  54          HB1       PHE  54   1.086  -5.215  -0.358
  394    HD1  PHE  54           HD1      PHE  54  -0.944  -4.441   0.258
  395    HD2  PHE  54           HD2      PHE  54   2.340  -3.821   2.888
  396    HE1  PHE  54           HE1      PHE  54  -2.455  -3.391   1.888
  397    HE2  PHE  54           HE2      PHE  54   0.832  -2.779   4.526
  398    HZ   PHE  54           HZ       PHE  54  -1.565  -2.560   4.027
  399    H    PHE  55           HN       PHE  55   4.786  -5.496  -0.243
  400    HA   PHE  55           HA       PHE  55   6.121  -4.247   2.026
  401   1HB   PHE  55          HB2       PHE  55   8.100  -5.766   1.741
  402   2HB   PHE  55          HB1       PHE  55   6.687  -6.578   2.395
  403    HD1  PHE  55           HD1      PHE  55   8.964  -6.304  -0.431
  404    HD2  PHE  55           HD2      PHE  55   5.418  -8.137   1.027
  405    HE1  PHE  55           HE1      PHE  55   9.107  -7.990  -2.221
  406    HE2  PHE  55           HE2      PHE  55   5.555  -9.829  -0.760
  407    HZ   PHE  55           HZ       PHE  55   7.420  -9.698  -2.433
  408    H    LEU  56           HN       LEU  56   8.390  -3.571   1.328
  409    HA   LEU  56           HA       LEU  56   8.354  -2.472  -1.367
  410   1HB   LEU  56          HB2       LEU  56  10.619  -2.300   0.612
  411   2HB   LEU  56          HB1       LEU  56  10.255  -1.216  -0.716
  412    HG   LEU  56           HG       LEU  56   8.539  -1.470   1.750
  413   1HD1  LEU  56          HD11      LEU  56  10.638   0.586   1.073
  414   2HD1  LEU  56          HD12      LEU  56  10.762  -0.642   2.332
  415   3HD1  LEU  56          HD13      LEU  56   9.550   0.635   2.461
  416   1HD2  LEU  56          HD21      LEU  56   8.620   0.586  -0.453
  417   2HD2  LEU  56          HD22      LEU  56   7.581   0.634   0.972
  418   3HD2  LEU  56          HD23      LEU  56   7.375  -0.642  -0.228
  419    H    ILE  57           HN       ILE  57   9.117  -3.723  -3.034
  420    HA   ILE  57           HA       ILE  57  11.074  -5.800  -2.321
  421    HB   ILE  57           HB       ILE  57   9.061  -6.737  -3.313
  422   1HG1  ILE  57          HG12      ILE  57  10.093  -7.987  -5.202
  423   2HG1  ILE  57          HG11      ILE  57  11.444  -6.858  -5.177
  424   1HG2  ILE  57          HG21      ILE  57   8.438  -6.285  -5.638
  425   2HG2  ILE  57          HG22      ILE  57   9.675  -5.030  -5.715
  426   3HG2  ILE  57          HG23      ILE  57   8.303  -4.850  -4.622
  427   1HD1  ILE  57          HD11      ILE  57  10.648  -8.734  -2.962
  428   2HD1  ILE  57          HD12      ILE  57  11.974  -7.571  -2.892
  429   3HD1  ILE  57          HD13      ILE  57  12.032  -8.905  -4.046
  430    H    SER  58           HN       SER  58  13.054  -5.688  -3.010
  431    HA   SER  58           HA       SER  58  14.063  -3.509  -4.490
  432   1HB   SER  58          HB2       SER  58  16.175  -4.896  -4.487
  433   2HB   SER  58          HB1       SER  58  15.466  -4.654  -2.887
  434    HG   SER  58           HG       SER  58  14.394  -6.831  -4.026
  435    H    ASP  59           HN       ASP  59  14.231  -3.225  -6.644
  436    HA   ASP  59           HA       ASP  59  13.134  -5.075  -8.489
  437   1HB   ASP  59          HB2       ASP  59  13.739  -3.521 -10.180
  438   2HB   ASP  59          HB1       ASP  59  13.347  -2.549  -8.766
  439    H    ASN  60           HN       ASN  60  16.334  -4.420  -7.321
  440    HA   ASN  60           HA       ASN  60  17.822  -6.032  -9.089
  441   1HB   ASN  60          HB2       ASN  60  18.827  -4.338  -7.618
  442   2HB   ASN  60          HB1       ASN  60  18.357  -5.273  -6.206
  443   1HD2  ASN  60          HD21      ASN  60  20.476  -5.108  -8.954
  444   2HD2  ASN  60          HD22      ASN  60  21.632  -6.262  -8.386
  445    H    ASN  61           HN       ASN  61  15.563  -6.800  -6.734
  446    HA   ASN  61           HA       ASN  61  14.837  -8.677  -5.715
  447   1HB   ASN  61          HB2       ASN  61  14.870  -9.471  -8.112
  448   2HB   ASN  61          HB1       ASN  61  16.440 -10.194  -7.783
  449   1HD2  ASN  61          HD21      ASN  61  13.969 -11.471  -8.582
  450   2HD2  ASN  61          HD22      ASN  61  13.593 -12.623  -7.343
  451    H    ARG  62           HN       ARG  62  16.073  -8.119  -3.873
  452    HA   ARG  62           HA       ARG  62  17.985 -10.218  -3.231
  453   1HB   ARG  62          HB2       ARG  62  19.458  -8.524  -2.068
  454   2HB   ARG  62          HB1       ARG  62  19.514  -8.518  -3.823
  455   1HG   ARG  62          HG2       ARG  62  18.201  -6.539  -3.940
  456   2HG   ARG  62          HG1       ARG  62  17.825  -6.617  -2.218
  457   1HD   ARG  62          HD2       ARG  62  19.561  -4.937  -2.791
  458   2HD   ARG  62          HD1       ARG  62  20.098  -6.152  -1.635
  459    HE   ARG  62           HE       ARG  62  20.786  -6.981  -4.233
  460   1HH1  ARG  62          HH11      ARG  62  21.612  -4.479  -1.932
  461   2HH1  ARG  62          HH12      ARG  62  23.280  -4.405  -2.417
  462   1HH2  ARG  62          HH21      ARG  62  22.974  -6.883  -4.890
  463   2HH2  ARG  62          HH22      ARG  62  24.046  -5.758  -4.103
  464    H    ASP  63           HN       ASP  63  15.946  -7.546  -2.067
  465    HA   ASP  63           HA       ASP  63  15.413  -9.112   0.330
  466   1HB   ASP  63          HB2       ASP  63  17.386  -7.269   0.506
  467   2HB   ASP  63          HB1       ASP  63  15.990  -6.269   0.898
  468    H    LYS  64           HN       LYS  64  13.848  -7.773   1.794
  469    HA   LYS  64           HA       LYS  64  12.006  -6.070   0.400
  470   1HB   LYS  64          HB2       LYS  64  10.104  -7.563   0.388
  471   2HB   LYS  64          HB1       LYS  64  11.410  -8.284  -0.535
  472   1HG   LYS  64          HG2       LYS  64  10.787 -10.114   0.626
  473   2HG   LYS  64          HG1       LYS  64  11.886  -9.434   1.825
  474   1HD   LYS  64          HD2       LYS  64   9.908  -8.299   2.876
  475   2HD   LYS  64          HD1       LYS  64   8.876  -9.186   1.754
  476   1HE   LYS  64          HE2       LYS  64  10.797 -10.500   3.667
  477   2HE   LYS  64          HE1       LYS  64   9.090 -10.231   4.014
  478   1HZ   LYS  64          HZ1       LYS  64   8.524 -11.595   2.088
  479   2HZ   LYS  64          HZ2       LYS  64   9.467 -12.463   3.196
  480   3HZ   LYS  64          HZ3       LYS  64  10.172 -11.870   1.778
  481    H    LEU  65           HN       LEU  65  10.675  -4.974   1.832
  482    HA   LEU  65           HA       LEU  65  10.503  -5.961   4.570
  483   1HB   LEU  65          HB2       LEU  65  11.040  -3.790   5.514
  484   2HB   LEU  65          HB1       LEU  65  12.365  -4.448   4.582
  485    HG   LEU  65           HG       LEU  65  10.509  -2.407   3.396
  486   1HD1  LEU  65          HD11      LEU  65  13.021  -1.893   4.992
  487   2HD1  LEU  65          HD12      LEU  65  11.378  -1.466   5.472
  488   3HD1  LEU  65          HD13      LEU  65  12.116  -0.689   4.072
  489   1HD2  LEU  65          HD21      LEU  65  13.380  -3.153   2.835
  490   2HD2  LEU  65          HD22      LEU  65  12.439  -1.930   1.981
  491   3HD2  LEU  65          HD23      LEU  65  11.984  -3.629   1.870
  492    H    TYR  66           HN       TYR  66   8.568  -5.631   5.527
  493    HA   TYR  66           HA       TYR  66   6.422  -4.926   3.778
  494   1HB   TYR  66          HB2       TYR  66   6.157  -5.367   6.747
  495   2HB   TYR  66          HB1       TYR  66   4.959  -5.638   5.492
  496    HD1  TYR  66           HD1      TYR  66   7.573  -7.091   7.449
  497    HD2  TYR  66           HD2      TYR  66   5.357  -7.550   3.848
  498    HE1  TYR  66           HE1      TYR  66   8.240  -9.451   7.349
  499    HE2  TYR  66           HE2      TYR  66   6.019  -9.917   3.741
  500    HH   TYR  66           HH       TYR  66   7.550 -11.511   6.383
  501    H    VAL  67           HN       VAL  67   5.080  -3.179   3.826
  502    HA   VAL  67           HA       VAL  67   5.626  -1.093   5.799
  503    HB   VAL  67           HB       VAL  67   5.367   0.636   3.986
  504   1HG1  VAL  67          HG11      VAL  67   7.533   0.134   4.969
  505   2HG1  VAL  67          HG12      VAL  67   7.700   0.480   3.247
  506   3HG1  VAL  67          HG13      VAL  67   7.764  -1.187   3.822
  507   1HG2  VAL  67          HG21      VAL  67   5.874  -0.048   1.685
  508   2HG2  VAL  67          HG22      VAL  67   4.381  -0.782   2.269
  509   3HG2  VAL  67          HG23      VAL  67   5.861  -1.738   2.187
  510    H    ASN  68           HN       ASN  68   3.852  -0.232   6.654
  511    HA   ASN  68           HA       ASN  68   1.320  -1.145   5.527
  512   1HB   ASN  68          HB2       ASN  68   0.309  -0.493   7.676
  513   2HB   ASN  68          HB1       ASN  68   1.626  -1.636   7.894
  514   1HD2  ASN  68          HD21      ASN  68   0.415   0.292   9.753
  515   2HD2  ASN  68          HD22      ASN  68   1.727   1.289  10.303
  516    H    ILE  69           HN       ILE  69   0.388   0.120   4.151
  517    HA   ILE  69           HA       ILE  69   0.835   2.949   4.074
  518    HB   ILE  69           HB       ILE  69  -1.390   2.452   2.484
  519   1HG1  ILE  69          HG12      ILE  69   0.551   0.144   2.236
  520   2HG1  ILE  69          HG11      ILE  69  -1.071   0.021   2.917
  521   1HG2  ILE  69          HG21      ILE  69   0.202   2.653   0.624
  522   2HG2  ILE  69          HG22      ILE  69   1.534   2.413   1.757
  523   3HG2  ILE  69          HG23      ILE  69   0.507   3.839   1.894
  524   1HD1  ILE  69          HD11      ILE  69  -1.024  -0.782   0.635
  525   2HD1  ILE  69          HD12      ILE  69  -0.376   0.762   0.083
  526   3HD1  ILE  69          HD13      ILE  69  -2.006   0.678   0.748
  527    H    ARG  70           HN       ARG  70   0.167   3.629   6.095
  528    HA   ARG  70           HA       ARG  70  -2.652   3.265   6.800
  529   1HB   ARG  70          HB2       ARG  70  -0.749   2.843   8.456
  530   2HB   ARG  70          HB1       ARG  70  -0.497   4.583   8.457
  531   1HG   ARG  70          HG2       ARG  70  -3.129   4.506   8.984
  532   2HG   ARG  70          HG1       ARG  70  -2.630   2.972   9.698
  533   1HD   ARG  70          HD2       ARG  70  -2.412   4.486  11.452
  534   2HD   ARG  70          HD1       ARG  70  -0.769   4.343  10.825
  535    HE   ARG  70           HE       ARG  70  -2.002   6.474   9.508
  536   1HH1  ARG  70          HH11      ARG  70  -0.920   5.633  12.739
  537   2HH1  ARG  70          HH12      ARG  70  -0.692   7.290  13.220
  538   1HH2  ARG  70          HH21      ARG  70  -1.717   8.652  10.162
  539   2HH2  ARG  70          HH22      ARG  70  -1.154   8.995  11.773
  540    HA   PRO  71           HA       PRO  71  -3.956   7.280   5.380
  541   1HB   PRO  71          HB2       PRO  71  -5.127   7.361   8.131
  542   2HB   PRO  71          HB1       PRO  71  -5.852   7.790   6.582
  543   1HG   PRO  71          HG2       PRO  71  -6.405   5.458   7.758
  544   2HG   PRO  71          HG1       PRO  71  -6.252   5.591   5.997
  545   1HD   PRO  71          HD2       PRO  71  -4.416   4.361   7.964
  546   2HD   PRO  71          HD1       PRO  71  -4.625   4.009   6.238
  547    H    MET  72           HN       MET  72  -3.033   9.229   5.432
  548    HA   MET  72           HA       MET  72  -0.861   9.774   7.131
  549   1HB   MET  72          HB2       MET  72  -1.082  10.746   4.884
  550   2HB   MET  72          HB1       MET  72  -2.470  11.683   5.422
  551   1HG   MET  72          HG2       MET  72  -0.497  13.068   5.336
  552   2HG   MET  72          HG1       MET  72  -1.042  12.882   7.003
  553   1HE   MET  72          HE1       MET  72   2.808  13.109   7.480
  554   2HE   MET  72          HE2       MET  72   1.232  13.711   7.999
  555   3HE   MET  72          HE3       MET  72   1.796  14.015   6.356
  556    H    ASP  73           HN       ASP  73  -4.029  11.397   6.943
  557    HA   ASP  73           HA       ASP  73  -4.221  11.542   9.807
  558   1HB   ASP  73          HB2       ASP  73  -2.737  13.450   9.369
  559   2HB   ASP  73          HB1       ASP  73  -3.903  14.098   8.220
  560    H    ASN  74           HN       ASN  74  -6.229  10.670   9.811
  561    HA   ASN  74           HA       ASN  74  -8.371  12.459   9.493
  562   1HB   ASN  74          HB2       ASN  74  -9.689  11.065   7.780
  563   2HB   ASN  74          HB1       ASN  74  -8.451  12.155   7.173
  564   1HD2  ASN  74          HD21      ASN  74  -6.705  11.339   6.125
  565   2HD2  ASN  74          HD22      ASN  74  -6.531   9.671   5.717
  566    H    SER  75           HN       SER  75  -8.720   9.022   8.779
  567    HA   SER  75           HA       SER  75  -9.829   8.645  11.478
  568   1HB   SER  75          HB2       SER  75 -10.988   7.654   8.860
  569   2HB   SER  75          HB1       SER  75 -11.596   7.228  10.459
  570    HG   SER  75           HG       SER  75 -11.343   9.931   9.685
  571    H    ALA  76           HN       ALA  76 -10.386   6.035  11.487
  572    HA   ALA  76           HA       ALA  76  -7.720   4.863  11.191
  573   1HB   ALA  76          HB1       ALA  76  -8.430   3.233  12.854
  574   2HB   ALA  76          HB2       ALA  76 -10.048   3.937  12.871
  575   3HB   ALA  76          HB3       ALA  76  -8.669   4.876  13.448
  576    H    TRP  77           HN       TRP  77  -7.348   3.068  10.034
  577    HA   TRP  77           HA       TRP  77  -9.605   1.858   8.576
  578   1HB   TRP  77          HB2       TRP  77  -6.742   2.343   7.816
  579   2HB   TRP  77          HB1       TRP  77  -7.658   1.070   7.033
  580    HD1  TRP  77           HD1      TRP  77  -9.161   4.540   7.842
  581    HE1  TRP  77           HE1      TRP  77  -9.771   5.684   5.603
  582    HE3  TRP  77           HE3      TRP  77  -7.149   1.131   4.609
  583    HZ2  TRP  77           HZ2      TRP  77  -9.431   5.191   2.852
  584    HZ3  TRP  77           HZ3      TRP  77  -7.334   1.545   2.191
  585    HH2  TRP  77           HH2      TRP  77  -8.450   3.534   1.333
  586    H    THR  78           HN       THR  78  -9.634  -0.433   8.384
  587    HA   THR  78           HA       THR  78  -8.485  -1.904  10.540
  588    HB   THR  78           HB       THR  78  -9.752  -2.962   8.001
  589    HG1  THR  78           HG1      THR  78 -10.939  -2.323  10.529
  590   1HG2  THR  78          HG21      THR  78  -8.535  -4.670   9.247
  591   2HG2  THR  78          HG22      THR  78 -10.273  -4.933   9.386
  592   3HG2  THR  78          HG23      THR  78  -9.380  -4.217  10.727
  593    H    THR  79           HN       THR  79  -6.459  -2.608  10.643
  594    HA   THR  79           HA       THR  79  -4.848  -2.397   8.226
  595    HB   THR  79           HB       THR  79  -3.997  -1.064   9.984
  596    HG1  THR  79           HG1      THR  79  -2.482  -3.469   9.760
  597   1HG2  THR  79          HG21      THR  79  -5.109  -2.119  11.877
  598   2HG2  THR  79          HG22      THR  79  -3.382  -1.952  12.190
  599   3HG2  THR  79          HG23      THR  79  -4.048  -3.521  11.737
  600    H    ASP  80           HN       ASP  80  -4.482  -4.153   7.116
  601    HA   ASP  80           HA       ASP  80  -3.562  -6.546   8.570
  602   1HB   ASP  80          HB2       ASP  80  -5.737  -6.376   6.760
  603   2HB   ASP  80          HB1       ASP  80  -4.439  -7.198   5.902
  604    H    ASN  81           HN       ASN  81  -1.977  -7.845   7.150
  605    HA   ASN  81           HA       ASN  81   0.110  -5.993   6.570
  606   1HB   ASN  81          HB2       ASN  81   0.133  -8.528   7.405
  607   2HB   ASN  81          HB1       ASN  81   0.388  -8.816   5.687
  608   1HD2  ASN  81          HD21      ASN  81   1.881  -6.209   5.414
  609   2HD2  ASN  81          HD22      ASN  81   3.426  -6.533   6.112
  610    H    GLY  82           HN       GLY  82  -2.260  -7.542   4.586
  611   1HA   GLY  82          HA2       GLY  82  -1.092  -6.176   2.252
  612   2HA   GLY  82          HA1       GLY  82  -1.569  -7.867   2.117
  613    H    VAL  83           HN       VAL  83  -3.434  -5.991   4.215
  614    HA   VAL  83           HA       VAL  83  -5.424  -5.343   2.176
  615    HB   VAL  83           HB       VAL  83  -6.025  -6.895   4.710
  616   1HG1  VAL  83          HG11      VAL  83  -7.738  -5.246   4.301
  617   2HG1  VAL  83          HG12      VAL  83  -8.360  -6.857   3.949
  618   3HG1  VAL  83          HG13      VAL  83  -7.895  -5.783   2.630
  619   1HG2  VAL  83          HG21      VAL  83  -6.836  -8.657   3.238
  620   2HG2  VAL  83          HG22      VAL  83  -5.141  -8.300   2.898
  621   3HG2  VAL  83          HG23      VAL  83  -6.404  -7.696   1.824
  622    H    PHE  84           HN       PHE  84  -6.118  -3.267   2.505
  623    HA   PHE  84           HA       PHE  84  -6.054  -2.249   5.247
  624   1HB   PHE  84          HB2       PHE  84  -4.026  -1.639   3.454
  625   2HB   PHE  84          HB1       PHE  84  -5.117  -0.265   3.316
  626    HD1  PHE  84           HD1      PHE  84  -5.672   1.072   5.326
  627    HD2  PHE  84           HD2      PHE  84  -2.671  -1.939   5.370
  628    HE1  PHE  84           HE1      PHE  84  -4.748   2.034   7.388
  629    HE2  PHE  84           HE2      PHE  84  -1.734  -0.979   7.431
  630    HZ   PHE  84           HZ       PHE  84  -2.762   0.986   8.452
  631    H    TYR  85           HN       TYR  85  -8.124  -1.798   5.533
  632    HA   TYR  85           HA       TYR  85  -9.458  -0.069   3.618
  633   1HB   TYR  85          HB2       TYR  85 -11.421  -1.484   3.418
  634   2HB   TYR  85          HB1       TYR  85 -10.001  -2.337   2.845
  635    HD1  TYR  85           HD1      TYR  85 -12.944  -2.795   4.494
  636    HD2  TYR  85           HD2      TYR  85  -8.807  -3.692   4.979
  637    HE1  TYR  85           HE1      TYR  85 -13.526  -4.687   5.953
  638    HE2  TYR  85           HE2      TYR  85  -9.385  -5.588   6.432
  639    HH   TYR  85           HH       TYR  85 -11.283  -6.282   7.892
  640    H    LYS  86           HN       LYS  86 -10.987   1.228   4.534
  641    HA   LYS  86           HA       LYS  86 -10.993   1.334   7.393
  642   1HB   LYS  86          HB2       LYS  86 -12.285   3.320   7.221
  643   2HB   LYS  86          HB1       LYS  86 -11.054   3.385   5.979
  644   1HG   LYS  86          HG2       LYS  86 -13.949   2.695   5.542
  645   2HG   LYS  86          HG1       LYS  86 -13.211   4.265   5.243
  646   1HD   LYS  86          HD2       LYS  86 -11.631   2.994   3.669
  647   2HD   LYS  86          HD1       LYS  86 -12.806   1.681   3.776
  648   1HE   LYS  86          HE2       LYS  86 -13.112   4.407   2.597
  649   2HE   LYS  86          HE1       LYS  86 -13.519   2.842   1.903
  650   1HZ   LYS  86          HZ1       LYS  86 -15.299   2.714   3.662
  651   2HZ   LYS  86          HZ2       LYS  86 -15.536   3.876   2.446
  652   3HZ   LYS  86          HZ3       LYS  86 -14.998   4.352   3.976
  653    H    ASN  87           HN       ASN  87 -12.568   0.833   8.783
  654    HA   ASN  87           HA       ASN  87 -14.194  -1.373   8.193
  655   1HB   ASN  87          HB2       ASN  87 -13.321  -0.747  10.450
  656   2HB   ASN  87          HB1       ASN  87 -14.474   0.578  10.492
  657   1HD2  ASN  87          HD21      ASN  87 -15.081  -2.670   9.238
  658   2HD2  ASN  87          HD22      ASN  87 -16.242  -3.101  10.454
  659    H    ASP  88           HN       ASP  88 -14.767   2.033   8.090
  660    HA   ASP  88           HA       ASP  88 -17.618   1.920   7.888
  661   1HB   ASP  88          HB2       ASP  88 -15.695   4.124   7.086
  662   2HB   ASP  88          HB1       ASP  88 -17.440   4.290   7.256
  663    H    VAL  89           HN       VAL  89 -18.880   1.754   6.079
  664    HA   VAL  89           HA       VAL  89 -17.516   1.366   3.529
  665    HB   VAL  89           HB       VAL  89 -19.735   0.762   2.620
  666   1HG1  VAL  89          HG11      VAL  89 -19.996  -1.344   3.849
  667   2HG1  VAL  89          HG12      VAL  89 -18.972  -0.713   5.139
  668   3HG1  VAL  89          HG13      VAL  89 -18.301  -0.973   3.527
  669   1HG2  VAL  89          HG21      VAL  89 -20.695   1.176   5.453
  670   2HG2  VAL  89          HG22      VAL  89 -21.629   0.438   4.153
  671   3HG2  VAL  89          HG23      VAL  89 -21.153   2.132   4.043
  672    H    GLY  90           HN       GLY  90 -17.546   2.788   1.875
  673   1HA   GLY  90          HA2       GLY  90 -19.056   4.775   1.064
  674   2HA   GLY  90          HA1       GLY  90 -18.496   5.464   2.584
  675    H    SER  91           HN       SER  91 -17.678   7.080   0.928
  676    HA   SER  91           HA       SER  91 -15.390   6.321  -0.603
  677   1HB   SER  91          HB2       SER  91 -16.389   9.094   0.105
  678   2HB   SER  91          HB1       SER  91 -15.302   8.666  -1.217
  679    HG   SER  91           HG       SER  91 -17.018   7.484  -2.163
  680    H    TRP  92           HN       TRP  92 -13.504   8.116  -0.218
  681    HA   TRP  92           HA       TRP  92 -12.919   8.690   2.523
  682   1HB   TRP  92          HB2       TRP  92 -12.426   6.251   2.423
  683   2HB   TRP  92          HB1       TRP  92 -11.206   6.602   1.193
  684    HD1  TRP  92           HD1      TRP  92 -11.936   7.222   4.926
  685    HE1  TRP  92           HE1      TRP  92  -9.700   7.804   6.076
  686    HE3  TRP  92           HE3      TRP  92  -8.957   7.428   0.811
  687    HZ2  TRP  92           HZ2      TRP  92  -7.037   8.286   5.310
  688    HZ3  TRP  92           HZ3      TRP  92  -6.599   7.965   1.099
  689    HH2  TRP  92           HH2      TRP  92  -5.640   8.378   3.298
  690    H    GLY  93           HN       GLY  93 -11.328   7.993  -0.523
  691   1HA   GLY  93          HA2       GLY  93  -9.580   9.093  -1.604
  692   2HA   GLY  93          HA1       GLY  93 -10.828  10.306  -1.684
  693    H    GLY  94           HN       GLY  94  -7.799   9.402  -0.337
  694   1HA   GLY  94          HA2       GLY  94  -7.144  12.095   0.293
  695   2HA   GLY  94          HA1       GLY  94  -7.457  11.171   1.758
  696    H    THR  95           HN       THR  95  -5.143  11.707   2.161
  697    HA   THR  95           HA       THR  95  -3.309  10.091   0.553
  698    HB   THR  95           HB       THR  95  -1.555  11.385   1.920
  699    HG1  THR  95           HG1      THR  95  -2.779  13.569   2.414
  700   1HG2  THR  95          HG21      THR  95  -1.698  13.318   0.430
  701   2HG2  THR  95          HG22      THR  95  -3.363  12.897   0.028
  702   3HG2  THR  95          HG23      THR  95  -2.044  11.825  -0.445
  703    H    ILE  96           HN       ILE  96  -2.578   8.212   1.301
  704    HA   ILE  96           HA       ILE  96  -2.319   7.901   4.204
  705    HB   ILE  96           HB       ILE  96  -2.352   5.551   4.033
  706   1HG1  ILE  96          HG12      ILE  96  -0.972   5.382   1.970
  707   2HG1  ILE  96          HG11      ILE  96  -2.325   4.275   2.027
  708   1HG2  ILE  96          HG21      ILE  96  -4.554   6.517   3.950
  709   2HG2  ILE  96          HG22      ILE  96  -4.505   5.047   2.982
  710   3HG2  ILE  96          HG23      ILE  96  -4.476   6.623   2.193
  711   1HD1  ILE  96          HD11      ILE  96  -2.316   5.014  -0.154
  712   2HD1  ILE  96          HD12      ILE  96  -1.941   6.668   0.305
  713   3HD1  ILE  96          HD13      ILE  96  -3.551   6.015   0.607
  714    H    GLY  97           HN       GLY  97  -0.290   6.731   4.883
  715   1HA   GLY  97          HA2       GLY  97   1.887   7.585   3.077
  716   2HA   GLY  97          HA1       GLY  97   1.966   7.740   4.825
  717    H    ILE  98           HN       ILE  98   3.782   6.368   3.032
  718    HA   ILE  98           HA       ILE  98   3.455   3.578   3.778
  719    HB   ILE  98           HB       ILE  98   5.500   5.013   2.089
  720   1HG1  ILE  98          HG12      ILE  98   4.726   3.169   0.458
  721   2HG1  ILE  98          HG11      ILE  98   3.394   2.932   1.589
  722   1HG2  ILE  98          HG21      ILE  98   5.604   2.138   2.979
  723   2HG2  ILE  98          HG22      ILE  98   6.743   3.415   3.411
  724   3HG2  ILE  98          HG23      ILE  98   6.629   2.864   1.740
  725   1HD1  ILE  98          HD11      ILE  98   4.041   5.490   0.150
  726   2HD1  ILE  98          HD12      ILE  98   2.700   5.240   1.270
  727   3HD1  ILE  98          HD13      ILE  98   2.749   4.362  -0.261
  728    H    TYR  99           HN       TYR  99   4.004   3.026   5.766
  729    HA   TYR  99           HA       TYR  99   6.462   4.190   6.912
  730   1HB   TYR  99          HB2       TYR  99   4.356   2.805   8.570
  731   2HB   TYR  99          HB1       TYR  99   5.596   3.934   9.089
  732    HD1  TYR  99           HD1      TYR  99   5.098   6.214   9.350
  733    HD2  TYR  99           HD2      TYR  99   2.402   3.730   7.198
  734    HE1  TYR  99           HE1      TYR  99   3.477   8.055   9.271
  735    HE2  TYR  99           HE2      TYR  99   0.769   5.565   7.124
  736    HH   TYR  99           HH       TYR  99   1.581   8.784   8.021
  737    H    VAL 100           HN       VAL 100   8.036   2.730   7.588
  738    HA   VAL 100           HA       VAL 100   7.850   0.041   6.603
  739    HB   VAL 100           HB       VAL 100   9.978   1.306   8.345
  740   1HG1  VAL 100          HG11      VAL 100  11.380  -0.592   7.689
  741   2HG1  VAL 100          HG12      VAL 100  10.016  -1.298   6.822
  742   3HG1  VAL 100          HG13      VAL 100   9.950  -1.123   8.574
  743   1HG2  VAL 100          HG21      VAL 100  11.286   1.456   6.305
  744   2HG2  VAL 100          HG22      VAL 100   9.778   2.358   6.155
  745   3HG2  VAL 100          HG23      VAL 100   9.942   0.780   5.379
  746    H    ASP 101           HN       ASP 101   6.973  -1.635   7.670
  747    HA   ASP 101           HA       ASP 101   6.291  -1.381  10.461
  748   1HB   ASP 101          HB2       ASP 101   4.875  -2.626   8.765
  749   2HB   ASP 101          HB1       ASP 101   6.117  -3.875   8.755
  750    H    GLY 102           HN       GLY 102   8.272  -1.130  11.482
  751   1HA   GLY 102          HA2       GLY 102  10.002  -2.109  12.733
  752   2HA   GLY 102          HA1       GLY 102   9.865  -3.560  11.748
  753    H    GLN 103           HN       GLN 103  11.053  -0.248  11.806
  754    HA   GLN 103           HA       GLN 103  12.340   0.143   9.492
  755   1HB   GLN 103          HB2       GLN 103  14.171   1.275  10.851
  756   2HB   GLN 103          HB1       GLN 103  12.524   1.819  11.129
  757   1HG   GLN 103          HG2       GLN 103  12.392   0.597  13.178
  758   2HG   GLN 103          HG1       GLN 103  13.940  -0.184  12.870
  759   1HE2  GLN 103          HE21      GLN 103  15.205   2.245  11.882
  760   2HE2  GLN 103          HE22      GLN 103  15.496   3.226  13.277
  761    H    GLN 104           HN       GLN 104  13.571  -1.060   8.262
  762    HA   GLN 104           HA       GLN 104  15.323  -3.073   9.401
  763   1HB   GLN 104          HB2       GLN 104  13.865  -3.521   7.383
  764   2HB   GLN 104          HB1       GLN 104  14.873  -2.396   6.486
  765   1HG   GLN 104          HG2       GLN 104  16.751  -3.796   6.621
  766   2HG   GLN 104          HG1       GLN 104  16.022  -4.788   7.881
  767   1HE2  GLN 104          HE21      GLN 104  13.441  -4.948   6.589
  768   2HE2  GLN 104          HE22      GLN 104  13.643  -6.018   5.240
  769    H    THR 105           HN       THR 105  15.569   0.100   9.064
  770    HA   THR 105           HA       THR 105  17.270   1.597   9.095
  771    HB   THR 105           HB       THR 105  19.125  -0.775   9.404
  772    HG1  THR 105           HG1      THR 105  17.812  -1.125  11.079
  773   1HG2  THR 105          HG21      THR 105  20.219   1.417   9.096
  774   2HG2  THR 105          HG22      THR 105  20.480   0.775  10.717
  775   3HG2  THR 105          HG23      THR 105  19.296   2.056  10.456
  776    H    ASN 106           HN       ASN 106  16.454   0.183   6.575
  777    HA   ASN 106           HA       ASN 106  16.854   0.444   4.367
  778   1HB   ASN 106          HB2       ASN 106  17.487   2.749   4.932
  779   2HB   ASN 106          HB1       ASN 106  19.137   2.222   5.244
  780   1HD2  ASN 106          HD21      ASN 106  20.479   1.728   3.533
  781   2HD2  ASN 106          HD22      ASN 106  20.093   2.147   1.901
  782    H    THR 107           HN       THR 107  17.360  -1.694   4.042
  783    HA   THR 107           HA       THR 107  20.041  -2.674   4.124
  784    HB   THR 107           HB       THR 107  18.503  -4.149   2.254
  785    HG1  THR 107           HG1      THR 107  16.715  -4.515   3.987
  786   1HG2  THR 107          HG21      THR 107  20.107  -5.076   3.861
  787   2HG2  THR 107          HG22      THR 107  18.541  -5.878   3.974
  788   3HG2  THR 107          HG23      THR 107  19.009  -4.682   5.182
  789    HA   PRO 108           HA       PRO 108  21.985  -1.007   0.570
  790   1HB   PRO 108          HB2       PRO 108  22.651  -3.474  -0.676
  791   2HB   PRO 108          HB1       PRO 108  23.680  -2.482   0.358
  792   1HG   PRO 108          HG2       PRO 108  22.057  -4.874   1.042
  793   2HG   PRO 108          HG1       PRO 108  23.577  -4.298   1.753
  794   1HD   PRO 108          HD2       PRO 108  21.261  -4.044   3.060
  795   2HD   PRO 108          HD1       PRO 108  22.495  -2.766   3.127
  796    HA   PRO 109           HA       PRO 109  18.368  -1.768  -2.010
  797   1HB   PRO 109          HB2       PRO 109  17.461   0.754  -2.040
  798   2HB   PRO 109          HB1       PRO 109  17.302  -0.282  -0.619
  799   1HG   PRO 109          HG2       PRO 109  19.071   2.031  -1.058
  800   2HG   PRO 109          HG1       PRO 109  18.503   1.323   0.456
  801   1HD   PRO 109          HD2       PRO 109  21.038   0.915  -0.862
  802   2HD   PRO 109          HD1       PRO 109  20.476   0.248   0.697
  803    H    GLY 110           HN       GLY 110  17.382  -0.095  -3.729
  804   1HA   GLY 110          HA2       GLY 110  19.214   1.272  -5.426
  805   2HA   GLY 110          HA1       GLY 110  18.727  -0.287  -6.097
  806    H    ASN 111           HN       ASN 111  16.667  -0.561  -6.869
  807    HA   ASN 111           HA       ASN 111  14.803   1.681  -6.451
  808   1HB   ASN 111          HB2       ASN 111  15.402   1.259  -8.851
  809   2HB   ASN 111          HB1       ASN 111  14.714  -0.356  -8.691
  810   1HD2  ASN 111          HD21      ASN 111  13.123  -0.008 -10.208
  811   2HD2  ASN 111          HD22      ASN 111  11.783   1.047  -9.932
  812    H    TYR 112           HN       TYR 112  13.139   1.235  -5.162
  813    HA   TYR 112           HA       TYR 112  12.500  -1.594  -4.720
  814   1HB   TYR 112          HB2       TYR 112  12.637   0.733  -2.888
  815   2HB   TYR 112          HB1       TYR 112  11.343  -0.425  -2.590
  816    HD1  TYR 112           HD1      TYR 112  11.822  -2.166  -1.145
  817    HD2  TYR 112           HD2      TYR 112  15.003  -0.443  -3.372
  818    HE1  TYR 112           HE1      TYR 112  13.423  -3.626   0.018
  819    HE2  TYR 112           HE2      TYR 112  16.611  -1.904  -2.219
  820    HH   TYR 112           HH       TYR 112  16.829  -3.198  -0.240
  821    H    THR 113           HN       THR 113  10.782  -2.258  -5.622
  822    HA   THR 113           HA       THR 113   8.860  -0.332  -6.674
  823    HB   THR 113           HB       THR 113   9.221  -3.277  -7.261
  824    HG1  THR 113           HG1      THR 113  10.727  -1.225  -7.957
  825   1HG2  THR 113          HG21      THR 113   6.962  -2.484  -7.779
  826   2HG2  THR 113          HG22      THR 113   7.861  -2.818  -9.259
  827   3HG2  THR 113          HG23      THR 113   7.635  -1.152  -8.721
  828    H    LEU 114           HN       LEU 114   6.819  -0.208  -5.965
  829    HA   LEU 114           HA       LEU 114   5.596  -2.500  -4.685
  830   1HB   LEU 114          HB2       LEU 114   4.644  -0.976  -2.881
  831   2HB   LEU 114          HB1       LEU 114   6.310  -1.486  -2.704
  832    HG   LEU 114           HG       LEU 114   5.788   1.124  -4.026
  833   1HD1  LEU 114          HD11      LEU 114   5.619   0.672  -1.047
  834   2HD1  LEU 114          HD12      LEU 114   4.300   1.192  -2.095
  835   3HD1  LEU 114          HD13      LEU 114   5.692   2.244  -1.842
  836   1HD2  LEU 114          HD21      LEU 114   7.882   0.167  -2.082
  837   2HD2  LEU 114          HD22      LEU 114   7.857   1.730  -2.897
  838   3HD2  LEU 114          HD23      LEU 114   8.061   0.253  -3.834
  839    H    THR 115           HN       THR 115   4.287  -2.685  -6.436
  840    HA   THR 115           HA       THR 115   2.772  -0.430  -7.417
  841    HB   THR 115           HB       THR 115   2.559  -3.358  -8.152
  842    HG1  THR 115           HG1      THR 115   4.139  -3.009  -9.565
  843   1HG2  THR 115          HG21      THR 115   0.579  -2.038  -8.768
  844   2HG2  THR 115          HG22      THR 115   1.485  -2.545 -10.193
  845   3HG2  THR 115          HG23      THR 115   1.613  -0.885  -9.612
  846    H    LEU 116           HN       LEU 116   0.703   0.029  -6.955
  847    HA   LEU 116           HA       LEU 116  -0.748  -1.812  -5.171
  848   1HB   LEU 116          HB2       LEU 116  -0.791   1.191  -5.314
  849   2HB   LEU 116          HB1       LEU 116  -1.909   0.249  -4.346
  850    HG   LEU 116           HG       LEU 116   1.088   0.335  -3.975
  851   1HD1  LEU 116          HD11      LEU 116   0.020   2.440  -3.369
  852   2HD1  LEU 116          HD12      LEU 116   0.589   1.581  -1.938
  853   3HD1  LEU 116          HD13      LEU 116  -1.127   1.573  -2.349
  854   1HD2  LEU 116          HD21      LEU 116   0.122  -1.809  -3.316
  855   2HD2  LEU 116          HD22      LEU 116  -1.063  -0.973  -2.314
  856   3HD2  LEU 116          HD23      LEU 116   0.651  -0.889  -1.908
  857    H    THR 117           HN       THR 117  -2.467  -2.688  -6.095
  858    HA   THR 117           HA       THR 117  -3.554  -1.472  -8.512
  859    HB   THR 117           HB       THR 117  -4.265  -4.125  -7.241
  860    HG1  THR 117           HG1      THR 117  -2.045  -3.352  -8.546
  861   1HG2  THR 117          HG21      THR 117  -4.705  -3.066 -10.037
  862   2HG2  THR 117          HG22      THR 117  -5.950  -3.246  -8.802
  863   3HG2  THR 117          HG23      THR 117  -5.145  -4.673  -9.456
  864    H    GLY 118           HN       GLY 118  -5.061   0.032  -8.173
  865   1HA   GLY 118          HA2       GLY 118  -6.600   0.373  -5.876
  866   2HA   GLY 118          HA1       GLY 118  -7.017   0.999  -7.468
  867    H    GLY 119           HN       GLY 119  -8.108  -0.879  -5.022
  868   1HA   GLY 119          HA2       GLY 119 -10.222  -1.978  -6.605
  869   2HA   GLY 119          HA1       GLY 119  -9.093  -3.204  -6.043
  870    H    TYR 120           HN       TYR 120 -11.936  -2.700  -5.351
  871    HA   TYR 120           HA       TYR 120 -11.757  -1.741  -2.624
  872   1HB   TYR 120          HB2       TYR 120 -14.219  -1.969  -2.596
  873   2HB   TYR 120          HB1       TYR 120 -13.644  -0.942  -3.902
  874    HD1  TYR 120           HD1      TYR 120 -15.156  -4.187  -3.068
  875    HD2  TYR 120           HD2      TYR 120 -13.971  -1.567  -6.208
  876    HE1  TYR 120           HE1      TYR 120 -16.412  -5.560  -4.675
  877    HE2  TYR 120           HE2      TYR 120 -15.233  -2.929  -7.822
  878    HH   TYR 120           HH       TYR 120 -17.465  -5.322  -6.879
  879    H    TRP 121           HN       TRP 121 -13.197  -3.019  -1.043
  880    HA   TRP 121           HA       TRP 121 -12.432  -5.850  -1.228
  881   1HB   TRP 121          HB2       TRP 121 -10.909  -5.008   0.330
  882   2HB   TRP 121          HB1       TRP 121 -12.061  -3.854   0.987
  883    HD1  TRP 121           HD1      TRP 121 -14.109  -5.030   2.444
  884    HE1  TRP 121           HE1      TRP 121 -13.970  -6.950   4.137
  885    HE3  TRP 121           HE3      TRP 121  -9.641  -7.076   1.009
  886    HZ2  TRP 121           HZ2      TRP 121 -12.227  -9.011   4.785
  887    HZ3  TRP 121           HZ3      TRP 121  -8.828  -9.045   2.265
  888    HH2  TRP 121           HH2      TRP 121 -10.093  -9.977   4.100
  889    H    ALA 122           HN       ALA 122 -13.834  -7.329  -0.294
  890    HA   ALA 122           HA       ALA 122 -16.472  -6.309   0.516
  891   1HB   ALA 122          HB1       ALA 122 -17.513  -8.206  -0.616
  892   2HB   ALA 122          HB2       ALA 122 -15.932  -8.748  -1.178
  893   3HB   ALA 122          HB3       ALA 122 -16.596  -7.217  -1.753
  894    H    LYS 123           HN       LYS 123 -17.505  -7.433   2.128
  895    HA   LYS 123           HA       LYS 123 -17.821  -8.707   3.969
  896   1HB   LYS 123          HB2       LYS 123 -17.001 -10.529   2.247
  897   2HB   LYS 123          HB1       LYS 123 -15.573 -10.548   3.270
  898   1HG   LYS 123          HG2       LYS 123 -17.020 -12.285   4.003
  899   2HG   LYS 123          HG1       LYS 123 -17.064 -11.006   5.218
  900   1HD   LYS 123          HD2       LYS 123 -19.101 -11.045   3.030
  901   2HD   LYS 123          HD1       LYS 123 -19.280 -12.131   4.408
  902   1HE   LYS 123          HE2       LYS 123 -18.929  -9.146   4.645
  903   2HE   LYS 123          HE1       LYS 123 -20.496  -9.952   4.617
  904   1HZ   LYS 123          HZ1       LYS 123 -18.361 -10.234   6.662
  905   2HZ   LYS 123          HZ2       LYS 123 -19.712 -11.253   6.577
  906   3HZ   LYS 123          HZ3       LYS 123 -19.919  -9.597   6.870
  907    H    ASP 124           HN       ASP 124 -15.372 -10.214   5.160
  908    HA   ASP 124           HA       ASP 124 -13.593  -8.084   5.880
  909   1HB   ASP 124          HB2       ASP 124 -14.118  -8.138   8.311
  910   2HB   ASP 124          HB1       ASP 124 -15.411  -7.458   7.331
  911    H    ASN 125           HN       ASN 125 -11.705  -8.870   6.183
  912    HA   ASN 125           HA       ASN 125  -9.926 -10.151   6.626
  913   1HB   ASN 125          HB2       ASN 125 -11.791 -11.526   8.529
  914   2HB   ASN 125          HB1       ASN 125 -10.051 -11.777   8.458
  915   1HD2  ASN 125          HD21      ASN 125  -8.667 -10.173   9.178
  916   2HD2  ASN 125          HD22      ASN 125  -9.221  -8.824  10.113
  917    H    LYS 126           HN       LYS 126 -12.759 -11.884   5.585
  918    HA   LYS 126           HA       LYS 126 -11.491 -14.389   5.164
  919   1HB   LYS 126          HB2       LYS 126 -13.477 -15.014   3.955
  920   2HB   LYS 126          HB1       LYS 126 -13.937 -14.099   5.381
  921   1HG   LYS 126          HG2       LYS 126 -15.289 -13.049   3.933
  922   2HG   LYS 126          HG1       LYS 126 -13.837 -12.111   3.569
  923   1HD   LYS 126          HD2       LYS 126 -13.342 -13.561   1.684
  924   2HD   LYS 126          HD1       LYS 126 -14.720 -14.589   2.081
  925   1HE   LYS 126          HE2       LYS 126 -16.206 -12.635   1.732
  926   2HE   LYS 126          HE1       LYS 126 -14.802 -11.706   1.206
  927   1HZ   LYS 126          HZ1       LYS 126 -16.079 -12.615  -0.646
  928   2HZ   LYS 126          HZ2       LYS 126 -15.796 -14.192  -0.087
  929   3HZ   LYS 126          HZ3       LYS 126 -14.500 -13.238  -0.622
  930    H    GLN 127           HN       GLN 127 -10.959 -11.530   3.708
  931    HA   GLN 127           HA       GLN 127  -9.642 -10.881   2.003
  932   1HB   GLN 127          HB2       GLN 127  -8.388 -13.021   2.438
  933   2HB   GLN 127          HB1       GLN 127  -9.359 -13.770   1.177
  934   1HG   GLN 127          HG2       GLN 127  -8.499 -12.138  -0.437
  935   2HG   GLN 127          HG1       GLN 127  -7.507 -11.421   0.830
  936   1HE2  GLN 127          HE21      GLN 127  -7.922 -14.104  -1.311
  937   2HE2  GLN 127          HE22      GLN 127  -6.376 -14.830  -1.028
  938    H    GLY 128           HN       GLY 128 -12.110 -10.348   1.572
  939   1HA   GLY 128          HA2       GLY 128 -12.697 -11.263  -1.155
  940   2HA   GLY 128          HA1       GLY 128 -13.797 -10.369  -0.106
  941    H    PHE 129           HN       PHE 129 -11.664 -10.091  -2.683
  942    HA   PHE 129           HA       PHE 129 -11.844  -7.176  -2.407
  943   1HB   PHE 129          HB2       PHE 129  -9.580  -6.902  -3.311
  944   2HB   PHE 129          HB1       PHE 129  -9.543  -7.821  -1.814
  945    HD1  PHE 129           HD1      PHE 129  -9.109 -10.257  -1.872
  946    HD2  PHE 129           HD2      PHE 129  -8.861  -7.844  -5.368
  947    HE1  PHE 129           HE1      PHE 129  -7.836 -12.030  -3.000
  948    HE2  PHE 129           HE2      PHE 129  -7.589  -9.619  -6.506
  949    HZ   PHE 129           HZ       PHE 129  -7.075 -11.714  -5.322
  950    H    THR 130           HN       THR 130 -11.621  -6.056  -4.509
  951    HA   THR 130           HA       THR 130 -11.720  -7.675  -6.917
  952    HB   THR 130           HB       THR 130 -13.962  -5.734  -6.303
  953    HG1  THR 130           HG1      THR 130 -13.661  -8.451  -5.876
  954   1HG2  THR 130          HG21      THR 130 -14.956  -6.622  -8.377
  955   2HG2  THR 130          HG22      THR 130 -13.509  -7.597  -8.643
  956   3HG2  THR 130          HG23      THR 130 -13.405  -5.835  -8.679
  957    HA   PRO 131           HA       PRO 131  -9.136  -4.081  -7.683
  958   1HB   PRO 131          HB2       PRO 131  -8.614  -5.390 -10.256
  959   2HB   PRO 131          HB1       PRO 131  -7.489  -4.961  -8.963
  960   1HG   PRO 131          HG2       PRO 131  -8.168  -7.520  -9.492
  961   2HG   PRO 131          HG1       PRO 131  -7.790  -6.951  -7.855
  962   1HD   PRO 131          HD2       PRO 131 -10.454  -7.485  -9.112
  963   2HD   PRO 131          HD1       PRO 131  -9.898  -7.820  -7.458
  964    H    SER 132           HN       SER 132 -10.102  -2.281  -8.226
  965    HA   SER 132           HA       SER 132 -11.139  -1.872 -10.873
  966   1HB   SER 132          HB2       SER 132 -13.082  -2.813  -9.552
  967   2HB   SER 132          HB1       SER 132 -12.972  -1.389  -8.525
  968    HG   SER 132           HG       SER 132 -13.011  -0.563 -11.052
  969    H    GLY 133           HN       GLY 133  -9.986  -0.115 -11.352
  970   1HA   GLY 133          HA2       GLY 133 -10.244   2.399 -10.546
  971   2HA   GLY 133          HA1       GLY 133  -9.263   1.746  -9.239
  972    H    THR 134           HN       THR 134  -7.349   2.703  -9.576
  973    HA   THR 134           HA       THR 134  -6.155   2.458 -12.259
  974    HB   THR 134           HB       THR 134  -5.232   4.358 -10.110
  975    HG1  THR 134           HG1      THR 134  -7.188   4.823 -12.150
  976   1HG2  THR 134          HG21      THR 134  -3.689   3.975 -11.966
  977   2HG2  THR 134          HG22      THR 134  -4.337   5.613 -12.026
  978   3HG2  THR 134          HG23      THR 134  -4.958   4.378 -13.121
  979    H    THR 135           HN       THR 135  -4.208   1.451 -12.490
  980    HA   THR 135           HA       THR 135  -3.142   0.082 -10.134
  981    HB   THR 135           HB       THR 135  -2.320  -0.268 -13.028
  982    HG1  THR 135           HG1      THR 135  -4.636  -0.753 -12.402
  983   1HG2  THR 135          HG21      THR 135  -0.707  -1.102 -11.369
  984   2HG2  THR 135          HG22      THR 135  -1.458  -2.425 -12.262
  985   3HG2  THR 135          HG23      THR 135  -1.983  -2.062 -10.619
  986    H    GLY 136           HN       GLY 136  -1.861   1.488  -9.031
  987   1HA   GLY 136          HA2       GLY 136   0.071   3.067 -10.606
  988   2HA   GLY 136          HA1       GLY 136  -0.613   3.584  -9.073
  989    H    THR 137           HN       THR 137   2.156   2.743 -10.320
  990    HA   THR 137           HA       THR 137   3.021   0.955  -8.183
  991    HB   THR 137           HB       THR 137   4.548   2.020 -10.573
  992    HG1  THR 137           HG1      THR 137   3.749  -0.673 -10.200
  993   1HG2  THR 137          HG21      THR 137   6.214   0.308 -10.022
  994   2HG2  THR 137          HG22      THR 137   5.288  -0.136  -8.588
  995   3HG2  THR 137          HG23      THR 137   6.028   1.461  -8.699
  996    H    THR 138           HN       THR 138   3.597   1.924  -6.318
  997    HA   THR 138           HA       THR 138   4.647   4.607  -6.291
  998    HB   THR 138           HB       THR 138   4.680   2.624  -3.998
  999    HG1  THR 138           HG1      THR 138   2.569   3.752  -5.259
 1000   1HG2  THR 138          HG21      THR 138   4.626   5.642  -4.073
 1001   2HG2  THR 138          HG22      THR 138   6.025   4.646  -3.677
 1002   3HG2  THR 138          HG23      THR 138   4.614   4.646  -2.618
 1003    H    LYS 139           HN       LYS 139   6.691   5.073  -6.744
 1004    HA   LYS 139           HA       LYS 139   8.590   2.837  -6.857
 1005   1HB   LYS 139          HB2       LYS 139   8.059   4.025  -8.969
 1006   2HB   LYS 139          HB1       LYS 139   8.659   5.515  -8.262
 1007   1HG   LYS 139          HG2       LYS 139  10.752   5.020  -8.789
 1008   2HG   LYS 139          HG1       LYS 139  10.623   3.403  -8.093
 1009   1HD   LYS 139          HD2       LYS 139  11.151   3.381 -10.514
 1010   2HD   LYS 139          HD1       LYS 139   9.640   2.556 -10.129
 1011   1HE   LYS 139          HE2       LYS 139   9.291   3.875 -12.093
 1012   2HE   LYS 139          HE1       LYS 139   8.421   4.632 -10.762
 1013   1HZ   LYS 139          HZ1       LYS 139  11.075   5.496 -11.781
 1014   2HZ   LYS 139          HZ2       LYS 139  10.192   6.246 -10.543
 1015   3HZ   LYS 139          HZ3       LYS 139   9.600   6.252 -12.129
 1016    H    LEU 140           HN       LEU 140   9.750   2.700  -5.129
 1017    HA   LEU 140           HA       LEU 140  10.726   5.153  -3.863
 1018   1HB   LEU 140          HB2       LEU 140   9.605   3.984  -2.213
 1019   2HB   LEU 140          HB1       LEU 140  10.053   2.419  -2.846
 1020    HG   LEU 140           HG       LEU 140  12.364   2.813  -2.023
 1021   1HD1  LEU 140          HD11      LEU 140  12.747   4.585  -0.393
 1022   2HD1  LEU 140          HD12      LEU 140  11.127   5.216  -0.693
 1023   3HD1  LEU 140          HD13      LEU 140  12.337   5.243  -1.976
 1024   1HD2  LEU 140          HD21      LEU 140  10.790   1.497  -0.730
 1025   2HD2  LEU 140          HD22      LEU 140  10.171   2.959   0.037
 1026   3HD2  LEU 140          HD23      LEU 140  11.829   2.439   0.339
 1027    H    THR 141           HN       THR 141  12.503   5.599  -5.052
 1028    HA   THR 141           HA       THR 141  14.528   3.503  -5.422
 1029    HB   THR 141           HB       THR 141  14.489   6.267  -6.659
 1030    HG1  THR 141           HG1      THR 141  13.325   3.820  -7.549
 1031   1HG2  THR 141          HG21      THR 141  15.944   5.209  -8.350
 1032   2HG2  THR 141          HG22      THR 141  15.910   3.710  -7.418
 1033   3HG2  THR 141          HG23      THR 141  16.651   5.157  -6.736
 1034    H    VAL 142           HN       VAL 142  16.654   3.804  -4.610
 1035    HA   VAL 142           HA       VAL 142  16.793   5.679  -2.399
 1036    HB   VAL 142           HB       VAL 142  17.674   3.412  -2.093
 1037   1HG1  VAL 142          HG11      VAL 142  19.787   2.739  -3.141
 1038   2HG1  VAL 142          HG12      VAL 142  19.748   4.197  -4.134
 1039   3HG1  VAL 142          HG13      VAL 142  18.500   2.965  -4.327
 1040   1HG2  VAL 142          HG21      VAL 142  19.792   5.548  -1.933
 1041   2HG2  VAL 142          HG22      VAL 142  19.809   4.014  -1.061
 1042   3HG2  VAL 142          HG23      VAL 142  18.556   5.209  -0.720
 1043    H    THR 143           HN       THR 143  17.840   7.560  -2.365
 1044    HA   THR 143           HA       THR 143  19.985   8.124  -4.220
 1045    HB   THR 143           HB       THR 143  17.551   9.929  -4.143
 1046    HG1  THR 143           HG1      THR 143  18.006   7.736  -5.589
 1047   1HG2  THR 143          HG21      THR 143  18.706  11.144  -5.949
 1048   2HG2  THR 143          HG22      THR 143  20.095  10.074  -5.770
 1049   3HG2  THR 143          HG23      THR 143  19.641  11.156  -4.454
  Start of MODEL    9
    1    H    GLU   1           H        GLU   1 -22.267   0.868 -10.898
    2    HA   GLU   1           HA       GLU   1 -22.033   0.901  -8.487
    3   1HB   GLU   1          HB2       GLU   1 -20.481  -0.722  -7.444
    4   2HB   GLU   1          HB1       GLU   1 -21.955  -1.478  -8.025
    5   1HG   GLU   1          HG2       GLU   1 -19.358  -1.503  -9.543
    6   2HG   GLU   1          HG1       GLU   1 -19.856  -2.771  -8.424
    7    H    GLU   2           HN       GLU   2 -20.449   2.218  -7.804
    8    HA   GLU   2           HA       GLU   2 -18.025   2.392  -9.458
    9   1HB   GLU   2          HB2       GLU   2 -19.729   4.228  -9.929
   10   2HB   GLU   2          HB1       GLU   2 -19.443   4.788  -8.286
   11   1HG   GLU   2          HG2       GLU   2 -18.049   6.131  -9.553
   12   2HG   GLU   2          HG1       GLU   2 -16.964   4.867  -8.972
   13    H    CYS   3           HN       CYS   3 -16.225   2.345  -8.297
   14    HA   CYS   3           HA       CYS   3 -15.944   3.685  -5.809
   15   1HB   CYS   3          HB2       CYS   3 -17.104   1.547  -5.091
   16   2HB   CYS   3          HB1       CYS   3 -15.703   0.667  -5.693
   17    H    GLN   4           HN       GLN   4 -14.524   4.489  -7.549
   18    HA   GLN   4           HA       GLN   4 -12.399   2.718  -8.404
   19   1HB   GLN   4          HB2       GLN   4 -12.868   5.621  -9.084
   20   2HB   GLN   4          HB1       GLN   4 -11.716   4.547  -9.862
   21   1HG   GLN   4          HG2       GLN   4 -14.712   4.447  -9.989
   22   2HG   GLN   4          HG1       GLN   4 -13.569   4.722 -11.303
   23   1HE2  GLN   4          HE21      GLN   4 -12.335   2.966 -12.078
   24   2HE2  GLN   4          HE22      GLN   4 -12.854   1.332 -11.826
   25    H    VAL   5           HN       VAL   5 -10.771   2.426  -7.070
   26    HA   VAL   5           HA       VAL   5  -9.871   4.517  -5.294
   27    HB   VAL   5           HB       VAL   5  -8.617   1.827  -5.896
   28   1HG1  VAL   5          HG11      VAL   5  -7.026   3.402  -4.940
   29   2HG1  VAL   5          HG12      VAL   5  -7.439   2.145  -3.774
   30   3HG1  VAL   5          HG13      VAL   5  -8.147   3.753  -3.625
   31   1HG2  VAL   5          HG21      VAL   5 -10.438   2.643  -3.635
   32   2HG2  VAL   5          HG22      VAL   5  -9.662   1.070  -3.822
   33   3HG2  VAL   5          HG23      VAL   5 -10.878   1.600  -4.986
   34    H    ARG   6           HN       ARG   6  -8.771   6.158  -6.131
   35    HA   ARG   6           HA       ARG   6  -7.381   5.844  -8.631
   36   1HB   ARG   6          HB2       ARG   6  -8.658   7.886  -8.212
   37   2HB   ARG   6          HB1       ARG   6  -7.627   8.266  -6.839
   38   1HG   ARG   6          HG2       ARG   6  -5.795   8.765  -8.195
   39   2HG   ARG   6          HG1       ARG   6  -6.482   7.925  -9.586
   40   1HD   ARG   6          HD2       ARG   6  -6.567  10.369  -9.836
   41   2HD   ARG   6          HD1       ARG   6  -8.170   9.642  -9.831
   42    HE   ARG   6           HE       ARG   6  -8.499  10.505  -7.624
   43   1HH1  ARG   6          HH11      ARG   6  -5.601  11.661  -9.216
   44   2HH1  ARG   6          HH12      ARG   6  -5.503  13.107  -8.250
   45   1HH2  ARG   6          HH21      ARG   6  -8.387  12.427  -6.383
   46   2HH2  ARG   6          HH22      ARG   6  -7.085  13.543  -6.656
   47    H    VAL   7           HN       VAL   7  -5.757   4.467  -8.234
   48    HA   VAL   7           HA       VAL   7  -3.583   5.386  -6.490
   49    HB   VAL   7           HB       VAL   7  -2.641   3.058  -7.032
   50   1HG1  VAL   7          HG11      VAL   7  -3.989   1.985  -5.303
   51   2HG1  VAL   7          HG12      VAL   7  -5.213   3.245  -5.466
   52   3HG1  VAL   7          HG13      VAL   7  -3.608   3.648  -4.855
   53   1HG2  VAL   7          HG21      VAL   7  -5.480   2.668  -7.933
   54   2HG2  VAL   7          HG22      VAL   7  -4.308   1.379  -7.660
   55   3HG2  VAL   7          HG23      VAL   7  -4.034   2.565  -8.935
   56    H    GLY   8           HN       GLY   8  -1.540   5.776  -7.345
   57   1HA   GLY   8          HA2       GLY   8  -1.341   5.687 -10.274
   58   2HA   GLY   8          HA1       GLY   8  -1.101   7.217  -9.444
   59    H    ASP   9           HN       ASP   9   0.835   6.210 -11.057
   60    HA   ASP   9           HA       ASP   9   2.867   4.941  -9.446
   61   1HB   ASP   9          HB2       ASP   9   2.768   5.998 -12.263
   62   2HB   ASP   9          HB1       ASP   9   4.305   5.584 -11.511
   63    H    LEU  10           HN       LEU  10   4.384   5.935  -8.300
   64    HA   LEU  10           HA       LEU  10   5.078   8.696  -8.877
   65   1HB   LEU  10          HB2       LEU  10   4.841   9.404  -6.543
   66   2HB   LEU  10          HB1       LEU  10   3.301   8.955  -7.245
   67    HG   LEU  10           HG       LEU  10   4.792   6.919  -5.648
   68   1HD1  LEU  10          HD11      LEU  10   3.113   9.139  -4.479
   69   2HD1  LEU  10          HD12      LEU  10   4.852   8.940  -4.267
   70   3HD1  LEU  10          HD13      LEU  10   3.740   7.744  -3.599
   71   1HD2  LEU  10          HD21      LEU  10   2.531   6.196  -5.095
   72   2HD2  LEU  10          HD22      LEU  10   2.751   6.295  -6.843
   73   3HD2  LEU  10          HD23      LEU  10   1.865   7.562  -5.992
   74    H    THR  11           HN       THR  11   7.162   9.150  -8.456
   75    HA   THR  11           HA       THR  11   8.776   6.925  -7.422
   76    HB   THR  11           HB       THR  11   9.696   9.315  -9.036
   77    HG1  THR  11           HG1      THR  11   8.631   8.200 -10.541
   78   1HG2  THR  11          HG21      THR  11  11.461   8.275  -7.682
   79   2HG2  THR  11          HG22      THR  11  11.719   7.978  -9.403
   80   3HG2  THR  11          HG23      THR  11  11.067   6.701  -8.376
   81    H    VAL  12           HN       VAL  12   9.615   7.085  -5.474
   82    HA   VAL  12           HA       VAL  12  10.012   9.766  -4.302
   83    HB   VAL  12           HB       VAL  12   9.390   7.214  -2.803
   84   1HG1  VAL  12          HG11      VAL  12  10.736   8.776  -1.516
   85   2HG1  VAL  12          HG12      VAL  12   9.096   8.692  -0.867
   86   3HG1  VAL  12          HG13      VAL  12   9.586  10.070  -1.854
   87   1HG2  VAL  12          HG21      VAL  12   7.593   9.553  -3.440
   88   2HG2  VAL  12          HG22      VAL  12   7.192   8.233  -2.342
   89   3HG2  VAL  12          HG23      VAL  12   7.437   7.909  -4.058
   90    H    ALA  13           HN       ALA  13  12.120  10.191  -4.315
   91    HA   ALA  13           HA       ALA  13  14.044   8.011  -4.053
   92   1HB   ALA  13          HB1       ALA  13  14.509  10.943  -4.599
   93   2HB   ALA  13          HB2       ALA  13  14.403   9.673  -5.818
   94   3HB   ALA  13          HB3       ALA  13  15.726   9.668  -4.653
   95    H    LYS  14           HN       LYS  14  14.235   7.395  -1.958
   96    HA   LYS  14           HA       LYS  14  15.477   9.194  -0.114
   97   1HB   LYS  14          HB2       LYS  14  12.819   9.505  -0.056
   98   2HB   LYS  14          HB1       LYS  14  12.927   8.095   0.983
   99   1HG   LYS  14          HG2       LYS  14  12.939   9.910   2.438
  100   2HG   LYS  14          HG1       LYS  14  14.627   9.414   2.332
  101   1HD   LYS  14          HD2       LYS  14  14.496  11.822   2.217
  102   2HD   LYS  14          HD1       LYS  14  14.996  11.195   0.644
  103   1HE   LYS  14          HE2       LYS  14  12.755  11.458  -0.221
  104   2HE   LYS  14          HE1       LYS  14  12.163  11.943   1.368
  105   1HZ   LYS  14          HZ1       LYS  14  12.498  13.857  -0.047
  106   2HZ   LYS  14          HZ2       LYS  14  14.124  13.446  -0.290
  107   3HZ   LYS  14          HZ3       LYS  14  13.584  13.902   1.254
  108    H    THR  15           HN       THR  15  15.907   8.122   1.992
  109    HA   THR  15           HA       THR  15  16.582   5.327   1.522
  110    HB   THR  15           HB       THR  15  17.877   5.514   3.610
  111    HG1  THR  15           HG1      THR  15  17.126   8.263   3.683
  112   1HG2  THR  15          HG21      THR  15  19.516   7.189   2.874
  113   2HG2  THR  15          HG22      THR  15  18.337   7.835   1.731
  114   3HG2  THR  15          HG23      THR  15  18.955   6.196   1.529
  115    H    ARG  16           HN       ARG  16  16.048   3.650   3.112
  116    HA   ARG  16           HA       ARG  16  13.485   4.006   4.370
  117   1HB   ARG  16          HB2       ARG  16  15.363   1.689   4.829
  118   2HB   ARG  16          HB1       ARG  16  13.634   1.733   5.132
  119   1HG   ARG  16          HG2       ARG  16  13.643   0.548   3.186
  120   2HG   ARG  16          HG1       ARG  16  13.557   2.191   2.525
  121   1HD   ARG  16          HD2       ARG  16  15.513   1.919   1.492
  122   2HD   ARG  16          HD1       ARG  16  16.289   1.524   3.018
  123    HE   ARG  16           HE       ARG  16  15.464  -0.307   0.960
  124   1HH1  ARG  16          HH11      ARG  16  16.031   0.031   4.415
  125   2HH1  ARG  16          HH12      ARG  16  16.445  -1.635   4.647
  126   1HH2  ARG  16          HH21      ARG  16  16.061  -2.514   1.286
  127   2HH2  ARG  16          HH22      ARG  16  16.457  -3.075   2.876
  128    H    GLY  17           HN       GLY  17  16.504   5.018   5.159
  129   1HA   GLY  17          HA2       GLY  17  16.376   4.724   8.014
  130   2HA   GLY  17          HA1       GLY  17  17.442   5.806   7.119
  131    H    GLN  18           HN       GLN  18  15.104   6.874   5.633
  132    HA   GLN  18           HA       GLN  18  14.131   8.907   7.335
  133   1HB   GLN  18          HB2       GLN  18  14.063   9.350   5.018
  134   2HB   GLN  18          HB1       GLN  18  13.301   7.809   4.658
  135   1HG   GLN  18          HG2       GLN  18  11.711   9.563   4.333
  136   2HG   GLN  18          HG1       GLN  18  11.237   8.614   5.737
  137   1HE2  GLN  18          HE21      GLN  18  12.462  11.668   4.623
  138   2HE2  GLN  18          HE22      GLN  18  12.168  12.544   6.082
  139    H    LEU  19           HN       LEU  19  12.777   5.886   6.136
  140    HA   LEU  19           HA       LEU  19  10.348   6.103   7.601
  141   1HB   LEU  19          HB2       LEU  19  11.457   3.514   6.567
  142   2HB   LEU  19          HB1       LEU  19   9.782   4.022   6.714
  143    HG   LEU  19           HG       LEU  19  11.718   5.186   4.716
  144   1HD1  LEU  19          HD11      LEU  19  10.521   3.853   3.055
  145   2HD1  LEU  19          HD12      LEU  19   9.576   3.094   4.336
  146   3HD1  LEU  19          HD13      LEU  19  11.317   2.824   4.248
  147   1HD2  LEU  19          HD21      LEU  19   8.726   5.398   5.005
  148   2HD2  LEU  19          HD22      LEU  19   9.689   6.081   3.694
  149   3HD2  LEU  19          HD23      LEU  19   9.894   6.673   5.343
  150    H    THR  20           HN       THR  20  10.860   6.373   9.751
  151    HA   THR  20           HA       THR  20  12.337   4.275  11.108
  152    HB   THR  20           HB       THR  20  11.608   5.990  13.086
  153    HG1  THR  20           HG1      THR  20  12.098   7.619  10.794
  154   1HG2  THR  20          HG21      THR  20  13.866   6.942  12.868
  155   2HG2  THR  20          HG22      THR  20  13.989   6.273  11.243
  156   3HG2  THR  20          HG23      THR  20  13.882   5.195  12.633
  157    H    ASP  21           HN       ASP  21  10.563   2.837  10.475
  158    HA   ASP  21           HA       ASP  21   8.689   1.631  10.796
  159   1HB   ASP  21          HB2       ASP  21   9.378   1.486  13.146
  160   2HB   ASP  21          HB1       ASP  21   8.569   3.014  13.487
  161    H    ALA  22           HN       ALA  22   7.395   4.233  12.768
  162    HA   ALA  22           HA       ALA  22   5.320   4.620  10.775
  163   1HB   ALA  22          HB1       ALA  22   5.583   5.855  13.512
  164   2HB   ALA  22          HB2       ALA  22   4.693   4.378  13.136
  165   3HB   ALA  22          HB3       ALA  22   4.169   5.921  12.460
  166    H    ALA  23           HN       ALA  23   7.258   5.458   9.456
  167    HA   ALA  23           HA       ALA  23   6.985   8.372   9.464
  168   1HB   ALA  23          HB1       ALA  23   9.629   6.953   9.143
  169   2HB   ALA  23          HB2       ALA  23   9.140   7.924  10.532
  170   3HB   ALA  23          HB3       ALA  23   9.352   8.684   8.954
  171    HA   PRO  24           HA       PRO  24   6.110   7.095   5.303
  172   1HB   PRO  24          HB2       PRO  24   4.661   9.232   4.638
  173   2HB   PRO  24          HB1       PRO  24   4.056   8.043   5.796
  174   1HG   PRO  24          HG2       PRO  24   5.226  10.746   6.285
  175   2HG   PRO  24          HG1       PRO  24   3.891   9.934   7.121
  176   1HD   PRO  24          HD2       PRO  24   6.528  10.061   8.019
  177   2HD   PRO  24          HD1       PRO  24   5.303   8.915   8.580
  178    H    ILE  25           HN       ILE  25   6.831   7.546   3.284
  179    HA   ILE  25           HA       ILE  25   8.764   9.733   2.983
  180    HB   ILE  25           HB       ILE  25   9.033   8.357   0.688
  181   1HG1  ILE  25          HG12      ILE  25   8.276   6.281   2.756
  182   2HG1  ILE  25          HG11      ILE  25   7.274   6.749   1.389
  183   1HG2  ILE  25          HG21      ILE  25  10.330   7.654   3.314
  184   2HG2  ILE  25          HG22      ILE  25  10.826   8.941   2.213
  185   3HG2  ILE  25          HG23      ILE  25  10.958   7.255   1.714
  186   1HD1  ILE  25          HD11      ILE  25   9.997   5.479   1.214
  187   2HD1  ILE  25          HD12      ILE  25   8.980   5.938  -0.152
  188   3HD1  ILE  25          HD13      ILE  25   8.451   4.670   0.955
  189    H    GLY  26           HN       GLY  26   6.325   8.103   0.939
  190   1HA   GLY  26          HA2       GLY  26   5.681  10.755  -0.170
  191   2HA   GLY  26          HA1       GLY  26   5.896   9.350  -1.204
  192    HA   PRO  27           HA       PRO  27   1.613   9.144   1.309
  193   1HB   PRO  27          HB2       PRO  27   1.149  12.058   0.924
  194   2HB   PRO  27          HB1       PRO  27   0.670  11.008   2.263
  195   1HG   PRO  27          HG2       PRO  27   2.693  12.743   2.505
  196   2HG   PRO  27          HG1       PRO  27   2.731  11.153   3.289
  197   1HD   PRO  27          HD2       PRO  27   4.180  12.099   0.865
  198   2HD   PRO  27          HD1       PRO  27   4.689  10.945   2.107
  199    H    VAL  28           HN       VAL  28   0.519   8.214  -0.279
  200    HA   VAL  28           HA       VAL  28   0.490   9.331  -2.954
  201    HB   VAL  28           HB       VAL  28  -0.929   6.860  -1.930
  202   1HG1  VAL  28          HG11      VAL  28  -0.193   7.730  -4.726
  203   2HG1  VAL  28          HG12      VAL  28  -1.816   7.666  -4.038
  204   3HG1  VAL  28          HG13      VAL  28  -0.908   6.177  -4.294
  205   1HG2  VAL  28          HG21      VAL  28   0.967   5.588  -2.819
  206   2HG2  VAL  28          HG22      VAL  28   1.466   6.680  -1.528
  207   3HG2  VAL  28          HG23      VAL  28   1.794   7.096  -3.209
  208    H    THR  29           HN       THR  29  -1.163  10.449  -3.848
  209    HA   THR  29           HA       THR  29  -3.407  11.193  -2.232
  210    HB   THR  29           HB       THR  29  -4.171  12.308  -4.408
  211    HG1  THR  29           HG1      THR  29  -3.045  11.235  -5.967
  212   1HG2  THR  29          HG21      THR  29  -3.037  13.531  -2.624
  213   2HG2  THR  29          HG22      THR  29  -2.500  14.097  -4.204
  214   3HG2  THR  29          HG23      THR  29  -1.470  13.025  -3.255
  215    H    VAL  30           HN       VAL  30  -4.366   9.178  -1.798
  216    HA   VAL  30           HA       VAL  30  -5.484   7.684  -4.044
  217    HB   VAL  30           HB       VAL  30  -5.657   7.070  -1.093
  218   1HG1  VAL  30          HG11      VAL  30  -6.213   5.374  -3.521
  219   2HG1  VAL  30          HG12      VAL  30  -7.395   5.985  -2.365
  220   3HG1  VAL  30          HG13      VAL  30  -6.201   4.791  -1.858
  221   1HG2  VAL  30          HG21      VAL  30  -3.717   6.028  -3.163
  222   2HG2  VAL  30          HG22      VAL  30  -3.873   5.416  -1.517
  223   3HG2  VAL  30          HG23      VAL  30  -3.328   7.069  -1.794
  224    H    GLN  31           HN       GLN  31  -7.381   8.283  -4.755
  225    HA   GLN  31           HA       GLN  31  -9.339   9.385  -2.866
  226   1HB   GLN  31          HB2       GLN  31  -8.668  10.962  -4.627
  227   2HB   GLN  31          HB1       GLN  31  -9.137   9.793  -5.855
  228   1HG   GLN  31          HG2       GLN  31 -11.456   9.916  -5.073
  229   2HG   GLN  31          HG1       GLN  31 -10.976  11.116  -3.873
  230   1HE2  GLN  31          HE21      GLN  31 -12.330  12.670  -4.720
  231   2HE2  GLN  31          HE22      GLN  31 -11.999  13.475  -6.223
  232    H    ALA  32           HN       ALA  32 -11.261   8.384  -2.654
  233    HA   ALA  32           HA       ALA  32 -11.741   6.000  -4.293
  234   1HB   ALA  32          HB1       ALA  32 -13.007   6.828  -1.679
  235   2HB   ALA  32          HB2       ALA  32 -11.702   5.657  -1.864
  236   3HB   ALA  32          HB3       ALA  32 -13.294   5.314  -2.538
  237    H    LEU  33           HN       LEU  33 -12.821   6.600  -6.080
  238    HA   LEU  33           HA       LEU  33 -14.741   8.762  -5.998
  239   1HB   LEU  33          HB2       LEU  33 -13.227   8.429  -7.928
  240   2HB   LEU  33          HB1       LEU  33 -14.008   6.895  -8.256
  241    HG   LEU  33           HG       LEU  33 -16.134   8.095  -8.678
  242   1HD1  LEU  33          HD11      LEU  33 -14.429  10.563  -8.387
  243   2HD1  LEU  33          HD12      LEU  33 -15.738  10.068  -7.314
  244   3HD1  LEU  33          HD13      LEU  33 -16.087  10.522  -8.982
  245   1HD2  LEU  33          HD21      LEU  33 -13.793   9.035 -10.329
  246   2HD2  LEU  33          HD22      LEU  33 -15.482   9.019 -10.838
  247   3HD2  LEU  33          HD23      LEU  33 -14.642   7.501 -10.518
  248    H    GLY  34           HN       GLY  34 -16.707   8.418  -5.229
  249   1HA   GLY  34          HA2       GLY  34 -18.870   7.528  -5.359
  250   2HA   GLY  34          HA1       GLY  34 -18.233   6.145  -6.232
  251    H    CYS  35           HN       CYS  35 -18.302   4.336  -5.187
  252    HA   CYS  35           HA       CYS  35 -18.213   2.752  -3.591
  253   1HB   CYS  35          HB2       CYS  35 -16.995   4.866  -1.806
  254   2HB   CYS  35          HB1       CYS  35 -16.964   3.126  -1.537
  255    H    ASN  36           HN       ASN  36 -18.850   5.632  -1.605
  256    HA   ASN  36           HA       ASN  36 -20.566   6.293  -0.312
  257   1HB   ASN  36          HB2       ASN  36 -22.097   4.561  -2.234
  258   2HB   ASN  36          HB1       ASN  36 -22.896   5.412  -0.917
  259   1HD2  ASN  36          HD21      ASN  36 -21.340   5.705  -3.990
  260   2HD2  ASN  36          HD22      ASN  36 -21.686   7.389  -4.235
  261    H    ALA  37           HN       ALA  37 -21.009   2.794  -0.830
  262    HA   ALA  37           HA       ALA  37 -21.090   2.500   2.103
  263   1HB   ALA  37          HB1       ALA  37 -22.874   1.063   0.133
  264   2HB   ALA  37          HB2       ALA  37 -23.373   2.350   1.231
  265   3HB   ALA  37          HB3       ALA  37 -22.832   0.802   1.875
  266    H    ARG  38           HN       ARG  38 -18.795   2.195   0.588
  267    HA   ARG  38           HA       ARG  38 -18.466  -0.727   0.492
  268   1HB   ARG  38          HB2       ARG  38 -18.586   0.368  -1.771
  269   2HB   ARG  38          HB1       ARG  38 -17.116   1.241  -1.351
  270   1HG   ARG  38          HG2       ARG  38 -16.658  -0.708  -2.744
  271   2HG   ARG  38          HG1       ARG  38 -15.899  -0.840  -1.157
  272   1HD   ARG  38          HD2       ARG  38 -16.876  -2.958  -1.773
  273   2HD   ARG  38          HD1       ARG  38 -17.760  -2.270  -0.414
  274    HE   ARG  38           HE       ARG  38 -19.196  -1.434  -2.552
  275   1HH1  ARG  38          HH11      ARG  38 -17.988  -4.573  -1.572
  276   2HH1  ARG  38          HH12      ARG  38 -19.303  -5.457  -2.291
  277   1HH2  ARG  38          HH21      ARG  38 -20.938  -2.594  -3.499
  278   2HH2  ARG  38          HH22      ARG  38 -20.990  -4.324  -3.359
  279    H    GLN  39           HN       GLN  39 -16.507  -1.560   1.168
  280    HA   GLN  39           HA       GLN  39 -14.853   0.184   2.787
  281   1HB   GLN  39          HB2       GLN  39 -14.779  -2.811   2.310
  282   2HB   GLN  39          HB1       GLN  39 -13.712  -1.943   3.407
  283   1HG   GLN  39          HG2       GLN  39 -15.336  -1.568   4.950
  284   2HG   GLN  39          HG1       GLN  39 -16.630  -1.559   3.755
  285   1HE2  GLN  39          HE21      GLN  39 -16.327  -2.968   6.328
  286   2HE2  GLN  39          HE22      GLN  39 -16.578  -4.640   5.963
  287    H    VAL  40           HN       VAL  40 -13.052   1.095   2.063
  288    HA   VAL  40           HA       VAL  40 -11.998   0.324  -0.542
  289    HB   VAL  40           HB       VAL  40 -11.176   2.609   1.265
  290   1HG1  VAL  40          HG11      VAL  40  -9.408   1.996  -0.268
  291   2HG1  VAL  40          HG12      VAL  40 -10.130   3.523  -0.775
  292   3HG1  VAL  40          HG13      VAL  40 -10.532   2.032  -1.626
  293   1HG2  VAL  40          HG21      VAL  40 -12.459   4.026  -0.299
  294   2HG2  VAL  40          HG22      VAL  40 -13.476   2.881   0.572
  295   3HG2  VAL  40          HG23      VAL  40 -13.041   2.569  -1.108
  296    H    ALA  41           HN       ALA  41 -10.316  -1.038  -0.699
  297    HA   ALA  41           HA       ALA  41  -8.529  -1.333   1.603
  298   1HB   ALA  41          HB1       ALA  41  -9.330  -3.499  -0.335
  299   2HB   ALA  41          HB2       ALA  41 -10.068  -3.261   1.247
  300   3HB   ALA  41          HB3       ALA  41  -8.359  -3.679   1.128
  301    H    LEU  42           HN       LEU  42  -6.348  -1.581   1.156
  302    HA   LEU  42           HA       LEU  42  -5.587  -0.958  -1.600
  303   1HB   LEU  42          HB2       LEU  42  -4.155  -0.657   1.028
  304   2HB   LEU  42          HB1       LEU  42  -3.282  -0.608  -0.492
  305    HG   LEU  42           HG       LEU  42  -4.830   1.271  -1.182
  306   1HD1  LEU  42          HD11      LEU  42  -6.581   0.871   0.487
  307   2HD1  LEU  42          HD12      LEU  42  -5.954   2.516   0.561
  308   3HD1  LEU  42          HD13      LEU  42  -5.452   1.327   1.766
  309   1HD2  LEU  42          HD21      LEU  42  -3.568   2.954   0.064
  310   2HD2  LEU  42          HD22      LEU  42  -2.529   1.655  -0.521
  311   3HD2  LEU  42          HD23      LEU  42  -3.007   1.705   1.175
  312    H    LYS  43           HN       LYS  43  -5.395  -2.743  -2.744
  313    HA   LYS  43           HA       LYS  43  -4.057  -5.084  -1.606
  314   1HB   LYS  43          HB2       LYS  43  -5.743  -4.609  -4.040
  315   2HB   LYS  43          HB1       LYS  43  -4.648  -5.975  -4.009
  316   1HG   LYS  43          HG2       LYS  43  -6.915  -6.625  -3.401
  317   2HG   LYS  43          HG1       LYS  43  -5.796  -6.875  -2.062
  318   1HD   LYS  43          HD2       LYS  43  -7.152  -4.264  -2.109
  319   2HD   LYS  43          HD1       LYS  43  -8.200  -5.661  -1.848
  320   1HE   LYS  43          HE2       LYS  43  -5.738  -4.955  -0.258
  321   2HE   LYS  43          HE1       LYS  43  -7.409  -4.761   0.270
  322   1HZ   LYS  43          HZ1       LYS  43  -7.713  -7.110   0.242
  323   2HZ   LYS  43          HZ2       LYS  43  -6.297  -6.790   1.118
  324   3HZ   LYS  43          HZ3       LYS  43  -6.197  -7.361  -0.467
  325    H    ALA  44           HN       ALA  44  -2.212  -5.970  -2.645
  326    HA   ALA  44           HA       ALA  44  -0.796  -4.039  -4.343
  327   1HB   ALA  44          HB1       ALA  44   0.309  -4.410  -2.208
  328   2HB   ALA  44          HB2       ALA  44   1.284  -5.043  -3.535
  329   3HB   ALA  44          HB3       ALA  44   0.353  -6.145  -2.518
  330    H    ASP  45           HN       ASP  45   0.534  -4.904  -6.019
  331    HA   ASP  45           HA       ASP  45  -0.710  -7.125  -7.383
  332   1HB   ASP  45          HB2       ASP  45   0.094  -5.050  -8.547
  333   2HB   ASP  45          HB1       ASP  45   1.743  -5.511  -8.139
  334    H    THR  46           HN       THR  46   0.504  -9.064  -8.038
  335    HA   THR  46           HA       THR  46   1.815 -10.253  -5.878
  336    HB   THR  46           HB       THR  46   0.697 -11.543  -7.677
  337    HG1  THR  46           HG1      THR  46   3.196 -12.085  -6.619
  338   1HG2  THR  46          HG21      THR  46   1.534 -10.334  -9.622
  339   2HG2  THR  46          HG22      THR  46   1.936 -12.049  -9.736
  340   3HG2  THR  46          HG23      THR  46   3.174 -10.880  -9.274
  341    H    ASP  47           HN       ASP  47   3.061  -8.099  -8.182
  342    HA   ASP  47           HA       ASP  47   5.767  -8.729  -8.313
  343   1HB   ASP  47          HB2       ASP  47   4.816  -6.969  -9.654
  344   2HB   ASP  47          HB1       ASP  47   4.332  -6.069  -8.223
  345    H    ASN  48           HN       ASN  48   3.937  -7.117  -5.749
  346    HA   ASN  48           HA       ASN  48   6.260  -7.479  -3.977
  347   1HB   ASN  48          HB2       ASN  48   5.869  -5.339  -2.899
  348   2HB   ASN  48          HB1       ASN  48   6.110  -5.067  -4.622
  349   1HD2  ASN  48          HD21      ASN  48   4.687  -3.567  -2.465
  350   2HD2  ASN  48          HD22      ASN  48   3.107  -3.277  -3.106
  351    H    PHE  49           HN       PHE  49   3.620  -8.853  -4.508
  352    HA   PHE  49           HA       PHE  49   2.522  -8.719  -1.773
  353   1HB   PHE  49          HB2       PHE  49   1.039  -7.681  -3.494
  354   2HB   PHE  49          HB1       PHE  49   0.990  -9.216  -4.336
  355    HD1  PHE  49           HD1      PHE  49  -0.116  -7.375  -1.371
  356    HD2  PHE  49           HD2      PHE  49  -0.417 -11.005  -3.572
  357    HE1  PHE  49           HE1      PHE  49  -2.038  -8.046   0.005
  358    HE2  PHE  49           HE2      PHE  49  -2.342 -11.683  -2.200
  359    HZ   PHE  49           HZ       PHE  49  -3.306 -10.113  -0.595
  360    H    GLU  50           HN       GLU  50   3.383 -10.519  -0.880
  361    HA   GLU  50           HA       GLU  50   3.314 -13.004  -2.435
  362   1HB   GLU  50          HB2       GLU  50   4.872 -13.892  -0.699
  363   2HB   GLU  50          HB1       GLU  50   5.507 -12.516  -1.586
  364   1HG   GLU  50          HG2       GLU  50   4.936 -11.057   0.307
  365   2HG   GLU  50          HG1       GLU  50   4.351 -12.459   1.190
  366    H    GLN  51           HN       GLN  51   1.438 -13.974  -2.225
  367    HA   GLN  51           HA       GLN  51  -0.216 -15.243  -1.348
  368   1HB   GLN  51          HB2       GLN  51   1.574 -16.102   0.184
  369   2HB   GLN  51          HB1       GLN  51   1.100 -14.880   1.351
  370   1HG   GLN  51          HG2       GLN  51  -0.920 -16.824   0.312
  371   2HG   GLN  51          HG1       GLN  51   0.213 -17.307   1.570
  372   1HE2  GLN  51          HE21      GLN  51   0.281 -14.685   2.820
  373   2HE2  GLN  51          HE22      GLN  51  -1.234 -14.501   3.641
  374    H    GLY  52           HN       GLY  52   0.559 -12.644   0.967
  375   1HA   GLY  52          HA2       GLY  52  -1.835 -11.230   0.429
  376   2HA   GLY  52          HA1       GLY  52  -2.030 -12.196   1.887
  377    H    LYS  53           HN       LYS  53   0.920 -10.646   0.758
  378    HA   LYS  53           HA       LYS  53   0.744  -8.590   2.822
  379   1HB   LYS  53          HB2       LYS  53   3.072 -10.502   2.610
  380   2HB   LYS  53          HB1       LYS  53   2.958  -9.142   3.711
  381   1HG   LYS  53          HG2       LYS  53   1.042 -11.463   3.771
  382   2HG   LYS  53          HG1       LYS  53   2.522 -11.398   4.730
  383   1HD   LYS  53          HD2       LYS  53   1.756  -9.479   5.922
  384   2HD   LYS  53          HD1       LYS  53   0.398  -9.267   4.816
  385   1HE   LYS  53          HE2       LYS  53   0.598 -11.845   6.276
  386   2HE   LYS  53          HE1       LYS  53   0.131 -10.419   7.200
  387   1HZ   LYS  53          HZ1       LYS  53  -1.270 -10.748   4.687
  388   2HZ   LYS  53          HZ2       LYS  53  -1.875 -10.341   6.221
  389   3HZ   LYS  53          HZ3       LYS  53  -1.575 -11.964   5.825
  390    H    PHE  54           HN       PHE  54   1.792  -6.728   2.233
  391    HA   PHE  54           HA       PHE  54   3.304  -6.835  -0.278
  392   1HB   PHE  54          HB2       PHE  54   2.650  -4.363  -0.467
  393   2HB   PHE  54          HB1       PHE  54   1.443  -5.593  -0.793
  394    HD1  PHE  54           HD1      PHE  54  -0.672  -4.813  -0.194
  395    HD2  PHE  54           HD2      PHE  54   2.653  -3.973   2.333
  396    HE1  PHE  54           HE1      PHE  54  -2.175  -3.729   1.431
  397    HE2  PHE  54           HE2      PHE  54   1.149  -2.896   3.959
  398    HZ   PHE  54           HZ       PHE  54  -1.363  -2.754   3.398
  399    H    PHE  55           HN       PHE  55   5.056  -5.426  -0.583
  400    HA   PHE  55           HA       PHE  55   6.358  -4.274   1.722
  401   1HB   PHE  55          HB2       PHE  55   8.340  -5.863   1.443
  402   2HB   PHE  55          HB1       PHE  55   6.908  -6.532   2.219
  403    HD1  PHE  55           HD1      PHE  55   8.937  -6.496  -0.828
  404    HD2  PHE  55           HD2      PHE  55   5.623  -8.270   1.162
  405    HE1  PHE  55           HE1      PHE  55   8.924  -8.311  -2.479
  406    HE2  PHE  55           HE2      PHE  55   5.604 -10.092  -0.492
  407    HZ   PHE  55           HZ       PHE  55   7.161 -10.099  -2.330
  408    H    LEU  56           HN       LEU  56   8.725  -3.726   1.100
  409    HA   LEU  56           HA       LEU  56   8.841  -2.518  -1.528
  410   1HB   LEU  56          HB2       LEU  56  11.142  -2.853   0.393
  411   2HB   LEU  56          HB1       LEU  56  10.937  -1.639  -0.843
  412    HG   LEU  56           HG       LEU  56   9.192  -1.770   1.603
  413   1HD1  LEU  56          HD11      LEU  56  11.674  -0.118   1.149
  414   2HD1  LEU  56          HD12      LEU  56  11.532  -1.475   2.267
  415   3HD1  LEU  56          HD13      LEU  56  10.590  -0.007   2.537
  416   1HD2  LEU  56          HD21      LEU  56   9.758   0.419  -0.388
  417   2HD2  LEU  56          HD22      LEU  56   8.710   0.549   1.024
  418   3HD2  LEU  56          HD23      LEU  56   8.280  -0.540  -0.297
  419    H    ILE  57           HN       ILE  57   9.315  -3.810  -3.294
  420    HA   ILE  57           HA       ILE  57  11.089  -6.095  -2.766
  421    HB   ILE  57           HB       ILE  57   8.947  -6.744  -3.771
  422   1HG1  ILE  57          HG12      ILE  57   9.860  -8.049  -5.678
  423   2HG1  ILE  57          HG11      ILE  57  11.324  -7.077  -5.611
  424   1HG2  ILE  57          HG21      ILE  57   8.430  -4.745  -5.034
  425   2HG2  ILE  57          HG22      ILE  57   8.406  -6.161  -6.085
  426   3HG2  ILE  57          HG23      ILE  57   9.783  -5.060  -6.121
  427   1HD1  ILE  57          HD11      ILE  57  11.667  -9.202  -4.522
  428   2HD1  ILE  57          HD12      ILE  57  10.301  -8.899  -3.450
  429   3HD1  ILE  57          HD13      ILE  57  11.746  -7.894  -3.341
  430    H    SER  58           HN       SER  58  13.086  -5.987  -3.374
  431    HA   SER  58           HA       SER  58  14.058  -3.649  -4.689
  432   1HB   SER  58          HB2       SER  58  15.293  -4.704  -2.852
  433   2HB   SER  58          HB1       SER  58  15.499  -6.162  -3.817
  434    HG   SER  58           HG       SER  58  16.675  -3.627  -4.140
  435    H    ASP  59           HN       ASP  59  15.011  -3.442  -6.663
  436    HA   ASP  59           HA       ASP  59  14.428  -5.184  -8.791
  437   1HB   ASP  59          HB2       ASP  59  14.961  -2.946  -9.346
  438   2HB   ASP  59          HB1       ASP  59  16.448  -2.980  -8.404
  439    H    ASN  60           HN       ASN  60  16.995  -5.053  -6.468
  440    HA   ASN  60           HA       ASN  60  18.682  -6.961  -7.818
  441   1HB   ASN  60          HB2       ASN  60  19.479  -5.104  -6.284
  442   2HB   ASN  60          HB1       ASN  60  18.839  -6.046  -4.942
  443   1HD2  ASN  60          HD21      ASN  60  20.388  -7.374  -7.803
  444   2HD2  ASN  60          HD22      ASN  60  21.779  -7.994  -6.977
  445    H    ASN  61           HN       ASN  61  16.108  -6.975  -5.538
  446    HA   ASN  61           HA       ASN  61  14.807  -8.603  -4.665
  447   1HB   ASN  61          HB2       ASN  61  15.036  -9.501  -7.030
  448   2HB   ASN  61          HB1       ASN  61  16.274 -10.586  -6.407
  449   1HD2  ASN  61          HD21      ASN  61  15.064 -12.414  -6.917
  450   2HD2  ASN  61          HD22      ASN  61  13.658 -12.867  -6.015
  451    H    ARG  62           HN       ARG  62  17.632  -8.067  -3.634
  452    HA   ARG  62           HA       ARG  62  18.056 -10.563  -2.161
  453   1HB   ARG  62          HB2       ARG  62  19.713  -8.052  -2.382
  454   2HB   ARG  62          HB1       ARG  62  20.082  -9.348  -1.252
  455   1HG   ARG  62          HG2       ARG  62  20.297 -10.905  -3.141
  456   2HG   ARG  62          HG1       ARG  62  19.990  -9.564  -4.250
  457   1HD   ARG  62          HD2       ARG  62  21.972  -8.412  -3.442
  458   2HD   ARG  62          HD1       ARG  62  22.256  -9.692  -2.263
  459    HE   ARG  62           HE       ARG  62  22.592 -11.190  -4.239
  460   1HH1  ARG  62          HH11      ARG  62  22.972  -7.731  -4.611
  461   2HH1  ARG  62          HH12      ARG  62  24.191  -7.862  -5.846
  462   1HH2  ARG  62          HH21      ARG  62  24.215 -11.370  -5.851
  463   2HH2  ARG  62          HH22      ARG  62  24.885  -9.929  -6.547
  464    H    ASP  63           HN       ASP  63  16.287  -7.806  -1.859
  465    HA   ASP  63           HA       ASP  63  16.106  -8.076   1.036
  466   1HB   ASP  63          HB2       ASP  63  17.760  -6.349   0.852
  467   2HB   ASP  63          HB1       ASP  63  16.829  -5.512  -0.385
  468    H    LYS  64           HN       LYS  64  14.125  -7.618   1.860
  469    HA   LYS  64           HA       LYS  64  12.287  -5.967   0.371
  470   1HB   LYS  64          HB2       LYS  64  10.436  -7.574   0.426
  471   2HB   LYS  64          HB1       LYS  64  11.765  -8.163  -0.553
  472   1HG   LYS  64          HG2       LYS  64  11.281 -10.074   0.558
  473   2HG   LYS  64          HG1       LYS  64  12.400  -9.377   1.729
  474   1HD   LYS  64          HD2       LYS  64  10.573  -8.546   3.061
  475   2HD   LYS  64          HD1       LYS  64   9.402  -9.041   1.839
  476   1HE   LYS  64          HE2       LYS  64  11.218 -10.951   3.301
  477   2HE   LYS  64          HE1       LYS  64   9.579 -10.566   3.822
  478   1HZ   LYS  64          HZ1       LYS  64  10.299 -11.756   1.194
  479   2HZ   LYS  64          HZ2       LYS  64   8.727 -11.445   1.751
  480   3HZ   LYS  64          HZ3       LYS  64   9.685 -12.614   2.516
  481    H    LEU  65           HN       LEU  65  11.196  -4.680   1.705
  482    HA   LEU  65           HA       LEU  65  10.926  -5.472   4.532
  483   1HB   LEU  65          HB2       LEU  65  11.633  -2.852   3.318
  484   2HB   LEU  65          HB1       LEU  65  10.649  -2.857   4.767
  485    HG   LEU  65           HG       LEU  65  12.873  -2.564   5.455
  486   1HD1  LEU  65          HD11      LEU  65  12.167  -5.460   5.860
  487   2HD1  LEU  65          HD12      LEU  65  11.582  -4.104   6.825
  488   3HD1  LEU  65          HD13      LEU  65  13.296  -4.521   6.838
  489   1HD2  LEU  65          HD21      LEU  65  13.598  -4.962   3.787
  490   2HD2  LEU  65          HD22      LEU  65  14.697  -4.074   4.846
  491   3HD2  LEU  65          HD23      LEU  65  14.002  -3.283   3.431
  492    H    TYR  66           HN       TYR  66   8.893  -5.532   5.329
  493    HA   TYR  66           HA       TYR  66   6.711  -5.163   3.546
  494   1HB   TYR  66          HB2       TYR  66   6.796  -5.633   6.531
  495   2HB   TYR  66          HB1       TYR  66   5.306  -5.567   5.594
  496    HD1  TYR  66           HD1      TYR  66   8.374  -7.483   6.229
  497    HD2  TYR  66           HD2      TYR  66   4.659  -7.386   4.160
  498    HE1  TYR  66           HE1      TYR  66   8.613  -9.869   5.706
  499    HE2  TYR  66           HE2      TYR  66   4.890  -9.780   3.631
  500    HH   TYR  66           HH       TYR  66   7.095 -11.795   5.166
  501    H    VAL  67           HN       VAL  67   5.069  -3.606   3.599
  502    HA   VAL  67           HA       VAL  67   5.885  -1.094   4.908
  503    HB   VAL  67           HB       VAL  67   4.849   0.134   3.050
  504   1HG1  VAL  67          HG11      VAL  67   6.946  -1.849   2.196
  505   2HG1  VAL  67          HG12      VAL  67   7.230  -0.303   2.996
  506   3HG1  VAL  67          HG13      VAL  67   6.561  -0.343   1.365
  507   1HG2  VAL  67          HG21      VAL  67   4.495  -2.594   1.816
  508   2HG2  VAL  67          HG22      VAL  67   4.280  -1.064   0.967
  509   3HG2  VAL  67          HG23      VAL  67   3.215  -1.486   2.311
  510    H    ASN  68           HN       ASN  68   4.310   0.220   5.742
  511    HA   ASN  68           HA       ASN  68   1.603  -0.932   5.860
  512   1HB   ASN  68          HB2       ASN  68   3.087   0.797   7.854
  513   2HB   ASN  68          HB1       ASN  68   1.351   0.528   7.932
  514   1HD2  ASN  68          HD21      ASN  68   4.492  -0.889   8.332
  515   2HD2  ASN  68          HD22      ASN  68   3.966  -2.325   9.150
  516    H    ILE  69           HN       ILE  69   0.398   0.075   4.408
  517    HA   ILE  69           HA       ILE  69   0.856   2.894   3.822
  518    HB   ILE  69           HB       ILE  69  -1.426   1.950   2.422
  519   1HG1  ILE  69          HG12      ILE  69   0.925   0.049   2.277
  520   2HG1  ILE  69          HG11      ILE  69  -0.676  -0.334   2.900
  521   1HG2  ILE  69          HG21      ILE  69   1.400   2.468   1.514
  522   2HG2  ILE  69          HG22      ILE  69   0.102   3.655   1.633
  523   3HG2  ILE  69          HG23      ILE  69  -0.004   2.347   0.455
  524   1HD1  ILE  69          HD11      ILE  69  -0.376  -1.223   0.672
  525   2HD1  ILE  69          HD12      ILE  69  -0.005   0.388   0.058
  526   3HD1  ILE  69          HD13      ILE  69  -1.617   0.028   0.676
  527    H    ARG  70           HN       ARG  70  -0.117   4.322   5.116
  528    HA   ARG  70           HA       ARG  70  -2.616   3.457   6.423
  529   1HB   ARG  70          HB2       ARG  70  -0.376   5.001   7.743
  530   2HB   ARG  70          HB1       ARG  70  -1.876   4.489   8.502
  531   1HG   ARG  70          HG2       ARG  70  -1.226   2.148   8.202
  532   2HG   ARG  70          HG1       ARG  70   0.284   2.671   7.454
  533   1HD   ARG  70          HD2       ARG  70   0.783   2.159   9.713
  534   2HD   ARG  70          HD1       ARG  70   0.785   3.916   9.581
  535    HE   ARG  70           HE       ARG  70  -1.771   3.198  10.361
  536   1HH1  ARG  70          HH11      ARG  70   1.484   2.982  11.628
  537   2HH1  ARG  70          HH12      ARG  70   0.981   2.934  13.286
  538   1HH2  ARG  70          HH21      ARG  70  -2.453   3.110  12.547
  539   2HH2  ARG  70          HH22      ARG  70  -1.262   2.975  13.814
  540    HA   PRO  71           HA       PRO  71  -4.411   7.264   5.080
  541   1HB   PRO  71          HB2       PRO  71  -5.831   7.172   7.683
  542   2HB   PRO  71          HB1       PRO  71  -6.489   7.257   6.044
  543   1HG   PRO  71          HG2       PRO  71  -6.612   5.001   7.454
  544   2HG   PRO  71          HG1       PRO  71  -6.298   4.976   5.708
  545   1HD   PRO  71          HD2       PRO  71  -4.395   4.618   7.987
  546   2HD   PRO  71          HD1       PRO  71  -4.457   3.779   6.422
  547    H    MET  72           HN       MET  72  -3.919   9.383   5.338
  548    HA   MET  72           HA       MET  72  -2.005  10.126   7.291
  549   1HB   MET  72          HB2       MET  72  -2.056  11.113   5.044
  550   2HB   MET  72          HB1       MET  72  -3.605  11.864   5.406
  551   1HG   MET  72          HG2       MET  72  -2.524  13.167   7.193
  552   2HG   MET  72          HG1       MET  72  -0.974  12.457   6.742
  553   1HE   MET  72          HE1       MET  72  -1.518  15.615   6.910
  554   2HE   MET  72          HE2       MET  72  -0.668  16.154   5.461
  555   3HE   MET  72          HE3       MET  72   0.039  14.904   6.486
  556    H    ASP  73           HN       ASP  73  -3.256   9.510   9.190
  557    HA   ASP  73           HA       ASP  73  -4.249  10.079  11.151
  558   1HB   ASP  73          HB2       ASP  73  -2.575  11.967  10.762
  559   2HB   ASP  73          HB1       ASP  73  -3.951  12.947  10.267
  560    H    ASN  74           HN       ASN  74  -6.131   9.381   9.287
  561    HA   ASN  74           HA       ASN  74  -8.266  11.363   9.715
  562   1HB   ASN  74          HB2       ASN  74  -7.627   9.639   7.393
  563   2HB   ASN  74          HB1       ASN  74  -9.329   9.877   7.758
  564   1HD2  ASN  74          HD21      ASN  74  -6.352  11.450   6.818
  565   2HD2  ASN  74          HD22      ASN  74  -7.079  12.908   6.243
  566    H    SER  75           HN       SER  75  -8.663   8.016   8.672
  567    HA   SER  75           HA       SER  75 -10.378   7.634  11.028
  568   1HB   SER  75          HB2       SER  75 -11.605   7.808   8.856
  569   2HB   SER  75          HB1       SER  75 -10.727   6.389   8.285
  570    HG   SER  75           HG       SER  75 -12.507   5.487   9.093
  571    H    ALA  76           HN       ALA  76 -10.733   5.289  11.554
  572    HA   ALA  76           HA       ALA  76  -8.140   4.013  11.778
  573   1HB   ALA  76          HB1       ALA  76  -9.569   4.194  13.759
  574   2HB   ALA  76          HB2       ALA  76  -9.241   2.508  13.352
  575   3HB   ALA  76          HB3       ALA  76 -10.804   3.223  12.957
  576    H    TRP  77           HN       TRP  77  -7.489   2.722  10.229
  577    HA   TRP  77           HA       TRP  77  -9.452   1.161   8.705
  578   1HB   TRP  77          HB2       TRP  77  -6.639   2.059   8.100
  579   2HB   TRP  77          HB1       TRP  77  -7.441   0.813   7.155
  580    HD1  TRP  77           HD1      TRP  77  -8.990   4.194   8.332
  581    HE1  TRP  77           HE1      TRP  77  -9.743   5.481   6.215
  582    HE3  TRP  77           HE3      TRP  77  -7.265   0.969   4.775
  583    HZ2  TRP  77           HZ2      TRP  77  -9.604   5.150   3.412
  584    HZ3  TRP  77           HZ3      TRP  77  -7.615   1.512   2.410
  585    HH2  TRP  77           HH2      TRP  77  -8.758   3.565   1.738
  586    H    THR  78           HN       THR  78  -9.414  -1.025   8.724
  587    HA   THR  78           HA       THR  78  -7.979  -2.471  10.686
  588    HB   THR  78           HB       THR  78  -9.251  -3.611   8.189
  589    HG1  THR  78           HG1      THR  78 -10.590  -3.217  10.672
  590   1HG2  THR  78          HG21      THR  78  -8.867  -4.742  10.967
  591   2HG2  THR  78          HG22      THR  78  -7.947  -5.194   9.532
  592   3HG2  THR  78          HG23      THR  78  -9.671  -5.557   9.626
  593    H    THR  79           HN       THR  79  -5.974  -3.347  10.600
  594    HA   THR  79           HA       THR  79  -4.500  -2.825   8.114
  595    HB   THR  79           HB       THR  79  -3.763  -1.417   9.916
  596    HG1  THR  79           HG1      THR  79  -1.899  -3.510   9.388
  597   1HG2  THR  79          HG21      THR  79  -2.751  -2.322  11.964
  598   2HG2  THR  79          HG22      THR  79  -3.237  -3.945  11.476
  599   3HG2  THR  79          HG23      THR  79  -4.463  -2.727  11.833
  600    H    ASP  80           HN       ASP  80  -4.539  -4.689   7.039
  601    HA   ASP  80           HA       ASP  80  -2.764  -6.734   8.206
  602   1HB   ASP  80          HB2       ASP  80  -4.874  -7.827   7.700
  603   2HB   ASP  80          HB1       ASP  80  -4.935  -7.073   6.109
  604    H    ASN  81           HN       ASN  81  -0.990  -7.341   6.843
  605    HA   ASN  81           HA       ASN  81  -0.138  -5.144   5.234
  606   1HB   ASN  81          HB2       ASN  81   1.105  -7.739   6.019
  607   2HB   ASN  81          HB1       ASN  81   1.799  -6.832   4.680
  608   1HD2  ASN  81          HD21      ASN  81   2.678  -4.784   5.072
  609   2HD2  ASN  81          HD22      ASN  81   3.130  -4.285   6.665
  610    H    GLY  82           HN       GLY  82  -2.274  -7.481   4.423
  611   1HA   GLY  82          HA2       GLY  82  -1.613  -6.998   1.584
  612   2HA   GLY  82          HA1       GLY  82  -2.259  -8.539   2.134
  613    H    VAL  83           HN       VAL  83  -3.827  -6.722   4.113
  614    HA   VAL  83           HA       VAL  83  -5.901  -5.780   2.247
  615    HB   VAL  83           HB       VAL  83  -6.419  -7.280   4.827
  616   1HG1  VAL  83          HG11      VAL  83  -8.772  -7.172   4.161
  617   2HG1  VAL  83          HG12      VAL  83  -8.325  -6.189   2.768
  618   3HG1  VAL  83          HG13      VAL  83  -8.078  -5.569   4.399
  619   1HG2  VAL  83          HG21      VAL  83  -6.873  -8.154   1.976
  620   2HG2  VAL  83          HG22      VAL  83  -7.361  -9.043   3.420
  621   3HG2  VAL  83          HG23      VAL  83  -5.649  -8.790   3.076
  622    H    PHE  84           HN       PHE  84  -6.147  -3.614   2.581
  623    HA   PHE  84           HA       PHE  84  -5.948  -2.680   5.361
  624   1HB   PHE  84          HB2       PHE  84  -3.919  -2.220   3.634
  625   2HB   PHE  84          HB1       PHE  84  -4.947  -0.844   3.246
  626    HD1  PHE  84           HD1      PHE  84  -5.748   0.591   5.256
  627    HD2  PHE  84           HD2      PHE  84  -2.462  -2.109   5.414
  628    HE1  PHE  84           HE1      PHE  84  -4.865   1.783   7.220
  629    HE2  PHE  84           HE2      PHE  84  -1.575  -0.922   7.376
  630    HZ   PHE  84           HZ       PHE  84  -2.775   1.026   8.284
  631    H    TYR  85           HN       TYR  85  -8.066  -2.283   5.678
  632    HA   TYR  85           HA       TYR  85  -9.378  -0.474   3.793
  633   1HB   TYR  85          HB2       TYR  85 -11.349  -1.824   3.614
  634   2HB   TYR  85          HB1       TYR  85  -9.968  -2.822   3.185
  635    HD1  TYR  85           HD1      TYR  85 -12.916  -2.641   5.086
  636    HD2  TYR  85           HD2      TYR  85  -8.994  -4.281   5.139
  637    HE1  TYR  85           HE1      TYR  85 -13.662  -4.347   6.694
  638    HE2  TYR  85           HE2      TYR  85  -9.729  -5.994   6.749
  639    HH   TYR  85           HH       TYR  85 -13.064  -6.486   7.507
  640    H    LYS  86           HN       LYS  86 -11.103   0.691   4.638
  641    HA   LYS  86           HA       LYS  86 -10.829   1.175   7.468
  642   1HB   LYS  86          HB2       LYS  86 -12.301   3.110   7.026
  643   2HB   LYS  86          HB1       LYS  86 -10.881   3.079   5.993
  644   1HG   LYS  86          HG2       LYS  86 -12.414   1.970   4.258
  645   2HG   LYS  86          HG1       LYS  86 -13.736   2.547   5.276
  646   1HD   LYS  86          HD2       LYS  86 -12.484   4.824   5.145
  647   2HD   LYS  86          HD1       LYS  86 -11.709   4.114   3.729
  648   1HE   LYS  86          HE2       LYS  86 -13.619   5.402   3.039
  649   2HE   LYS  86          HE1       LYS  86 -13.955   3.689   2.765
  650   1HZ   LYS  86          HZ1       LYS  86 -14.833   5.186   5.172
  651   2HZ   LYS  86          HZ2       LYS  86 -15.309   3.629   4.697
  652   3HZ   LYS  86          HZ3       LYS  86 -15.799   4.976   3.794
  653    H    ASN  87           HN       ASN  87 -12.427   0.993   9.004
  654    HA   ASN  87           HA       ASN  87 -14.351  -1.063   8.637
  655   1HB   ASN  87          HB2       ASN  87 -13.291  -0.536  10.828
  656   2HB   ASN  87          HB1       ASN  87 -14.183   0.981  10.867
  657   1HD2  ASN  87          HD21      ASN  87 -16.365   0.966  11.322
  658   2HD2  ASN  87          HD22      ASN  87 -17.195  -0.443  11.905
  659    H    ASP  88           HN       ASP  88 -14.436   2.433   8.546
  660    HA   ASP  88           HA       ASP  88 -17.250   2.701   8.281
  661   1HB   ASP  88          HB2       ASP  88 -16.491   4.930   7.104
  662   2HB   ASP  88          HB1       ASP  88 -16.268   4.726   8.841
  663    H    VAL  89           HN       VAL  89 -18.534   2.761   6.482
  664    HA   VAL  89           HA       VAL  89 -17.258   1.752   4.038
  665    HB   VAL  89           HB       VAL  89 -19.534   1.130   3.286
  666   1HG1  VAL  89          HG11      VAL  89 -18.099  -0.492   4.405
  667   2HG1  VAL  89          HG12      VAL  89 -19.795  -0.773   4.798
  668   3HG1  VAL  89          HG13      VAL  89 -18.736   0.009   5.971
  669   1HG2  VAL  89          HG21      VAL  89 -20.364   1.976   6.066
  670   2HG2  VAL  89          HG22      VAL  89 -21.380   1.118   4.907
  671   3HG2  VAL  89          HG23      VAL  89 -20.834   2.759   4.557
  672    H    GLY  90           HN       GLY  90 -17.177   2.907   2.232
  673   1HA   GLY  90          HA2       GLY  90 -18.647   4.579   0.918
  674   2HA   GLY  90          HA1       GLY  90 -18.349   5.603   2.317
  675    H    SER  91           HN       SER  91 -17.419   7.024   0.617
  676    HA   SER  91           HA       SER  91 -14.844   6.202  -0.407
  677   1HB   SER  91          HB2       SER  91 -14.810   8.503  -1.379
  678   2HB   SER  91          HB1       SER  91 -16.243   7.584  -1.835
  679    HG   SER  91           HG       SER  91 -17.378   9.120  -0.990
  680    H    TRP  92           HN       TRP  92 -12.905   6.800   0.403
  681    HA   TRP  92           HA       TRP  92 -12.917   8.363   2.881
  682   1HB   TRP  92          HB2       TRP  92 -11.919   6.132   3.042
  683   2HB   TRP  92          HB1       TRP  92 -10.789   6.539   1.745
  684    HD1  TRP  92           HD1      TRP  92 -11.570   7.337   5.406
  685    HE1  TRP  92           HE1      TRP  92  -9.492   8.376   6.470
  686    HE3  TRP  92           HE3      TRP  92  -8.662   7.746   1.239
  687    HZ2  TRP  92           HZ2      TRP  92  -6.918   9.267   5.642
  688    HZ3  TRP  92           HZ3      TRP  92  -6.427   8.706   1.450
  689    HH2  TRP  92           HH2      TRP  92  -5.563   9.449   3.609
  690    H    GLY  93           HN       GLY  93 -10.897   7.854   0.043
  691   1HA   GLY  93          HA2       GLY  93  -9.551   9.233  -1.198
  692   2HA   GLY  93          HA1       GLY  93 -10.911  10.316  -1.120
  693    H    GLY  94           HN       GLY  94  -7.685   9.962  -0.523
  694   1HA   GLY  94          HA2       GLY  94  -7.306  12.585   0.366
  695   2HA   GLY  94          HA1       GLY  94  -7.271  11.539   1.780
  696    H    THR  95           HN       THR  95  -5.198  11.338   2.339
  697    HA   THR  95           HA       THR  95  -3.304  10.502   0.254
  698    HB   THR  95           HB       THR  95  -1.566  11.556   1.883
  699    HG1  THR  95           HG1      THR  95  -2.410  13.235   3.132
  700   1HG2  THR  95          HG21      THR  95  -1.764  13.717   0.752
  701   2HG2  THR  95          HG22      THR  95  -3.401  13.309   0.241
  702   3HG2  THR  95          HG23      THR  95  -2.029  12.390  -0.379
  703    H    ILE  96           HN       ILE  96  -2.302   8.623   0.582
  704    HA   ILE  96           HA       ILE  96  -2.405   7.429   3.284
  705    HB   ILE  96           HB       ILE  96  -1.907   5.914   0.724
  706   1HG1  ILE  96          HG12      ILE  96  -4.158   7.066   0.760
  707   2HG1  ILE  96          HG11      ILE  96  -4.214   5.312   0.614
  708   1HG2  ILE  96          HG21      ILE  96  -2.567   3.983   2.068
  709   2HG2  ILE  96          HG22      ILE  96  -2.754   5.041   3.468
  710   3HG2  ILE  96          HG23      ILE  96  -1.163   4.815   2.739
  711   1HD1  ILE  96          HD11      ILE  96  -5.907   6.107   2.141
  712   2HD1  ILE  96          HD12      ILE  96  -4.681   6.910   3.119
  713   3HD1  ILE  96          HD13      ILE  96  -4.707   5.149   3.005
  714    H    GLY  97           HN       GLY  97  -0.528   7.145   4.302
  715   1HA   GLY  97          HA2       GLY  97   1.904   7.888   2.843
  716   2HA   GLY  97          HA1       GLY  97   1.719   7.848   4.591
  717    H    ILE  98           HN       ILE  98   3.620   6.544   2.559
  718    HA   ILE  98           HA       ILE  98   3.254   3.759   3.308
  719    HB   ILE  98           HB       ILE  98   5.322   5.128   1.588
  720   1HG1  ILE  98          HG12      ILE  98   4.403   3.457  -0.110
  721   2HG1  ILE  98          HG11      ILE  98   3.112   3.152   1.045
  722   1HG2  ILE  98          HG21      ILE  98   5.238   2.215   2.360
  723   2HG2  ILE  98          HG22      ILE  98   6.454   3.390   2.862
  724   3HG2  ILE  98          HG23      ILE  98   6.316   2.933   1.164
  725   1HD1  ILE  98          HD11      ILE  98   3.740   5.810  -0.220
  726   2HD1  ILE  98          HD12      ILE  98   2.427   5.479   0.911
  727   3HD1  ILE  98          HD13      ILE  98   2.429   4.723  -0.683
  728    H    TYR  99           HN       TYR  99   3.813   3.228   5.272
  729    HA   TYR  99           HA       TYR  99   6.242   4.400   6.458
  730   1HB   TYR  99          HB2       TYR  99   4.030   2.897   7.883
  731   2HB   TYR  99          HB1       TYR  99   5.344   3.801   8.622
  732    HD1  TYR  99           HD1      TYR  99   5.111   6.097   9.094
  733    HD2  TYR  99           HD2      TYR  99   2.226   4.168   6.640
  734    HE1  TYR  99           HE1      TYR  99   3.666   8.076   9.248
  735    HE2  TYR  99           HE2      TYR  99   0.778   6.150   6.778
  736    HH   TYR  99           HH       TYR  99   1.862   9.135   8.007
  737    H    VAL 100           HN       VAL 100   7.871   2.973   7.157
  738    HA   VAL 100           HA       VAL 100   7.799   0.368   5.938
  739    HB   VAL 100           HB       VAL 100   9.889   1.757   6.094
  740   1HG1  VAL 100          HG11      VAL 100  11.175   1.695   8.161
  741   2HG1  VAL 100          HG12      VAL 100   9.836   0.887   8.976
  742   3HG1  VAL 100          HG13      VAL 100   9.643   2.538   8.382
  743   1HG2  VAL 100          HG21      VAL 100  11.367  -0.150   6.555
  744   2HG2  VAL 100          HG22      VAL 100   9.997  -0.599   5.538
  745   3HG2  VAL 100          HG23      VAL 100  10.002  -1.026   7.250
  746    H    ASP 101           HN       ASP 101   7.537  -1.594   6.942
  747    HA   ASP 101           HA       ASP 101   6.363  -1.586   9.569
  748   1HB   ASP 101          HB2       ASP 101   5.706  -3.168   7.713
  749   2HB   ASP 101          HB1       ASP 101   7.251  -3.980   7.951
  750    H    GLY 102           HN       GLY 102   7.925  -0.835  10.978
  751   1HA   GLY 102          HA2       GLY 102   9.721  -1.023  12.413
  752   2HA   GLY 102          HA1       GLY 102   9.985  -2.651  11.800
  753    H    GLN 103           HN       GLN 103  11.092   0.549  11.803
  754    HA   GLN 103           HA       GLN 103  12.305   0.967   9.410
  755   1HB   GLN 103          HB2       GLN 103  13.858   2.403  10.508
  756   2HB   GLN 103          HB1       GLN 103  12.324   2.511  11.351
  757   1HG   GLN 103          HG2       GLN 103  14.658   0.864  12.290
  758   2HG   GLN 103          HG1       GLN 103  14.299   2.499  12.837
  759   1HE2  GLN 103          HE21      GLN 103  13.448  -0.838  13.034
  760   2HE2  GLN 103          HE22      GLN 103  12.296  -0.686  14.318
  761    H    GLN 104           HN       GLN 104  13.777   0.017   8.217
  762    HA   GLN 104           HA       GLN 104  15.360  -2.159   9.308
  763   1HB   GLN 104          HB2       GLN 104  14.193  -2.323   7.100
  764   2HB   GLN 104          HB1       GLN 104  15.268  -1.078   6.484
  765   1HG   GLN 104          HG2       GLN 104  16.029  -3.258   5.789
  766   2HG   GLN 104          HG1       GLN 104  17.190  -2.537   6.902
  767   1HE2  GLN 104          HE21      GLN 104  18.066  -4.508   7.495
  768   2HE2  GLN 104          HE22      GLN 104  17.211  -5.650   8.477
  769    H    THR 105           HN       THR 105  15.667   1.058   9.320
  770    HA   THR 105           HA       THR 105  17.364   2.520   9.685
  771    HB   THR 105           HB       THR 105  19.177   0.135  10.087
  772    HG1  THR 105           HG1      THR 105  17.645  -0.450  11.477
  773   1HG2  THR 105          HG21      THR 105  20.230   2.347  10.226
  774   2HG2  THR 105          HG22      THR 105  20.178   1.572  11.811
  775   3HG2  THR 105          HG23      THR 105  19.027   2.849  11.414
  776    H    ASN 106           HN       ASN 106  16.914   1.334   6.981
  777    HA   ASN 106           HA       ASN 106  17.739   1.387   4.868
  778   1HB   ASN 106          HB2       ASN 106  18.150   3.717   5.273
  779   2HB   ASN 106          HB1       ASN 106  19.618   3.363   6.171
  780   1HD2  ASN 106          HD21      ASN 106  18.173   3.621   3.030
  781   2HD2  ASN 106          HD22      ASN 106  19.640   3.580   2.124
  782    H    THR 107           HN       THR 107  18.392  -0.728   4.705
  783    HA   THR 107           HA       THR 107  21.236  -1.288   5.160
  784    HB   THR 107           HB       THR 107  19.496  -2.882   6.096
  785    HG1  THR 107           HG1      THR 107  20.982  -4.348   5.900
  786   1HG2  THR 107          HG21      THR 107  18.411  -4.440   4.548
  787   2HG2  THR 107          HG22      THR 107  19.049  -3.524   3.182
  788   3HG2  THR 107          HG23      THR 107  17.881  -2.780   4.275
  789    HA   PRO 108           HA       PRO 108  22.823  -0.693   1.131
  790   1HB   PRO 108          HB2       PRO 108  22.759  -3.675   0.873
  791   2HB   PRO 108          HB1       PRO 108  24.041  -2.541   0.438
  792   1HG   PRO 108          HG2       PRO 108  23.954  -3.969   2.795
  793   2HG   PRO 108          HG1       PRO 108  24.858  -2.467   2.558
  794   1HD   PRO 108          HD2       PRO 108  22.610  -2.908   4.272
  795   2HD   PRO 108          HD1       PRO 108  23.470  -1.383   3.981
  796    HA   PRO 109           HA       PRO 109  18.839  -1.470  -0.903
  797   1HB   PRO 109          HB2       PRO 109  17.960   1.055  -0.893
  798   2HB   PRO 109          HB1       PRO 109  17.980   0.071   0.574
  799   1HG   PRO 109          HG2       PRO 109  19.655   2.372  -0.144
  800   2HG   PRO 109          HG1       PRO 109  19.360   1.653   1.445
  801   1HD   PRO 109          HD2       PRO 109  21.605   1.225  -0.369
  802   2HD   PRO 109          HD1       PRO 109  21.412   0.710   1.323
  803    H    GLY 110           HN       GLY 110  17.665   0.119  -2.571
  804   1HA   GLY 110          HA2       GLY 110  19.197   1.553  -4.449
  805   2HA   GLY 110          HA1       GLY 110  18.925  -0.088  -5.033
  806    H    ASN 111           HN       ASN 111  17.250  -0.170  -6.378
  807    HA   ASN 111           HA       ASN 111  14.982   1.620  -5.982
  808   1HB   ASN 111          HB2       ASN 111  15.818   1.329  -8.265
  809   2HB   ASN 111          HB1       ASN 111  15.554  -0.407  -8.158
  810   1HD2  ASN 111          HD21      ASN 111  14.169  -0.414  -9.921
  811   2HD2  ASN 111          HD22      ASN 111  12.552   0.207  -9.819
  812    H    TYR 112           HN       TYR 112  13.284   1.035  -4.816
  813    HA   TYR 112           HA       TYR 112  12.649  -1.829  -4.601
  814   1HB   TYR 112          HB2       TYR 112  12.166   0.383  -2.589
  815   2HB   TYR 112          HB1       TYR 112  11.465  -1.227  -2.471
  816    HD1  TYR 112           HD1      TYR 112  12.967  -3.210  -2.226
  817    HD2  TYR 112           HD2      TYR 112  14.416   0.774  -1.884
  818    HE1  TYR 112           HE1      TYR 112  15.002  -4.040  -1.132
  819    HE2  TYR 112           HE2      TYR 112  16.451  -0.052  -0.811
  820    HH   TYR 112           HH       TYR 112  17.248  -3.397  -0.686
  821    H    THR 113           HN       THR 113  10.835  -2.449  -5.464
  822    HA   THR 113           HA       THR 113   8.996  -0.388  -6.431
  823    HB   THR 113           HB       THR 113   9.133  -3.296  -7.230
  824    HG1  THR 113           HG1      THR 113  11.031  -1.688  -7.610
  825   1HG2  THR 113          HG21      THR 113   7.030  -2.143  -7.778
  826   2HG2  THR 113          HG22      THR 113   7.951  -2.542  -9.228
  827   3HG2  THR 113          HG23      THR 113   7.945  -0.889  -8.617
  828    H    LEU 114           HN       LEU 114   6.898  -0.338  -5.821
  829    HA   LEU 114           HA       LEU 114   5.743  -2.665  -4.514
  830   1HB   LEU 114          HB2       LEU 114   4.591  -0.870  -2.937
  831   2HB   LEU 114          HB1       LEU 114   6.090  -1.664  -2.511
  832    HG   LEU 114           HG       LEU 114   6.200   0.968  -3.922
  833   1HD1  LEU 114          HD11      LEU 114   4.604   1.328  -2.116
  834   2HD1  LEU 114          HD12      LEU 114   6.144   2.104  -1.742
  835   3HD1  LEU 114          HD13      LEU 114   5.715   0.578  -0.970
  836   1HD2  LEU 114          HD21      LEU 114   8.238   1.209  -2.615
  837   2HD2  LEU 114          HD22      LEU 114   8.258  -0.283  -3.554
  838   3HD2  LEU 114          HD23      LEU 114   7.919  -0.336  -1.824
  839    H    THR 115           HN       THR 115   4.469  -3.055  -6.236
  840    HA   THR 115           HA       THR 115   2.937  -0.922  -7.462
  841    HB   THR 115           HB       THR 115   2.951  -3.877  -8.119
  842    HG1  THR 115           HG1      THR 115   4.947  -3.323  -8.706
  843   1HG2  THR 115          HG21      THR 115   2.028  -1.476  -9.712
  844   2HG2  THR 115          HG22      THR 115   0.984  -2.691  -8.971
  845   3HG2  THR 115          HG23      THR 115   2.065  -3.143 -10.289
  846    H    LEU 116           HN       LEU 116   1.032  -0.346  -6.706
  847    HA   LEU 116           HA       LEU 116  -0.471  -2.234  -5.043
  848   1HB   LEU 116          HB2       LEU 116  -0.734   0.741  -5.411
  849   2HB   LEU 116          HB1       LEU 116  -1.736  -0.219  -4.341
  850    HG   LEU 116           HG       LEU 116   1.243   0.202  -4.073
  851   1HD1  LEU 116          HD11      LEU 116   0.665   1.488  -2.092
  852   2HD1  LEU 116          HD12      LEU 116  -1.051   1.223  -2.406
  853   3HD1  LEU 116          HD13      LEU 116  -0.089   2.183  -3.529
  854   1HD2  LEU 116          HD21      LEU 116   1.053  -1.005  -1.980
  855   2HD2  LEU 116          HD22      LEU 116   0.508  -2.023  -3.313
  856   3HD2  LEU 116          HD23      LEU 116  -0.672  -1.251  -2.251
  857    H    THR 117           HN       THR 117  -2.513  -2.857  -5.529
  858    HA   THR 117           HA       THR 117  -3.532  -2.068  -8.174
  859    HB   THR 117           HB       THR 117  -4.283  -4.518  -6.560
  860    HG1  THR 117           HG1      THR 117  -2.016  -4.078  -7.765
  861   1HG2  THR 117          HG21      THR 117  -5.196  -5.313  -8.700
  862   2HG2  THR 117          HG22      THR 117  -4.764  -3.776  -9.450
  863   3HG2  THR 117          HG23      THR 117  -5.980  -3.822  -8.173
  864    H    GLY 118           HN       GLY 118  -4.999  -0.506  -7.988
  865   1HA   GLY 118          HA2       GLY 118  -6.422   0.060  -5.598
  866   2HA   GLY 118          HA1       GLY 118  -6.734   0.767  -7.178
  867    H    GLY 119           HN       GLY 119  -8.278  -0.723  -4.838
  868   1HA   GLY 119          HA2       GLY 119 -10.391  -1.614  -6.523
  869   2HA   GLY 119          HA1       GLY 119  -9.516  -2.972  -5.828
  870    H    TYR 120           HN       TYR 120 -12.137  -2.686  -5.234
  871    HA   TYR 120           HA       TYR 120 -12.157  -1.481  -2.563
  872   1HB   TYR 120          HB2       TYR 120 -14.576  -1.536  -2.652
  873   2HB   TYR 120          HB1       TYR 120 -13.960  -0.746  -4.096
  874    HD1  TYR 120           HD1      TYR 120 -15.601  -3.751  -2.778
  875    HD2  TYR 120           HD2      TYR 120 -14.288  -1.723  -6.293
  876    HE1  TYR 120           HE1      TYR 120 -16.913  -5.303  -4.159
  877    HE2  TYR 120           HE2      TYR 120 -15.602  -3.273  -7.674
  878    HH   TYR 120           HH       TYR 120 -16.506  -5.598  -7.487
  879    H    TRP 121           HN       TRP 121 -13.311  -2.658  -0.894
  880    HA   TRP 121           HA       TRP 121 -12.876  -5.563  -1.137
  881   1HB   TRP 121          HB2       TRP 121 -11.187  -4.797   0.316
  882   2HB   TRP 121          HB1       TRP 121 -12.242  -3.619   1.079
  883    HD1  TRP 121           HD1      TRP 121 -14.206  -4.712   2.670
  884    HE1  TRP 121           HE1      TRP 121 -14.071  -6.713   4.261
  885    HE3  TRP 121           HE3      TRP 121 -10.058  -6.967   0.758
  886    HZ2  TRP 121           HZ2      TRP 121 -12.423  -8.927   4.670
  887    HZ3  TRP 121           HZ3      TRP 121  -9.266  -9.045   1.851
  888    HH2  TRP 121           HH2      TRP 121 -10.424  -9.992   3.748
  889    H    ALA 122           HN       ALA 122 -14.339  -6.894  -0.021
  890    HA   ALA 122           HA       ALA 122 -16.745  -5.642   1.078
  891   1HB   ALA 122          HB1       ALA 122 -18.163  -7.261  -0.050
  892   2HB   ALA 122          HB2       ALA 122 -16.751  -7.983  -0.824
  893   3HB   ALA 122          HB3       ALA 122 -17.234  -6.336  -1.228
  894    H    LYS 123           HN       LYS 123 -17.418  -6.561   2.914
  895    HA   LYS 123           HA       LYS 123 -17.913  -8.088   4.524
  896   1HB   LYS 123          HB2       LYS 123 -16.195 -10.001   2.949
  897   2HB   LYS 123          HB1       LYS 123 -17.111 -10.422   4.390
  898   1HG   LYS 123          HG2       LYS 123 -18.247  -9.465   1.769
  899   2HG   LYS 123          HG1       LYS 123 -18.306 -11.112   2.401
  900   1HD   LYS 123          HD2       LYS 123 -19.696 -10.384   4.246
  901   2HD   LYS 123          HD1       LYS 123 -19.564  -8.705   3.719
  902   1HE   LYS 123          HE2       LYS 123 -20.695  -9.284   1.621
  903   2HE   LYS 123          HE1       LYS 123 -20.836 -10.955   2.163
  904   1HZ   LYS 123          HZ1       LYS 123 -22.881  -9.689   2.515
  905   2HZ   LYS 123          HZ2       LYS 123 -22.050  -8.613   3.524
  906   3HZ   LYS 123          HZ3       LYS 123 -22.225 -10.237   3.982
  907    H    ASP 124           HN       ASP 124 -15.727 -10.064   5.446
  908    HA   ASP 124           HA       ASP 124 -13.693  -8.150   6.249
  909   1HB   ASP 124          HB2       ASP 124 -14.004  -8.454   8.633
  910   2HB   ASP 124          HB1       ASP 124 -15.492  -7.853   7.913
  911    H    ASN 125           HN       ASN 125 -11.862  -9.048   5.919
  912    HA   ASN 125           HA       ASN 125 -10.041 -10.343   6.091
  913   1HB   ASN 125          HB2       ASN 125 -10.525 -10.340   8.437
  914   2HB   ASN 125          HB1       ASN 125 -11.626 -11.699   8.256
  915   1HD2  ASN 125          HD21      ASN 125  -8.301 -10.682   8.307
  916   2HD2  ASN 125          HD22      ASN 125  -7.612 -12.261   8.464
  917    H    LYS 126           HN       LYS 126 -13.013 -11.894   5.377
  918    HA   LYS 126           HA       LYS 126 -12.038 -14.475   4.766
  919   1HB   LYS 126          HB2       LYS 126 -14.173 -14.810   3.666
  920   2HB   LYS 126          HB1       LYS 126 -14.403 -13.972   5.191
  921   1HG   LYS 126          HG2       LYS 126 -15.738 -12.648   3.975
  922   2HG   LYS 126          HG1       LYS 126 -14.225 -11.872   3.499
  923   1HD   LYS 126          HD2       LYS 126 -14.123 -13.180   1.486
  924   2HD   LYS 126          HD1       LYS 126 -15.513 -14.144   1.990
  925   1HE   LYS 126          HE2       LYS 126 -16.874 -12.058   1.967
  926   2HE   LYS 126          HE1       LYS 126 -15.484 -11.216   1.284
  927   1HZ   LYS 126          HZ1       LYS 126 -15.564 -12.721  -0.619
  928   2HZ   LYS 126          HZ2       LYS 126 -17.043 -11.911  -0.430
  929   3HZ   LYS 126          HZ3       LYS 126 -16.898 -13.527   0.051
  930    H    GLN 127           HN       GLN 127 -11.273 -11.656   3.381
  931    HA   GLN 127           HA       GLN 127 -10.206 -11.013   1.513
  932   1HB   GLN 127          HB2       GLN 127  -8.950 -13.097   1.582
  933   2HB   GLN 127          HB1       GLN 127 -10.262 -13.943   0.774
  934   1HG   GLN 127          HG2       GLN 127  -9.932 -12.580  -1.218
  935   2HG   GLN 127          HG1       GLN 127  -8.628 -11.709  -0.413
  936   1HE2  GLN 127          HE21      GLN 127  -7.160 -12.344  -2.020
  937   2HE2  GLN 127          HE22      GLN 127  -6.532 -13.948  -2.100
  938    H    GLY 128           HN       GLY 128 -12.525 -10.125   1.387
  939   1HA   GLY 128          HA2       GLY 128 -13.506 -10.869  -1.290
  940   2HA   GLY 128          HA1       GLY 128 -14.442  -9.996  -0.069
  941    H    PHE 129           HN       PHE 129 -12.073  -9.691  -2.609
  942    HA   PHE 129           HA       PHE 129 -12.570  -6.828  -2.457
  943   1HB   PHE 129          HB2       PHE 129 -10.208  -6.240  -2.786
  944   2HB   PHE 129          HB1       PHE 129 -10.461  -7.073  -1.260
  945    HD1  PHE 129           HD1      PHE 129  -9.338  -9.084  -0.766
  946    HD2  PHE 129           HD2      PHE 129  -9.148  -7.449  -4.691
  947    HE1  PHE 129           HE1      PHE 129  -7.523 -10.645  -1.328
  948    HE2  PHE 129           HE2      PHE 129  -7.340  -9.015  -5.261
  949    HZ   PHE 129           HZ       PHE 129  -6.523 -10.615  -3.576
  950    H    THR 130           HN       THR 130 -12.480  -5.787  -4.442
  951    HA   THR 130           HA       THR 130 -11.866  -7.445  -6.792
  952    HB   THR 130           HB       THR 130 -14.255  -5.596  -6.593
  953    HG1  THR 130           HG1      THR 130 -15.406  -7.688  -6.736
  954   1HG2  THR 130          HG21      THR 130 -13.373  -5.790  -8.856
  955   2HG2  THR 130          HG22      THR 130 -14.913  -6.641  -8.726
  956   3HG2  THR 130          HG23      THR 130 -13.400  -7.549  -8.735
  957    HA   PRO 131           HA       PRO 131  -9.285  -3.839  -7.468
  958   1HB   PRO 131          HB2       PRO 131  -8.849  -5.144 -10.083
  959   2HB   PRO 131          HB1       PRO 131  -7.673  -4.652  -8.858
  960   1HG   PRO 131          HG2       PRO 131  -8.267  -7.230  -9.257
  961   2HG   PRO 131          HG1       PRO 131  -7.928  -6.594  -7.637
  962   1HD   PRO 131          HD2       PRO 131 -10.556  -7.258  -8.906
  963   2HD   PRO 131          HD1       PRO 131 -10.010  -7.529  -7.238
  964    H    SER 132           HN       SER 132  -9.985  -1.945  -8.123
  965    HA   SER 132           HA       SER 132 -11.281  -1.589 -10.676
  966   1HB   SER 132          HB2       SER 132 -13.084  -2.171  -8.925
  967   2HB   SER 132          HB1       SER 132 -12.725  -0.589  -8.239
  968    HG   SER 132           HG       SER 132 -13.802   0.318  -9.797
  969    H    GLY 133           HN       GLY 133  -9.678  -0.243 -11.300
  970   1HA   GLY 133          HA2       GLY 133  -9.580   2.414 -10.827
  971   2HA   GLY 133          HA1       GLY 133  -8.586   1.755  -9.532
  972    H    THR 134           HN       THR 134  -6.467   1.543  -9.977
  973    HA   THR 134           HA       THR 134  -5.686   0.758 -12.682
  974    HB   THR 134           HB       THR 134  -3.725   2.538 -12.216
  975    HG1  THR 134           HG1      THR 134  -4.313   3.909 -10.721
  976   1HG2  THR 134          HG21      THR 134  -5.027   2.400 -14.270
  977   2HG2  THR 134          HG22      THR 134  -4.902   4.077 -13.734
  978   3HG2  THR 134          HG23      THR 134  -6.397   3.176 -13.474
  979    H    THR 135           HN       THR 135  -3.287   0.220 -12.743
  980    HA   THR 135           HA       THR 135  -2.443  -0.975 -10.221
  981    HB   THR 135           HB       THR 135  -0.574  -1.429 -12.325
  982    HG1  THR 135           HG1      THR 135  -1.866  -1.361 -14.003
  983   1HG2  THR 135          HG21      THR 135  -1.215  -3.771 -11.987
  984   2HG2  THR 135          HG22      THR 135  -2.636  -3.253 -11.078
  985   3HG2  THR 135          HG23      THR 135  -1.020  -2.939 -10.443
  986    H    GLY 136           HN       GLY 136  -1.597   0.666  -9.012
  987   1HA   GLY 136          HA2       GLY 136   0.139   2.627 -10.337
  988   2HA   GLY 136          HA1       GLY 136  -0.610   2.816  -8.759
  989    H    THR 137           HN       THR 137   2.236   2.186 -10.341
  990    HA   THR 137           HA       THR 137   3.348   0.520  -8.236
  991    HB   THR 137           HB       THR 137   4.607   1.669 -10.735
  992    HG1  THR 137           HG1      THR 137   3.963  -1.037 -10.067
  993   1HG2  THR 137          HG21      THR 137   6.290   1.398  -8.983
  994   2HG2  THR 137          HG22      THR 137   6.504   0.193 -10.251
  995   3HG2  THR 137          HG23      THR 137   5.759  -0.264  -8.720
  996    H    THR 138           HN       THR 138   3.688   1.599  -6.388
  997    HA   THR 138           HA       THR 138   4.788   4.263  -6.345
  998    HB   THR 138           HB       THR 138   4.696   2.298  -4.045
  999    HG1  THR 138           HG1      THR 138   2.641   3.454  -5.417
 1000   1HG2  THR 138          HG21      THR 138   4.580   5.318  -4.130
 1001   2HG2  THR 138          HG22      THR 138   6.000   4.360  -3.705
 1002   3HG2  THR 138          HG23      THR 138   4.564   4.314  -2.680
 1003    H    LYS 139           HN       LYS 139   6.907   4.693  -6.609
 1004    HA   LYS 139           HA       LYS 139   8.730   2.384  -6.454
 1005   1HB   LYS 139          HB2       LYS 139   8.329   3.331  -8.724
 1006   2HB   LYS 139          HB1       LYS 139   9.007   4.855  -8.170
 1007   1HG   LYS 139          HG2       LYS 139  11.154   3.824  -7.801
 1008   2HG   LYS 139          HG1       LYS 139  10.498   2.240  -8.217
 1009   1HD   LYS 139          HD2       LYS 139  10.645   4.619 -10.066
 1010   2HD   LYS 139          HD1       LYS 139  11.743   3.238 -10.083
 1011   1HE   LYS 139          HE2       LYS 139   9.938   1.753 -10.672
 1012   2HE   LYS 139          HE1       LYS 139   8.761   3.054 -10.506
 1013   1HZ   LYS 139          HZ1       LYS 139  10.941   2.916 -12.521
 1014   2HZ   LYS 139          HZ2       LYS 139   9.854   4.205 -12.339
 1015   3HZ   LYS 139          HZ3       LYS 139   9.284   2.685 -12.818
 1016    H    LEU 140           HN       LEU 140   9.816   2.435  -4.682
 1017    HA   LEU 140           HA       LEU 140  10.769   4.978  -3.606
 1018   1HB   LEU 140          HB2       LEU 140   9.753   3.840  -1.876
 1019   2HB   LEU 140          HB1       LEU 140  10.245   2.269  -2.466
 1020    HG   LEU 140           HG       LEU 140  12.540   2.708  -1.689
 1021   1HD1  LEU 140          HD11      LEU 140  12.552   5.142  -1.858
 1022   2HD1  LEU 140          HD12      LEU 140  12.979   4.629  -0.225
 1023   3HD1  LEU 140          HD13      LEU 140  11.364   5.249  -0.559
 1024   1HD2  LEU 140          HD21      LEU 140  12.097   2.523   0.696
 1025   2HD2  LEU 140          HD22      LEU 140  10.957   1.552  -0.236
 1026   3HD2  LEU 140          HD23      LEU 140  10.448   3.098   0.443
 1027    H    THR 141           HN       THR 141  12.559   5.521  -4.675
 1028    HA   THR 141           HA       THR 141  14.668   3.495  -4.990
 1029    HB   THR 141           HB       THR 141  14.426   6.159  -6.409
 1030    HG1  THR 141           HG1      THR 141  13.216   3.759  -6.853
 1031   1HG2  THR 141          HG21      THR 141  16.726   5.342  -6.242
 1032   2HG2  THR 141          HG22      THR 141  16.143   5.227  -7.903
 1033   3HG2  THR 141          HG23      THR 141  16.230   3.781  -6.896
 1034    H    VAL 142           HN       VAL 142  16.290   3.619  -3.599
 1035    HA   VAL 142           HA       VAL 142  16.375   5.816  -1.739
 1036    HB   VAL 142           HB       VAL 142  18.175   3.414  -1.941
 1037   1HG1  VAL 142          HG11      VAL 142  19.245   5.184  -0.705
 1038   2HG1  VAL 142          HG12      VAL 142  18.726   3.919   0.409
 1039   3HG1  VAL 142          HG13      VAL 142  17.798   5.411   0.276
 1040   1HG2  VAL 142          HG21      VAL 142  15.858   2.771  -1.584
 1041   2HG2  VAL 142          HG22      VAL 142  15.745   3.890  -0.226
 1042   3HG2  VAL 142          HG23      VAL 142  16.809   2.489  -0.126
 1043    H    THR 143           HN       THR 143  17.270   7.647  -2.377
 1044    HA   THR 143           HA       THR 143  20.080   7.643  -3.055
 1045    HB   THR 143           HB       THR 143  18.077   9.005  -4.879
 1046    HG1  THR 143           HG1      THR 143  19.046   6.507  -4.885
 1047   1HG2  THR 143          HG21      THR 143  21.093   8.844  -5.016
 1048   2HG2  THR 143          HG22      THR 143  20.148  10.285  -4.635
 1049   3HG2  THR 143          HG23      THR 143  20.048   9.563  -6.241
  Start of MODEL   10
    1    H    GLU   1           H        GLU   1 -22.591  -1.001  -5.098
    2    HA   GLU   1           HA       GLU   1 -21.133   0.830  -5.474
    3   1HB   GLU   1          HB2       GLU   1 -19.891  -1.426  -3.890
    4   2HB   GLU   1          HB1       GLU   1 -19.294   0.228  -3.857
    5   1HG   GLU   1          HG2       GLU   1 -22.060  -0.635  -3.056
    6   2HG   GLU   1          HG1       GLU   1 -20.732  -0.300  -1.945
    7    H    GLU   2           HN       GLU   2 -20.188   1.363  -7.369
    8    HA   GLU   2           HA       GLU   2 -17.936  -0.233  -8.344
    9   1HB   GLU   2          HB2       GLU   2 -19.565   0.660 -10.012
   10   2HB   GLU   2          HB1       GLU   2 -19.127   2.285  -9.505
   11   1HG   GLU   2          HG2       GLU   2 -16.771   1.770 -10.168
   12   2HG   GLU   2          HG1       GLU   2 -17.372   0.271 -10.873
   13    H    CYS   3           HN       CYS   3 -16.259   0.146  -7.020
   14    HA   CYS   3           HA       CYS   3 -15.719   2.937  -6.295
   15   1HB   CYS   3          HB2       CYS   3 -16.103   1.166  -4.484
   16   2HB   CYS   3          HB1       CYS   3 -14.513   0.554  -4.917
   17    H    GLN   4           HN       GLN   4 -14.515   3.676  -7.875
   18    HA   GLN   4           HA       GLN   4 -12.310   2.131  -8.942
   19   1HB   GLN   4          HB2       GLN   4 -13.656   3.411 -10.480
   20   2HB   GLN   4          HB1       GLN   4 -13.408   4.877  -9.545
   21   1HG   GLN   4          HG2       GLN   4 -11.051   4.876 -10.129
   22   2HG   GLN   4          HG1       GLN   4 -11.262   3.368 -11.021
   23   1HE2  GLN   4          HE21      GLN   4 -10.545   4.329 -12.924
   24   2HE2  GLN   4          HE22      GLN   4 -11.527   5.434 -13.826
   25    H    VAL   5           HN       VAL   5 -10.528   2.046  -7.768
   26    HA   VAL   5           HA       VAL   5  -9.755   4.394  -6.180
   27    HB   VAL   5           HB       VAL   5  -8.821   1.520  -5.997
   28   1HG1  VAL   5          HG11      VAL   5  -7.652   2.224  -3.956
   29   2HG1  VAL   5          HG12      VAL   5  -8.092   3.899  -4.290
   30   3HG1  VAL   5          HG13      VAL   5  -7.018   3.031  -5.389
   31   1HG2  VAL   5          HG21      VAL   5 -10.557   3.171  -4.163
   32   2HG2  VAL   5          HG22      VAL   5  -9.995   1.531  -3.839
   33   3HG2  VAL   5          HG23      VAL   5 -11.091   1.836  -5.186
   34    H    ARG   6           HN       ARG   6  -8.400   5.699  -7.180
   35    HA   ARG   6           HA       ARG   6  -6.549   4.640  -9.167
   36   1HB   ARG   6          HB2       ARG   6  -7.053   7.502  -8.341
   37   2HB   ARG   6          HB1       ARG   6  -6.081   6.976  -9.706
   38   1HG   ARG   6          HG2       ARG   6  -8.068   6.042 -10.769
   39   2HG   ARG   6          HG1       ARG   6  -9.047   6.564  -9.397
   40   1HD   ARG   6          HD2       ARG   6  -7.470   8.367 -11.230
   41   2HD   ARG   6          HD1       ARG   6  -9.215   8.127 -11.276
   42    HE   ARG   6           HE       ARG   6  -8.019   9.130  -8.796
   43   1HH1  ARG   6          HH11      ARG   6  -9.884   9.747 -11.697
   44   2HH1  ARG   6          HH12      ARG   6 -10.560  11.234 -11.093
   45   1HH2  ARG   6          HH21      ARG   6  -8.844  11.115  -8.031
   46   2HH2  ARG   6          HH22      ARG   6  -9.951  12.018  -9.020
   47    H    VAL   7           HN       VAL   7  -4.712   3.861  -8.365
   48    HA   VAL   7           HA       VAL   7  -3.494   5.074  -6.023
   49    HB   VAL   7           HB       VAL   7  -2.520   2.774  -7.732
   50   1HG1  VAL   7          HG11      VAL   7  -1.043   2.274  -5.836
   51   2HG1  VAL   7          HG12      VAL   7  -1.616   3.724  -5.012
   52   3HG1  VAL   7          HG13      VAL   7  -0.710   3.865  -6.518
   53   1HG2  VAL   7          HG21      VAL   7  -4.622   2.206  -6.682
   54   2HG2  VAL   7          HG22      VAL   7  -4.026   2.765  -5.119
   55   3HG2  VAL   7          HG23      VAL   7  -3.308   1.345  -5.879
   56    H    GLY   8           HN       GLY   8  -2.259   6.799  -6.270
   57   1HA   GLY   8          HA2       GLY   8  -1.453   7.792  -8.786
   58   2HA   GLY   8          HA1       GLY   8  -0.935   8.404  -7.223
   59    H    ASP   9           HN       ASP   9   0.022   6.873 -10.024
   60    HA   ASP   9           HA       ASP   9   2.256   5.397  -9.019
   61   1HB   ASP   9          HB2       ASP   9   1.164   5.036 -11.248
   62   2HB   ASP   9          HB1       ASP   9   1.866   6.555 -11.788
   63    H    LEU  10           HN       LEU  10   3.790   6.420  -7.916
   64    HA   LEU  10           HA       LEU  10   4.919   8.874  -9.026
   65   1HB   LEU  10          HB2       LEU  10   5.004   9.825  -6.695
   66   2HB   LEU  10          HB1       LEU  10   3.419   9.756  -7.436
   67    HG   LEU  10           HG       LEU  10   3.159   7.529  -6.119
   68   1HD1  LEU  10          HD11      LEU  10   5.334   8.869  -4.516
   69   2HD1  LEU  10          HD12      LEU  10   5.463   7.330  -5.368
   70   3HD1  LEU  10          HD13      LEU  10   4.369   7.488  -3.994
   71   1HD2  LEU  10          HD21      LEU  10   3.148  10.190  -4.705
   72   2HD2  LEU  10          HD22      LEU  10   2.263   8.745  -4.217
   73   3HD2  LEU  10          HD23      LEU  10   1.860   9.556  -5.727
   74    H    THR  11           HN       THR  11   7.041   9.358  -8.307
   75    HA   THR  11           HA       THR  11   8.455   7.027  -7.200
   76    HB   THR  11           HB       THR  11   9.484   9.017  -9.234
   77    HG1  THR  11           HG1      THR  11   7.945   6.912  -9.580
   78   1HG2  THR  11          HG21      THR  11  10.763   6.538  -8.075
   79   2HG2  THR  11          HG22      THR  11  11.269   8.204  -7.789
   80   3HG2  THR  11          HG23      THR  11  11.417   7.499  -9.399
   81    H    VAL  12           HN       VAL  12   9.452   7.395  -5.338
   82    HA   VAL  12           HA       VAL  12  10.145  10.175  -4.643
   83    HB   VAL  12           HB       VAL  12   8.215   9.328  -3.330
   84   1HG1  VAL  12          HG11      VAL  12  10.168   7.281  -2.299
   85   2HG1  VAL  12          HG12      VAL  12   8.734   6.968  -3.278
   86   3HG1  VAL  12          HG13      VAL  12   8.563   7.588  -1.635
   87   1HG2  VAL  12          HG21      VAL  12   9.101   9.894  -1.102
   88   2HG2  VAL  12          HG22      VAL  12   9.642  11.017  -2.350
   89   3HG2  VAL  12          HG23      VAL  12  10.739   9.776  -1.744
   90    H    ALA  13           HN       ALA  13  12.159  10.509  -3.714
   91    HA   ALA  13           HA       ALA  13  13.912   8.147  -3.680
   92   1HB   ALA  13          HB1       ALA  13  15.773   9.671  -4.068
   93   2HB   ALA  13          HB2       ALA  13  14.666  11.043  -4.042
   94   3HB   ALA  13          HB3       ALA  13  14.546   9.838  -5.324
   95    H    LYS  14           HN       LYS  14  13.854   7.412  -1.627
   96    HA   LYS  14           HA       LYS  14  14.900   9.196   0.445
   97   1HB   LYS  14          HB2       LYS  14  12.454   7.473   0.903
   98   2HB   LYS  14          HB1       LYS  14  13.269   8.451   2.107
   99   1HG   LYS  14          HG2       LYS  14  11.907   9.561  -0.336
  100   2HG   LYS  14          HG1       LYS  14  11.161   9.430   1.256
  101   1HD   LYS  14          HD2       LYS  14  12.983  10.853   2.165
  102   2HD   LYS  14          HD1       LYS  14  13.592  11.058   0.521
  103   1HE   LYS  14          HE2       LYS  14  11.457  12.050  -0.140
  104   2HE   LYS  14          HE1       LYS  14  10.852  11.851   1.504
  105   1HZ   LYS  14          HZ1       LYS  14  13.034  13.627   0.572
  106   2HZ   LYS  14          HZ2       LYS  14  12.778  13.277   2.209
  107   3HZ   LYS  14          HZ3       LYS  14  11.571  14.068   1.317
  108    H    THR  15           HN       THR  15  15.385   7.915   2.453
  109    HA   THR  15           HA       THR  15  16.378   5.240   1.789
  110    HB   THR  15           HB       THR  15  17.500   5.643   4.152
  111    HG1  THR  15           HG1      THR  15  17.475   8.325   3.245
  112   1HG2  THR  15          HG21      THR  15  18.445   7.014   1.630
  113   2HG2  THR  15          HG22      THR  15  18.726   5.325   2.061
  114   3HG2  THR  15          HG23      THR  15  19.452   6.613   3.022
  115    H    ARG  16           HN       ARG  16  16.031   3.526   3.370
  116    HA   ARG  16           HA       ARG  16  13.323   3.717   4.403
  117   1HB   ARG  16          HB2       ARG  16  15.158   1.313   4.338
  118   2HB   ARG  16          HB1       ARG  16  13.436   1.299   4.695
  119   1HG   ARG  16          HG2       ARG  16  13.293   0.722   2.513
  120   2HG   ARG  16          HG1       ARG  16  13.372   2.474   2.290
  121   1HD   ARG  16          HD2       ARG  16  15.088   1.991   0.901
  122   2HD   ARG  16          HD1       ARG  16  16.007   1.860   2.399
  123    HE   ARG  16           HE       ARG  16  14.893  -0.385   0.860
  124   1HH1  ARG  16          HH11      ARG  16  17.143   0.908   3.201
  125   2HH1  ARG  16          HH12      ARG  16  18.031  -0.577   3.362
  126   1HH2  ARG  16          HH21      ARG  16  16.044  -2.374   1.113
  127   2HH2  ARG  16          HH22      ARG  16  17.414  -2.425   2.187
  128    H    GLY  17           HN       GLY  17  16.289   4.426   5.579
  129   1HA   GLY  17          HA2       GLY  17  15.920   3.394   8.261
  130   2HA   GLY  17          HA1       GLY  17  17.239   4.414   7.703
  131    H    GLN  18           HN       GLN  18  15.262   6.326   6.507
  132    HA   GLN  18           HA       GLN  18  14.971   7.944   8.870
  133   1HB   GLN  18          HB2       GLN  18  14.248   9.709   7.382
  134   2HB   GLN  18          HB1       GLN  18  15.689   8.940   6.734
  135   1HG   GLN  18          HG2       GLN  18  14.368   7.723   5.124
  136   2HG   GLN  18          HG1       GLN  18  12.884   8.345   5.844
  137   1HE2  GLN  18          HE21      GLN  18  15.733   9.160   3.997
  138   2HE2  GLN  18          HE22      GLN  18  15.119  10.637   3.335
  139    H    LEU  19           HN       LEU  19  13.177   5.526   7.655
  140    HA   LEU  19           HA       LEU  19  10.566   6.665   7.790
  141   1HB   LEU  19          HB2       LEU  19  11.393   3.768   7.746
  142   2HB   LEU  19          HB1       LEU  19   9.765   4.376   7.487
  143    HG   LEU  19           HG       LEU  19  12.155   4.820   5.694
  144   1HD1  LEU  19          HD11      LEU  19  11.187   2.591   5.523
  145   2HD1  LEU  19          HD12      LEU  19  10.861   3.536   4.071
  146   3HD1  LEU  19          HD13      LEU  19   9.590   3.295   5.268
  147   1HD2  LEU  19          HD21      LEU  19  10.609   5.991   4.217
  148   2HD2  LEU  19          HD22      LEU  19  10.754   6.810   5.772
  149   3HD2  LEU  19          HD23      LEU  19   9.330   5.831   5.420
  150    H    THR  20           HN       THR  20  12.700   5.133   9.977
  151    HA   THR  20           HA       THR  20  12.456   4.297  12.113
  152    HB   THR  20           HB       THR  20  13.152   6.568  12.433
  153    HG1  THR  20           HG1      THR  20  11.060   5.893  14.252
  154   1HG2  THR  20          HG21      THR  20  11.432   7.766  11.189
  155   2HG2  THR  20          HG22      THR  20  11.563   8.410  12.828
  156   3HG2  THR  20          HG23      THR  20  10.228   7.337  12.406
  157    H    ASP  21           HN       ASP  21  10.505   2.996  11.046
  158    HA   ASP  21           HA       ASP  21   8.747   1.718  11.676
  159   1HB   ASP  21          HB2       ASP  21   8.632   3.572  14.048
  160   2HB   ASP  21          HB1       ASP  21   7.456   2.293  13.788
  161    H    ALA  22           HN       ALA  22   8.137   5.211  11.999
  162    HA   ALA  22           HA       ALA  22   5.860   4.877  10.212
  163   1HB   ALA  22          HB1       ALA  22   5.572   6.188  12.908
  164   2HB   ALA  22          HB2       ALA  22   4.905   4.624  12.439
  165   3HB   ALA  22          HB3       ALA  22   4.332   6.099  11.657
  166    H    ALA  23           HN       ALA  23   7.181   6.020   8.722
  167    HA   ALA  23           HA       ALA  23   6.763   8.899   9.054
  168   1HB   ALA  23          HB1       ALA  23   9.295   7.732   7.915
  169   2HB   ALA  23          HB2       ALA  23   9.142   8.475   9.506
  170   3HB   ALA  23          HB3       ALA  23   8.900   9.445   8.053
  171    HA   PRO  24           HA       PRO  24   4.765   7.856   5.148
  172   1HB   PRO  24          HB2       PRO  24   3.503  10.264   4.923
  173   2HB   PRO  24          HB1       PRO  24   2.894   8.934   5.915
  174   1HG   PRO  24          HG2       PRO  24   4.457  11.350   6.743
  175   2HG   PRO  24          HG1       PRO  24   3.058  10.598   7.532
  176   1HD   PRO  24          HD2       PRO  24   5.575  10.187   8.408
  177   2HD   PRO  24          HD1       PRO  24   4.336   8.925   8.487
  178    H    ILE  25           HN       ILE  25   6.509   7.821   3.782
  179    HA   ILE  25           HA       ILE  25   7.634  10.391   2.946
  180    HB   ILE  25           HB       ILE  25   9.305   8.946   1.711
  181   1HG1  ILE  25          HG12      ILE  25   9.494   6.661   3.004
  182   2HG1  ILE  25          HG11      ILE  25   7.767   6.854   3.194
  183   1HG2  ILE  25          HG21      ILE  25   9.876  10.117   3.734
  184   2HG2  ILE  25          HG22      ILE  25  10.605   8.511   3.770
  185   3HG2  ILE  25          HG23      ILE  25   9.156   8.844   4.720
  186   1HD1  ILE  25          HD11      ILE  25   9.281   6.731   0.598
  187   2HD1  ILE  25          HD12      ILE  25   7.545   6.995   0.753
  188   3HD1  ILE  25          HD13      ILE  25   8.255   5.471   1.284
  189    H    GLY  26           HN       GLY  26   5.612   7.831   1.811
  190   1HA   GLY  26          HA2       GLY  26   5.451   9.255  -0.764
  191   2HA   GLY  26          HA1       GLY  26   5.431   7.502  -0.689
  192    HA   PRO  27           HA       PRO  27   1.137   8.759   1.319
  193   1HB   PRO  27          HB2       PRO  27   0.733  11.524   1.159
  194   2HB   PRO  27          HB1       PRO  27   1.085  10.611   2.627
  195   1HG   PRO  27          HG2       PRO  27   2.933  12.158   0.869
  196   2HG   PRO  27          HG1       PRO  27   2.925  12.006   2.637
  197   1HD   PRO  27          HD2       PRO  27   4.706  10.654   1.164
  198   2HD   PRO  27          HD1       PRO  27   3.937   9.906   2.578
  199    H    VAL  28           HN       VAL  28   0.104   7.967  -0.378
  200    HA   VAL  28           HA       VAL  28   0.122   9.328  -2.954
  201    HB   VAL  28           HB       VAL  28  -1.121   6.697  -2.126
  202   1HG1  VAL  28          HG11      VAL  28  -0.657   7.836  -4.874
  203   2HG1  VAL  28          HG12      VAL  28  -2.218   7.673  -4.069
  204   3HG1  VAL  28          HG13      VAL  28  -1.298   6.233  -4.508
  205   1HG2  VAL  28          HG21      VAL  28   1.462   7.250  -3.578
  206   2HG2  VAL  28          HG22      VAL  28   0.760   5.656  -3.304
  207   3HG2  VAL  28          HG23      VAL  28   1.300   6.628  -1.935
  208    H    THR  29           HN       THR  29  -1.624  10.345  -3.832
  209    HA   THR  29           HA       THR  29  -3.890  10.929  -2.170
  210    HB   THR  29           HB       THR  29  -4.685  12.063  -4.366
  211    HG1  THR  29           HG1      THR  29  -3.396  11.348  -5.938
  212   1HG2  THR  29          HG21      THR  29  -2.184  12.971  -2.942
  213   2HG2  THR  29          HG22      THR  29  -3.845  13.304  -2.454
  214   3HG2  THR  29          HG23      THR  29  -3.211  13.994  -3.947
  215    H    VAL  30           HN       VAL  30  -5.136   9.154  -1.834
  216    HA   VAL  30           HA       VAL  30  -6.075   7.669  -4.194
  217    HB   VAL  30           HB       VAL  30  -6.237   6.967  -1.260
  218   1HG1  VAL  30          HG11      VAL  30  -7.118   5.387  -3.672
  219   2HG1  VAL  30          HG12      VAL  30  -8.168   6.104  -2.451
  220   3HG1  VAL  30          HG13      VAL  30  -7.078   4.787  -2.014
  221   1HG2  VAL  30          HG21      VAL  30  -4.653   5.188  -1.843
  222   2HG2  VAL  30          HG22      VAL  30  -3.985   6.784  -2.174
  223   3HG2  VAL  30          HG23      VAL  30  -4.590   5.789  -3.498
  224    H    GLN  31           HN       GLN  31  -7.882   8.421  -4.982
  225    HA   GLN  31           HA       GLN  31  -9.963   9.427  -3.176
  226   1HB   GLN  31          HB2       GLN  31  -8.927  10.785  -5.198
  227   2HB   GLN  31          HB1       GLN  31 -10.032   9.808  -6.150
  228   1HG   GLN  31          HG2       GLN  31 -10.845  11.582  -3.858
  229   2HG   GLN  31          HG1       GLN  31 -10.924  12.029  -5.558
  230   1HE2  GLN  31          HE21      GLN  31 -12.469  11.075  -6.882
  231   2HE2  GLN  31          HE22      GLN  31 -13.842  10.248  -6.229
  232    H    ALA  32           HN       ALA  32 -11.314   7.818  -2.682
  233    HA   ALA  32           HA       ALA  32 -11.723   5.589  -4.446
  234   1HB   ALA  32          HB1       ALA  32 -11.648   5.246  -2.031
  235   2HB   ALA  32          HB2       ALA  32 -13.199   4.733  -2.694
  236   3HB   ALA  32          HB3       ALA  32 -13.072   6.269  -1.837
  237    H    LEU  33           HN       LEU  33 -12.696   6.339  -6.275
  238    HA   LEU  33           HA       LEU  33 -15.031   8.045  -6.085
  239   1HB   LEU  33          HB2       LEU  33 -13.180   8.332  -7.782
  240   2HB   LEU  33          HB1       LEU  33 -13.755   6.872  -8.558
  241    HG   LEU  33           HG       LEU  33 -15.588   9.223  -8.164
  242   1HD1  LEU  33          HD11      LEU  33 -13.606  10.077  -9.296
  243   2HD1  LEU  33          HD12      LEU  33 -14.974   9.984 -10.407
  244   3HD1  LEU  33          HD13      LEU  33 -13.700   8.764 -10.471
  245   1HD2  LEU  33          HD21      LEU  33 -16.570   7.071  -8.823
  246   2HD2  LEU  33          HD22      LEU  33 -15.493   7.018 -10.220
  247   3HD2  LEU  33          HD23      LEU  33 -16.719   8.279 -10.098
  248    H    GLY  34           HN       GLY  34 -16.943   7.153  -5.695
  249   1HA   GLY  34          HA2       GLY  34 -18.743   5.866  -6.745
  250   2HA   GLY  34          HA1       GLY  34 -17.560   4.605  -7.052
  251    H    CYS  35           HN       CYS  35 -16.470   5.232  -4.257
  252    HA   CYS  35           HA       CYS  35 -18.051   3.304  -2.864
  253   1HB   CYS  35          HB2       CYS  35 -15.605   4.888  -2.266
  254   2HB   CYS  35          HB1       CYS  35 -16.527   4.288  -0.895
  255    H    ASN  36           HN       ASN  36 -20.063   3.878  -2.342
  256    HA   ASN  36           HA       ASN  36 -20.460   6.434  -0.924
  257   1HB   ASN  36          HB2       ASN  36 -22.456   4.596  -2.269
  258   2HB   ASN  36          HB1       ASN  36 -22.899   6.017  -1.329
  259   1HD2  ASN  36          HD21      ASN  36 -21.525   4.850  -4.290
  260   2HD2  ASN  36          HD22      ASN  36 -21.546   6.361  -5.133
  261    H    ALA  37           HN       ALA  37 -21.038   2.978  -0.827
  262    HA   ALA  37           HA       ALA  37 -20.935   3.086   2.094
  263   1HB   ALA  37          HB1       ALA  37 -23.327   3.075   1.574
  264   2HB   ALA  37          HB2       ALA  37 -22.834   1.556   2.321
  265   3HB   ALA  37          HB3       ALA  37 -23.110   1.634   0.581
  266    H    ARG  38           HN       ARG  38 -18.773   2.398   1.145
  267    HA   ARG  38           HA       ARG  38 -18.657  -0.509   1.015
  268   1HB   ARG  38          HB2       ARG  38 -18.916   0.349  -1.329
  269   2HB   ARG  38          HB1       ARG  38 -17.429   1.258  -1.102
  270   1HG   ARG  38          HG2       ARG  38 -17.260  -0.929  -2.364
  271   2HG   ARG  38          HG1       ARG  38 -16.112  -0.670  -1.050
  272   1HD   ARG  38          HD2       ARG  38 -17.056  -2.956  -1.091
  273   2HD   ARG  38          HD1       ARG  38 -17.375  -2.096   0.410
  274    HE   ARG  38           HE       ARG  38 -19.613  -1.646  -1.060
  275   1HH1  ARG  38          HH11      ARG  38 -17.834  -4.524  -0.188
  276   2HH1  ARG  38          HH12      ARG  38 -19.245  -5.537  -0.088
  277   1HH2  ARG  38          HH21      ARG  38 -21.493  -2.964  -0.934
  278   2HH2  ARG  38          HH22      ARG  38 -21.327  -4.650  -0.534
  279    H    GLN  39           HN       GLN  39 -16.650  -1.364   1.577
  280    HA   GLN  39           HA       GLN  39 -14.890   0.383   3.063
  281   1HB   GLN  39          HB2       GLN  39 -14.615  -2.588   2.556
  282   2HB   GLN  39          HB1       GLN  39 -13.841  -1.647   3.827
  283   1HG   GLN  39          HG2       GLN  39 -15.970  -1.251   4.889
  284   2HG   GLN  39          HG1       GLN  39 -16.808  -2.077   3.578
  285   1HE2  GLN  39          HE21      GLN  39 -16.691  -4.323   3.434
  286   2HE2  GLN  39          HE22      GLN  39 -16.164  -5.304   4.753
  287    H    VAL  40           HN       VAL  40 -13.069   1.232   2.278
  288    HA   VAL  40           HA       VAL  40 -12.208   0.511  -0.416
  289    HB   VAL  40           HB       VAL  40 -11.143   2.725   1.345
  290   1HG1  VAL  40          HG11      VAL  40 -11.008   2.279  -1.633
  291   2HG1  VAL  40          HG12      VAL  40  -9.674   2.124  -0.489
  292   3HG1  VAL  40          HG13      VAL  40 -10.405   3.702  -0.785
  293   1HG2  VAL  40          HG21      VAL  40 -13.538   3.029   1.030
  294   2HG2  VAL  40          HG22      VAL  40 -13.339   2.862  -0.714
  295   3HG2  VAL  40          HG23      VAL  40 -12.627   4.238   0.127
  296    H    ALA  41           HN       ALA  41 -10.429  -0.714  -0.777
  297    HA   ALA  41           HA       ALA  41  -8.669  -1.255   1.506
  298   1HB   ALA  41          HB1       ALA  41  -9.531  -3.206  -0.627
  299   2HB   ALA  41          HB2       ALA  41 -10.181  -3.140   1.011
  300   3HB   ALA  41          HB3       ALA  41  -8.485  -3.550   0.751
  301    H    LEU  42           HN       LEU  42  -6.518  -1.295   1.124
  302    HA   LEU  42           HA       LEU  42  -5.622  -0.604  -1.581
  303   1HB   LEU  42          HB2       LEU  42  -3.945  -0.583   0.920
  304   2HB   LEU  42          HB1       LEU  42  -3.658   0.267  -0.587
  305    HG   LEU  42           HG       LEU  42  -5.955   0.908   1.247
  306   1HD1  LEU  42          HD11      LEU  42  -3.874   1.287   2.431
  307   2HD1  LEU  42          HD12      LEU  42  -4.631   2.821   1.992
  308   3HD1  LEU  42          HD13      LEU  42  -3.254   2.217   1.068
  309   1HD2  LEU  42          HD21      LEU  42  -6.032   2.990  -0.027
  310   2HD2  LEU  42          HD22      LEU  42  -6.253   1.591  -1.078
  311   3HD2  LEU  42          HD23      LEU  42  -4.699   2.425  -1.036
  312    H    LYS  43           HN       LYS  43  -5.017  -2.283  -2.774
  313    HA   LYS  43           HA       LYS  43  -3.856  -4.629  -1.429
  314   1HB   LYS  43          HB2       LYS  43  -5.552  -4.347  -3.877
  315   2HB   LYS  43          HB1       LYS  43  -4.431  -5.689  -3.768
  316   1HG   LYS  43          HG2       LYS  43  -6.583  -6.429  -3.064
  317   2HG   LYS  43          HG1       LYS  43  -5.523  -6.373  -1.658
  318   1HD   LYS  43          HD2       LYS  43  -7.765  -5.512  -1.166
  319   2HD   LYS  43          HD1       LYS  43  -6.522  -4.281  -0.951
  320   1HE   LYS  43          HE2       LYS  43  -8.551  -3.440  -2.067
  321   2HE   LYS  43          HE1       LYS  43  -7.099  -3.264  -3.049
  322   1HZ   LYS  43          HZ1       LYS  43  -9.155  -5.380  -3.355
  323   2HZ   LYS  43          HZ2       LYS  43  -7.761  -5.228  -4.297
  324   3HZ   LYS  43          HZ3       LYS  43  -8.962  -4.038  -4.366
  325    H    ALA  44           HN       ALA  44  -2.048  -5.617  -2.340
  326    HA   ALA  44           HA       ALA  44  -0.466  -3.872  -4.076
  327   1HB   ALA  44          HB1       ALA  44   1.442  -5.244  -3.371
  328   2HB   ALA  44          HB2       ALA  44   0.357  -6.229  -2.388
  329   3HB   ALA  44          HB3       ALA  44   0.598  -4.524  -1.999
  330    H    ASP  45           HN       ASP  45   0.923  -5.016  -5.691
  331    HA   ASP  45           HA       ASP  45  -0.631  -7.070  -7.079
  332   1HB   ASP  45          HB2       ASP  45   0.141  -5.143  -8.404
  333   2HB   ASP  45          HB1       ASP  45   1.808  -5.509  -7.973
  334    H    THR  46           HN       THR  46   0.513  -8.971  -7.921
  335    HA   THR  46           HA       THR  46   1.751 -10.447  -5.934
  336    HB   THR  46           HB       THR  46   0.639 -11.452  -7.873
  337    HG1  THR  46           HG1      THR  46   2.618 -12.430  -6.647
  338   1HG2  THR  46          HG21      THR  46   1.427  -9.955  -9.621
  339   2HG2  THR  46          HG22      THR  46   1.814 -11.628 -10.025
  340   3HG2  THR  46          HG23      THR  46   3.073 -10.554  -9.416
  341    H    ASP  47           HN       ASP  47   3.135  -8.155  -8.061
  342    HA   ASP  47           HA       ASP  47   5.818  -8.834  -8.137
  343   1HB   ASP  47          HB2       ASP  47   5.379  -7.016  -9.429
  344   2HB   ASP  47          HB1       ASP  47   4.203  -6.359  -8.302
  345    H    ASN  48           HN       ASN  48   3.979  -7.326  -5.519
  346    HA   ASN  48           HA       ASN  48   6.274  -7.787  -3.738
  347   1HB   ASN  48          HB2       ASN  48   5.828  -5.641  -2.589
  348   2HB   ASN  48          HB1       ASN  48   6.321  -5.404  -4.261
  349   1HD2  ASN  48          HD21      ASN  48   4.747  -4.824  -5.798
  350   2HD2  ASN  48          HD22      ASN  48   3.280  -4.036  -5.302
  351    H    PHE  49           HN       PHE  49   3.537  -8.967  -4.368
  352    HA   PHE  49           HA       PHE  49   2.414  -8.918  -1.636
  353   1HB   PHE  49          HB2       PHE  49   1.001  -7.884  -3.444
  354   2HB   PHE  49          HB1       PHE  49   0.971  -9.441  -4.245
  355    HD1  PHE  49           HD1      PHE  49  -0.161  -7.592  -1.254
  356    HD2  PHE  49           HD2      PHE  49  -0.569 -11.100  -3.634
  357    HE1  PHE  49           HE1      PHE  49  -2.262  -8.128  -0.109
  358    HE2  PHE  49           HE2      PHE  49  -2.663 -11.652  -2.468
  359    HZ   PHE  49           HZ       PHE  49  -3.521 -10.154  -0.708
  360    H    GLU  50           HN       GLU  50   3.275 -10.732  -0.741
  361    HA   GLU  50           HA       GLU  50   3.239 -13.193  -2.333
  362   1HB   GLU  50          HB2       GLU  50   4.788 -14.112  -0.650
  363   2HB   GLU  50          HB1       GLU  50   5.417 -12.657  -1.405
  364   1HG   GLU  50          HG2       GLU  50   4.885 -11.355   0.548
  365   2HG   GLU  50          HG1       GLU  50   4.082 -12.735   1.292
  366    H    GLN  51           HN       GLN  51   1.266 -14.031  -2.172
  367    HA   GLN  51           HA       GLN  51  -0.433 -15.266  -1.315
  368   1HB   GLN  51          HB2       GLN  51   1.239 -16.386   0.082
  369   2HB   GLN  51          HB1       GLN  51   1.106 -15.115   1.284
  370   1HG   GLN  51          HG2       GLN  51  -1.221 -15.725   1.682
  371   2HG   GLN  51          HG1       GLN  51  -1.087 -17.008   0.478
  372   1HE2  GLN  51          HE21      GLN  51  -0.145 -15.934   3.644
  373   2HE2  GLN  51          HE22      GLN  51   0.420 -17.468   4.219
  374    H    GLY  52           HN       GLY  52   0.581 -12.820   1.029
  375   1HA   GLY  52          HA2       GLY  52  -1.729 -11.232   0.776
  376   2HA   GLY  52          HA1       GLY  52  -1.912 -12.296   2.170
  377    H    LYS  53           HN       LYS  53   1.058 -10.923   0.927
  378    HA   LYS  53           HA       LYS  53   1.231  -9.067   3.198
  379   1HB   LYS  53          HB2       LYS  53   3.537 -10.785   2.259
  380   2HB   LYS  53          HB1       LYS  53   3.514  -9.705   3.642
  381   1HG   LYS  53          HG2       LYS  53   1.677 -12.061   3.514
  382   2HG   LYS  53          HG1       LYS  53   3.354 -12.244   4.029
  383   1HD   LYS  53          HD2       LYS  53   1.328 -10.387   5.276
  384   2HD   LYS  53          HD1       LYS  53   1.818 -11.953   5.928
  385   1HE   LYS  53          HE2       LYS  53   4.183 -11.060   5.948
  386   2HE   LYS  53          HE1       LYS  53   3.495  -9.474   5.601
  387   1HZ   LYS  53          HZ1       LYS  53   3.078 -11.145   8.014
  388   2HZ   LYS  53          HZ2       LYS  53   2.106  -9.807   7.655
  389   3HZ   LYS  53          HZ3       LYS  53   3.772  -9.599   7.922
  390    H    PHE  54           HN       PHE  54   1.909  -7.065   2.495
  391    HA   PHE  54           HA       PHE  54   3.354  -7.015  -0.051
  392   1HB   PHE  54          HB2       PHE  54   2.591  -4.570  -0.175
  393   2HB   PHE  54          HB1       PHE  54   1.421  -5.828  -0.526
  394    HD1  PHE  54           HD1      PHE  54  -0.636  -5.009  -0.019
  395    HD2  PHE  54           HD2      PHE  54   2.541  -4.379   2.739
  396    HE1  PHE  54           HE1      PHE  54  -2.222  -3.990   1.560
  397    HE2  PHE  54           HE2      PHE  54   0.956  -3.370   4.330
  398    HZ   PHE  54           HZ       PHE  54  -1.425  -3.172   3.739
  399    H    PHE  55           HN       PHE  55   5.024  -5.478  -0.330
  400    HA   PHE  55           HA       PHE  55   6.265  -4.338   2.015
  401   1HB   PHE  55          HB2       PHE  55   8.389  -5.704   1.584
  402   2HB   PHE  55          HB1       PHE  55   7.090  -6.524   2.403
  403    HD1  PHE  55           HD1      PHE  55   8.779  -6.123  -0.839
  404    HD2  PHE  55           HD2      PHE  55   6.083  -8.455   1.479
  405    HE1  PHE  55           HE1      PHE  55   8.843  -7.888  -2.546
  406    HE2  PHE  55           HE2      PHE  55   6.145 -10.229  -0.227
  407    HZ   PHE  55           HZ       PHE  55   7.527  -9.944  -2.243
  408    H    LEU  56           HN       LEU  56   8.534  -3.541   1.390
  409    HA   LEU  56           HA       LEU  56   8.472  -2.256  -1.199
  410   1HB   LEU  56          HB2       LEU  56  10.807  -2.378   0.715
  411   2HB   LEU  56          HB1       LEU  56  10.537  -1.219  -0.564
  412    HG   LEU  56           HG       LEU  56   8.814  -1.419   1.900
  413   1HD1  LEU  56          HD11      LEU  56  11.068   0.485   1.281
  414   2HD1  LEU  56          HD12      LEU  56  11.090  -0.787   2.502
  415   3HD1  LEU  56          HD13      LEU  56   9.988   0.579   2.672
  416   1HD2  LEU  56          HD21      LEU  56   8.035   0.795   1.190
  417   2HD2  LEU  56          HD22      LEU  56   7.683  -0.440  -0.017
  418   3HD2  LEU  56          HD23      LEU  56   9.027   0.672  -0.263
  419    H    ILE  57           HN       ILE  57   8.915  -3.475  -2.961
  420    HA   ILE  57           HA       ILE  57  10.931  -5.590  -2.663
  421    HB   ILE  57           HB       ILE  57   8.738  -6.421  -3.405
  422   1HG1  ILE  57          HG12      ILE  57   9.492  -7.620  -5.442
  423   2HG1  ILE  57          HG11      ILE  57  10.862  -6.520  -5.559
  424   1HG2  ILE  57          HG21      ILE  57   7.912  -4.439  -4.524
  425   2HG2  ILE  57          HG22      ILE  57   7.855  -5.829  -5.609
  426   3HG2  ILE  57          HG23      ILE  57   9.128  -4.622  -5.785
  427   1HD1  ILE  57          HD11      ILE  57  10.322  -8.494  -3.353
  428   2HD1  ILE  57          HD12      ILE  57  11.642  -7.327  -3.360
  429   3HD1  ILE  57          HD13      ILE  57  11.578  -8.591  -4.587
  430    H    SER  58           HN       SER  58  12.812  -5.362  -3.619
  431    HA   SER  58           HA       SER  58  13.447  -3.109  -5.234
  432   1HB   SER  58          HB2       SER  58  15.113  -4.201  -3.782
  433   2HB   SER  58          HB1       SER  58  14.981  -5.680  -4.730
  434    HG   SER  58           HG       SER  58  16.765  -4.096  -5.190
  435    H    ASP  59           HN       ASP  59  14.020  -3.111  -7.466
  436    HA   ASP  59           HA       ASP  59  12.381  -4.644  -9.154
  437   1HB   ASP  59          HB2       ASP  59  13.249  -2.502  -9.888
  438   2HB   ASP  59          HB1       ASP  59  14.903  -3.098  -9.789
  439    H    ASN  60           HN       ASN  60  15.634  -5.137  -7.970
  440    HA   ASN  60           HA       ASN  60  16.158  -7.385  -9.704
  441   1HB   ASN  60          HB2       ASN  60  17.635  -6.244  -7.331
  442   2HB   ASN  60          HB1       ASN  60  18.171  -7.687  -8.183
  443   1HD2  ASN  60          HD21      ASN  60  17.327  -6.726 -10.785
  444   2HD2  ASN  60          HD22      ASN  60  18.467  -5.508 -11.245
  445    H    ASN  61           HN       ASN  61  14.180  -6.964  -7.172
  446    HA   ASN  61           HA       ASN  61  13.272  -8.232  -5.520
  447   1HB   ASN  61          HB2       ASN  61  12.214 -10.299  -6.431
  448   2HB   ASN  61          HB1       ASN  61  11.950  -8.856  -7.398
  449   1HD2  ASN  61          HD21      ASN  61  12.966  -8.677  -9.414
  450   2HD2  ASN  61          HD22      ASN  61  13.608 -10.058 -10.233
  451    H    ARG  62           HN       ARG  62  15.633  -8.292  -4.629
  452    HA   ARG  62           HA       ARG  62  16.033 -11.110  -3.875
  453   1HB   ARG  62          HB2       ARG  62  18.439 -10.539  -3.486
  454   2HB   ARG  62          HB1       ARG  62  17.957 -10.516  -5.179
  455   1HG   ARG  62          HG2       ARG  62  17.800  -8.066  -5.074
  456   2HG   ARG  62          HG1       ARG  62  18.321  -8.118  -3.389
  457   1HD   ARG  62          HD2       ARG  62  20.220  -7.588  -4.742
  458   2HD   ARG  62          HD1       ARG  62  20.418  -9.231  -4.138
  459    HE   ARG  62           HE       ARG  62  19.184  -9.330  -6.659
  460   1HH1  ARG  62          HH11      ARG  62  22.282  -8.609  -5.190
  461   2HH1  ARG  62          HH12      ARG  62  23.190  -8.991  -6.629
  462   1HH2  ARG  62          HH21      ARG  62  20.359  -9.818  -8.542
  463   2HH2  ARG  62          HH22      ARG  62  22.097  -9.664  -8.541
  464    H    ASP  63           HN       ASP  63  15.253  -8.011  -2.953
  465    HA   ASP  63           HA       ASP  63  15.655  -8.599  -0.127
  466   1HB   ASP  63          HB2       ASP  63  16.194  -6.107   0.066
  467   2HB   ASP  63          HB1       ASP  63  17.459  -7.140  -0.562
  468    H    LYS  64           HN       LYS  64  14.164  -7.524   1.277
  469    HA   LYS  64           HA       LYS  64  12.013  -5.960   0.141
  470   1HB   LYS  64          HB2       LYS  64  10.227  -7.454   0.558
  471   2HB   LYS  64          HB1       LYS  64  11.438  -8.414  -0.280
  472   1HG   LYS  64          HG2       LYS  64  12.066  -9.540   1.685
  473   2HG   LYS  64          HG1       LYS  64  11.243  -8.369   2.716
  474   1HD   LYS  64          HD2       LYS  64   9.845 -10.246   2.716
  475   2HD   LYS  64          HD1       LYS  64   9.100  -9.131   1.571
  476   1HE   LYS  64          HE2       LYS  64   9.052 -11.294   0.581
  477   2HE   LYS  64          HE1       LYS  64  10.287 -10.362  -0.264
  478   1HZ   LYS  64          HZ1       LYS  64  10.703 -12.456   1.798
  479   2HZ   LYS  64          HZ2       LYS  64  11.942 -11.445   1.243
  480   3HZ   LYS  64          HZ3       LYS  64  11.171 -12.505   0.169
  481    H    LEU  65           HN       LEU  65  10.714  -4.946   1.733
  482    HA   LEU  65           HA       LEU  65  11.150  -5.673   4.528
  483   1HB   LEU  65          HB2       LEU  65  10.868  -2.765   4.047
  484   2HB   LEU  65          HB1       LEU  65  11.684  -3.606   5.340
  485    HG   LEU  65           HG       LEU  65  12.793  -3.325   2.572
  486   1HD1  LEU  65          HD11      LEU  65  13.361  -1.656   5.008
  487   2HD1  LEU  65          HD12      LEU  65  12.466  -1.128   3.583
  488   3HD1  LEU  65          HD13      LEU  65  14.178  -1.530   3.450
  489   1HD2  LEU  65          HD21      LEU  65  13.770  -5.163   3.833
  490   2HD2  LEU  65          HD22      LEU  65  14.057  -4.090   5.202
  491   3HD2  LEU  65          HD23      LEU  65  14.933  -3.844   3.692
  492    H    TYR  66           HN       TYR  66   9.198  -5.856   5.466
  493    HA   TYR  66           HA       TYR  66   6.894  -5.426   3.870
  494   1HB   TYR  66          HB2       TYR  66   7.175  -6.166   6.775
  495   2HB   TYR  66          HB1       TYR  66   5.659  -6.195   5.883
  496    HD1  TYR  66           HD1      TYR  66   8.719  -7.944   6.619
  497    HD2  TYR  66           HD2      TYR  66   5.395  -7.796   3.979
  498    HE1  TYR  66           HE1      TYR  66   9.239 -10.221   5.856
  499    HE2  TYR  66           HE2      TYR  66   5.900 -10.081   3.206
  500    HH   TYR  66           HH       TYR  66   8.210 -12.101   4.815
  501    H    VAL  67           HN       VAL  67   5.458  -3.855   3.844
  502    HA   VAL  67           HA       VAL  67   5.725  -1.649   5.771
  503    HB   VAL  67           HB       VAL  67   5.214  -0.053   3.951
  504   1HG1  VAL  67          HG11      VAL  67   7.440  -0.052   2.935
  505   2HG1  VAL  67          HG12      VAL  67   7.705  -1.692   3.524
  506   3HG1  VAL  67          HG13      VAL  67   7.510  -0.364   4.668
  507   1HG2  VAL  67          HG21      VAL  67   4.141  -1.568   2.380
  508   2HG2  VAL  67          HG22      VAL  67   5.661  -2.428   2.142
  509   3HG2  VAL  67          HG23      VAL  67   5.504  -0.753   1.614
  510    H    ASN  68           HN       ASN  68   3.751  -0.177   5.558
  511    HA   ASN  68           HA       ASN  68   1.412  -1.421   4.439
  512   1HB   ASN  68          HB2       ASN  68   0.168  -0.927   6.701
  513   2HB   ASN  68          HB1       ASN  68   0.995  -2.454   6.446
  514   1HD2  ASN  68          HD21      ASN  68   1.341  -2.888   8.546
  515   2HD2  ASN  68          HD22      ASN  68   2.442  -2.007   9.549
  516    H    ILE  69           HN       ILE  69   0.097   0.018   3.611
  517    HA   ILE  69           HA       ILE  69   0.992   2.753   3.617
  518    HB   ILE  69           HB       ILE  69  -1.521   2.273   2.227
  519   1HG1  ILE  69          HG12      ILE  69   0.884   0.628   1.402
  520   2HG1  ILE  69          HG11      ILE  69  -0.575  -0.028   2.138
  521   1HG2  ILE  69          HG21      ILE  69   1.231   3.107   1.317
  522   2HG2  ILE  69          HG22      ILE  69  -0.069   4.184   1.823
  523   3HG2  ILE  69          HG23      ILE  69  -0.244   3.219   0.357
  524   1HD1  ILE  69          HD11      ILE  69  -1.873   0.746   0.214
  525   2HD1  ILE  69          HD12      ILE  69  -0.587  -0.366  -0.254
  526   3HD1  ILE  69          HD13      ILE  69  -0.396   1.367  -0.523
  527    H    ARG  70           HN       ARG  70   0.525   3.502   5.665
  528    HA   ARG  70           HA       ARG  70  -2.163   3.237   6.727
  529   1HB   ARG  70          HB2       ARG  70   0.119   4.802   7.932
  530   2HB   ARG  70          HB1       ARG  70  -1.292   4.147   8.751
  531   1HG   ARG  70          HG2       ARG  70  -0.482   1.909   8.483
  532   2HG   ARG  70          HG1       ARG  70   0.849   2.468   7.467
  533   1HD   ARG  70          HD2       ARG  70   1.624   3.836   9.432
  534   2HD   ARG  70          HD1       ARG  70   0.425   2.984  10.404
  535    HE   ARG  70           HE       ARG  70   2.043   1.116   9.036
  536   1HH1  ARG  70          HH11      ARG  70   2.216   3.439  11.663
  537   2HH1  ARG  70          HH12      ARG  70   3.431   2.542  12.536
  538   1HH2  ARG  70          HH21      ARG  70   3.650  -0.042  10.172
  539   2HH2  ARG  70          HH22      ARG  70   4.258   0.582  11.671
  540    HA   PRO  71           HA       PRO  71  -3.752   7.127   5.202
  541   1HB   PRO  71          HB2       PRO  71  -4.996   7.108   7.917
  542   2HB   PRO  71          HB1       PRO  71  -5.731   7.412   6.345
  543   1HG   PRO  71          HG2       PRO  71  -6.094   5.082   7.553
  544   2HG   PRO  71          HG1       PRO  71  -5.834   5.158   5.800
  545   1HD   PRO  71          HD2       PRO  71  -3.956   4.331   7.961
  546   2HD   PRO  71          HD1       PRO  71  -4.113   3.716   6.304
  547    H    MET  72           HN       MET  72  -2.651   8.998   5.233
  548    HA   MET  72           HA       MET  72  -0.838   9.575   7.376
  549   1HB   MET  72          HB2       MET  72  -0.300  10.066   5.003
  550   2HB   MET  72          HB1       MET  72  -1.573  11.279   4.987
  551   1HG   MET  72          HG2       MET  72  -0.392  12.602   6.620
  552   2HG   MET  72          HG1       MET  72   0.843  11.355   6.783
  553   1HE   MET  72          HE1       MET  72   2.744  13.189   6.352
  554   2HE   MET  72          HE2       MET  72   1.487  14.419   6.213
  555   3HE   MET  72          HE3       MET  72   2.733  14.287   4.972
  556    H    ASP  73           HN       ASP  73  -2.326   9.747   9.114
  557    HA   ASP  73           HA       ASP  73  -3.407  10.922  10.723
  558   1HB   ASP  73          HB2       ASP  73  -2.452  13.264   9.075
  559   2HB   ASP  73          HB1       ASP  73  -3.232  13.428  10.644
  560    H    ASN  74           HN       ASN  74  -4.801  10.160   8.160
  561    HA   ASN  74           HA       ASN  74  -6.865  12.197   7.964
  562   1HB   ASN  74          HB2       ASN  74  -6.035   9.874   6.319
  563   2HB   ASN  74          HB1       ASN  74  -7.737  10.321   6.265
  564   1HD2  ASN  74          HD21      ASN  74  -4.471  11.392   5.615
  565   2HD2  ASN  74          HD22      ASN  74  -4.907  12.708   4.580
  566    H    SER  75           HN       SER  75  -6.683   8.710   8.680
  567    HA   SER  75           HA       SER  75  -8.709   8.882  10.659
  568   1HB   SER  75          HB2       SER  75  -9.967   9.023   8.395
  569   2HB   SER  75          HB1       SER  75  -9.557   7.317   8.222
  570    HG   SER  75           HG       SER  75 -11.155   6.890   9.501
  571    H    ALA  76           HN       ALA  76  -9.498   6.443  11.076
  572    HA   ALA  76           HA       ALA  76  -7.012   4.897  11.227
  573   1HB   ALA  76          HB1       ALA  76  -8.088   5.428  13.363
  574   2HB   ALA  76          HB2       ALA  76  -8.050   3.690  13.069
  575   3HB   ALA  76          HB3       ALA  76  -9.546   4.591  12.833
  576    H    TRP  77           HN       TRP  77  -6.760   3.162  10.031
  577    HA   TRP  77           HA       TRP  77  -9.144   1.918   8.813
  578   1HB   TRP  77          HB2       TRP  77  -6.398   2.469   7.729
  579   2HB   TRP  77          HB1       TRP  77  -7.360   1.158   7.061
  580    HD1  TRP  77           HD1      TRP  77  -8.927   4.557   8.034
  581    HE1  TRP  77           HE1      TRP  77  -9.806   5.684   5.873
  582    HE3  TRP  77           HE3      TRP  77  -7.063   1.276   4.598
  583    HZ2  TRP  77           HZ2      TRP  77  -9.701   5.223   3.096
  584    HZ3  TRP  77           HZ3      TRP  77  -7.494   1.688   2.214
  585    HH2  TRP  77           HH2      TRP  77  -8.783   3.621   1.479
  586    H    THR  78           HN       THR  78  -8.930  -0.407   8.376
  587    HA   THR  78           HA       THR  78  -7.627  -1.803  10.543
  588    HB   THR  78           HB       THR  78  -9.142  -2.962   8.192
  589    HG1  THR  78           HG1      THR  78 -10.108  -2.176  10.770
  590   1HG2  THR  78          HG21      THR  78  -7.794  -4.577   9.460
  591   2HG2  THR  78          HG22      THR  78  -9.520  -4.858   9.692
  592   3HG2  THR  78          HG23      THR  78  -8.576  -4.060  10.952
  593    H    THR  79           HN       THR  79  -5.558  -2.394  10.418
  594    HA   THR  79           HA       THR  79  -4.289  -2.302   7.795
  595    HB   THR  79           HB       THR  79  -3.230  -0.847   9.319
  596    HG1  THR  79           HG1      THR  79  -1.667  -3.228   9.183
  597   1HG2  THR  79          HG21      THR  79  -3.038  -3.162  11.247
  598   2HG2  THR  79          HG22      THR  79  -4.054  -1.732  11.421
  599   3HG2  THR  79          HG23      THR  79  -2.299  -1.578  11.482
  600    H    ASP  80           HN       ASP  80  -4.317  -4.165   6.793
  601    HA   ASP  80           HA       ASP  80  -3.059  -6.455   8.153
  602   1HB   ASP  80          HB2       ASP  80  -5.070  -6.385   5.892
  603   2HB   ASP  80          HB1       ASP  80  -4.095  -7.809   6.238
  604    H    ASN  81           HN       ASN  81  -1.626  -7.743   6.650
  605    HA   ASN  81           HA       ASN  81  -0.031  -5.859   5.119
  606   1HB   ASN  81          HB2       ASN  81   0.400  -8.695   5.995
  607   2HB   ASN  81          HB1       ASN  81   1.416  -7.981   4.747
  608   1HD2  ASN  81          HD21      ASN  81   2.850  -6.323   5.296
  609   2HD2  ASN  81          HD22      ASN  81   3.263  -5.990   6.945
  610    H    GLY  82           HN       GLY  82  -2.588  -7.902   4.467
  611   1HA   GLY  82          HA2       GLY  82  -1.752  -8.278   1.685
  612   2HA   GLY  82          HA1       GLY  82  -3.112  -9.079   2.460
  613    H    VAL  83           HN       VAL  83  -4.152  -6.699   3.676
  614    HA   VAL  83           HA       VAL  83  -4.931  -5.072   1.381
  615    HB   VAL  83           HB       VAL  83  -7.323  -5.213   2.027
  616   1HG1  VAL  83          HG11      VAL  83  -6.089  -7.881   1.357
  617   2HG1  VAL  83          HG12      VAL  83  -6.504  -6.609   0.207
  618   3HG1  VAL  83          HG13      VAL  83  -7.776  -7.434   1.108
  619   1HG2  VAL  83          HG21      VAL  83  -8.085  -6.995   3.520
  620   2HG2  VAL  83          HG22      VAL  83  -7.028  -5.860   4.361
  621   3HG2  VAL  83          HG23      VAL  83  -6.410  -7.433   3.855
  622    H    PHE  84           HN       PHE  84  -5.908  -3.040   2.027
  623    HA   PHE  84           HA       PHE  84  -5.584  -2.409   4.877
  624   1HB   PHE  84          HB2       PHE  84  -3.708  -1.617   3.083
  625   2HB   PHE  84          HB1       PHE  84  -4.845  -0.280   2.950
  626    HD1  PHE  84           HD1      PHE  84  -5.602   0.775   5.221
  627    HD2  PHE  84           HD2      PHE  84  -2.091  -1.564   4.692
  628    HE1  PHE  84           HE1      PHE  84  -4.622   1.787   7.240
  629    HE2  PHE  84           HE2      PHE  84  -1.107  -0.557   6.701
  630    HZ   PHE  84           HZ       PHE  84  -2.373   1.120   7.984
  631    H    TYR  85           HN       TYR  85  -7.720  -2.182   5.337
  632    HA   TYR  85           HA       TYR  85  -9.226  -0.344   3.622
  633   1HB   TYR  85          HB2       TYR  85 -11.154  -1.789   3.558
  634   2HB   TYR  85          HB1       TYR  85  -9.761  -2.658   2.940
  635    HD1  TYR  85           HD1      TYR  85 -12.595  -3.000   4.877
  636    HD2  TYR  85           HD2      TYR  85  -8.454  -3.988   4.916
  637    HE1  TYR  85           HE1      TYR  85 -13.045  -4.814   6.480
  638    HE2  TYR  85           HE2      TYR  85  -8.897  -5.809   6.513
  639    HH   TYR  85           HH       TYR  85 -10.451  -6.633   7.977
  640    H    LYS  86           HN       LYS  86 -10.800   0.844   4.585
  641    HA   LYS  86           HA       LYS  86 -10.502   1.194   7.416
  642   1HB   LYS  86          HB2       LYS  86 -12.141   3.027   7.129
  643   2HB   LYS  86          HB1       LYS  86 -10.773   3.156   6.041
  644   1HG   LYS  86          HG2       LYS  86 -12.047   2.537   4.174
  645   2HG   LYS  86          HG1       LYS  86 -13.363   1.920   5.175
  646   1HD   LYS  86          HD2       LYS  86 -13.904   4.155   5.912
  647   2HD   LYS  86          HD1       LYS  86 -12.515   4.810   5.047
  648   1HE   LYS  86          HE2       LYS  86 -13.491   4.420   2.958
  649   2HE   LYS  86          HE1       LYS  86 -14.698   3.311   3.616
  650   1HZ   LYS  86          HZ1       LYS  86 -15.804   5.130   4.669
  651   2HZ   LYS  86          HZ2       LYS  86 -15.559   5.550   3.048
  652   3HZ   LYS  86          HZ3       LYS  86 -14.575   6.216   4.253
  653    H    ASN  87           HN       ASN  87 -12.063   0.918   8.987
  654    HA   ASN  87           HA       ASN  87 -13.937  -1.197   8.593
  655   1HB   ASN  87          HB2       ASN  87 -12.816  -0.823  10.753
  656   2HB   ASN  87          HB1       ASN  87 -13.609   0.739  10.904
  657   1HD2  ASN  87          HD21      ASN  87 -14.049  -2.719  10.979
  658   2HD2  ASN  87          HD22      ASN  87 -15.574  -2.703  11.796
  659    H    ASP  88           HN       ASP  88 -13.991   2.225   8.344
  660    HA   ASP  88           HA       ASP  88 -16.810   2.634   8.473
  661   1HB   ASP  88          HB2       ASP  88 -14.743   4.321   7.043
  662   2HB   ASP  88          HB1       ASP  88 -16.350   4.831   7.540
  663    H    VAL  89           HN       VAL  89 -18.127   3.313   6.608
  664    HA   VAL  89           HA       VAL  89 -17.220   2.077   4.092
  665    HB   VAL  89           HB       VAL  89 -19.599   1.634   3.539
  666   1HG1  VAL  89          HG11      VAL  89 -18.569   0.304   6.041
  667   2HG1  VAL  89          HG12      VAL  89 -18.188  -0.148   4.380
  668   3HG1  VAL  89          HG13      VAL  89 -19.832  -0.336   4.988
  669   1HG2  VAL  89          HG21      VAL  89 -20.099   2.333   6.433
  670   2HG2  VAL  89          HG22      VAL  89 -21.276   1.629   5.326
  671   3HG2  VAL  89          HG23      VAL  89 -20.653   3.253   5.036
  672    H    GLY  90           HN       GLY  90 -17.418   3.252   2.253
  673   1HA   GLY  90          HA2       GLY  90 -18.871   4.921   1.075
  674   2HA   GLY  90          HA1       GLY  90 -18.703   5.906   2.521
  675    H    SER  91           HN       SER  91 -17.863   7.564   1.114
  676    HA   SER  91           HA       SER  91 -15.513   7.187  -0.408
  677   1HB   SER  91          HB2       SER  91 -16.723   9.749   0.667
  678   2HB   SER  91          HB1       SER  91 -15.522   9.629  -0.618
  679    HG   SER  91           HG       SER  91 -17.592   8.035  -1.210
  680    H    TRP  92           HN       TRP  92 -13.533   8.499   0.023
  681    HA   TRP  92           HA       TRP  92 -12.856   8.979   2.800
  682   1HB   TRP  92          HB2       TRP  92 -12.475   6.528   2.473
  683   2HB   TRP  92          HB1       TRP  92 -11.272   6.944   1.247
  684    HD1  TRP  92           HD1      TRP  92 -11.910   7.360   5.033
  685    HE1  TRP  92           HE1      TRP  92  -9.640   7.787   6.169
  686    HE3  TRP  92           HE3      TRP  92  -9.000   7.627   0.870
  687    HZ2  TRP  92           HZ2      TRP  92  -6.956   8.199   5.365
  688    HZ3  TRP  92           HZ3      TRP  92  -6.619   8.046   1.119
  689    HH2  TRP  92           HH2      TRP  92  -5.593   8.318   3.323
  690    H    GLY  93           HN       GLY  93 -11.591   8.500  -0.421
  691   1HA   GLY  93          HA2       GLY  93  -9.790   9.546  -1.497
  692   2HA   GLY  93          HA1       GLY  93 -10.986  10.812  -1.444
  693    H    GLY  94           HN       GLY  94  -7.982   9.629  -0.156
  694   1HA   GLY  94          HA2       GLY  94  -7.239  12.294   0.645
  695   2HA   GLY  94          HA1       GLY  94  -7.424  11.186   1.997
  696    H    THR  95           HN       THR  95  -5.232  11.234   2.556
  697    HA   THR  95           HA       THR  95  -3.376  10.234   0.510
  698    HB   THR  95           HB       THR  95  -1.605  11.274   2.044
  699    HG1  THR  95           HG1      THR  95  -2.503  13.063   3.295
  700   1HG2  THR  95          HG21      THR  95  -2.225  12.224  -0.127
  701   2HG2  THR  95          HG22      THR  95  -1.922  13.500   1.054
  702   3HG2  THR  95          HG23      THR  95  -3.578  13.071   0.623
  703    H    ILE  96           HN       ILE  96  -2.584   8.278   0.773
  704    HA   ILE  96           HA       ILE  96  -2.236   7.220   3.508
  705    HB   ILE  96           HB       ILE  96  -2.053   4.958   2.259
  706   1HG1  ILE  96          HG12      ILE  96  -3.951   6.076   0.286
  707   2HG1  ILE  96          HG11      ILE  96  -2.254   6.472   0.031
  708   1HG2  ILE  96          HG21      ILE  96  -4.469   4.613   2.425
  709   2HG2  ILE  96          HG22      ILE  96  -4.712   6.358   2.511
  710   3HG2  ILE  96          HG23      ILE  96  -3.845   5.523   3.802
  711   1HD1  ILE  96          HD11      ILE  96  -1.743   4.062   0.051
  712   2HD1  ILE  96          HD12      ILE  96  -2.856   4.522  -1.237
  713   3HD1  ILE  96          HD13      ILE  96  -3.466   3.725   0.213
  714    H    GLY  97           HN       GLY  97  -0.170   6.700   4.132
  715   1HA   GLY  97          HA2       GLY  97   1.893   7.326   2.118
  716   2HA   GLY  97          HA1       GLY  97   2.057   7.636   3.840
  717    H    ILE  98           HN       ILE  98   3.937   6.234   2.282
  718    HA   ILE  98           HA       ILE  98   3.621   3.452   3.055
  719    HB   ILE  98           HB       ILE  98   5.717   4.891   1.436
  720   1HG1  ILE  98          HG12      ILE  98   5.052   3.085  -0.223
  721   2HG1  ILE  98          HG11      ILE  98   3.742   2.684   0.880
  722   1HG2  ILE  98          HG21      ILE  98   6.923   3.338   2.851
  723   2HG2  ILE  98          HG22      ILE  98   6.898   2.747   1.189
  724   3HG2  ILE  98          HG23      ILE  98   5.826   2.034   2.395
  725   1HD1  ILE  98          HD11      ILE  98   2.800   4.895   0.603
  726   2HD1  ILE  98          HD12      ILE  98   3.001   4.101  -0.958
  727   3HD1  ILE  98          HD13      ILE  98   4.139   5.349  -0.452
  728    H    TYR  99           HN       TYR  99   4.053   2.952   5.060
  729    HA   TYR  99           HA       TYR  99   6.445   4.103   6.355
  730   1HB   TYR  99          HB2       TYR  99   4.179   2.735   7.822
  731   2HB   TYR  99          HB1       TYR  99   5.439   3.760   8.488
  732    HD1  TYR  99           HD1      TYR  99   4.806   5.867   9.176
  733    HD2  TYR  99           HD2      TYR  99   2.630   4.024   6.029
  734    HE1  TYR  99           HE1      TYR  99   3.309   7.809   9.078
  735    HE2  TYR  99           HE2      TYR  99   1.122   5.958   5.930
  736    HH   TYR  99           HH       TYR  99   1.812   8.901   7.499
  737    H    VAL 100           HN       VAL 100   8.083   2.625   6.596
  738    HA   VAL 100           HA       VAL 100   7.794  -0.124   5.970
  739    HB   VAL 100           HB       VAL 100   9.989   1.050   5.944
  740   1HG1  VAL 100          HG11      VAL 100  11.245   1.343   8.024
  741   2HG1  VAL 100          HG12      VAL 100   9.819   0.874   8.949
  742   3HG1  VAL 100          HG13      VAL 100   9.799   2.352   7.988
  743   1HG2  VAL 100          HG21      VAL 100   9.841  -1.404   7.687
  744   2HG2  VAL 100          HG22      VAL 100  11.288  -0.817   6.869
  745   3HG2  VAL 100          HG23      VAL 100   9.904  -1.365   5.924
  746    H    ASP 101           HN       ASP 101   6.941  -1.741   7.181
  747    HA   ASP 101           HA       ASP 101   5.828  -1.072   9.745
  748   1HB   ASP 101          HB2       ASP 101   4.672  -2.600   8.137
  749   2HB   ASP 101          HB1       ASP 101   5.940  -3.792   8.421
  750    H    GLY 102           HN       GLY 102   7.510  -0.622  11.060
  751   1HA   GLY 102          HA2       GLY 102   9.034  -1.281  12.709
  752   2HA   GLY 102          HA1       GLY 102   9.158  -2.861  11.936
  753    H    GLN 103           HN       GLN 103  10.689   0.055  12.434
  754    HA   GLN 103           HA       GLN 103  11.960   0.659  10.055
  755   1HB   GLN 103          HB2       GLN 103  13.878   1.453  11.537
  756   2HB   GLN 103          HB1       GLN 103  12.294   2.156  11.830
  757   1HG   GLN 103          HG2       GLN 103  11.973   0.800  13.765
  758   2HG   GLN 103          HG1       GLN 103  13.426  -0.135  13.416
  759   1HE2  GLN 103          HE21      GLN 103  15.415   0.720  13.847
  760   2HE2  GLN 103          HE22      GLN 103  15.639   2.146  14.808
  761    H    GLN 104           HN       GLN 104  13.096  -0.527   8.741
  762    HA   GLN 104           HA       GLN 104  14.253  -3.016   9.687
  763   1HB   GLN 104          HB2       GLN 104  13.611  -1.939   6.946
  764   2HB   GLN 104          HB1       GLN 104  14.486  -3.443   7.177
  765   1HG   GLN 104          HG2       GLN 104  11.724  -2.850   8.217
  766   2HG   GLN 104          HG1       GLN 104  12.101  -3.801   6.783
  767   1HE2  GLN 104          HE21      GLN 104  11.100  -5.628   7.594
  768   2HE2  GLN 104          HE22      GLN 104  11.786  -6.578   8.861
  769    H    THR 105           HN       THR 105  15.411  -0.200   9.949
  770    HA   THR 105           HA       THR 105  17.521   0.486  10.430
  771    HB   THR 105           HB       THR 105  18.527  -2.131   9.309
  772    HG1  THR 105           HG1      THR 105  17.255  -1.489  11.736
  773   1HG2  THR 105          HG21      THR 105  19.673  -0.214  11.341
  774   2HG2  THR 105          HG22      THR 105  20.259  -0.459   9.696
  775   3HG2  THR 105          HG23      THR 105  20.381  -1.761  10.880
  776    H    ASN 106           HN       ASN 106  16.682  -0.576   7.285
  777    HA   ASN 106           HA       ASN 106  17.210   0.119   5.207
  778   1HB   ASN 106          HB2       ASN 106  17.182   2.416   6.094
  779   2HB   ASN 106          HB1       ASN 106  18.867   2.255   6.566
  780   1HD2  ASN 106          HD21      ASN 106  20.456   2.330   5.003
  781   2HD2  ASN 106          HD22      ASN 106  20.150   2.881   3.388
  782    H    THR 107           HN       THR 107  18.197  -1.827   4.901
  783    HA   THR 107           HA       THR 107  21.128  -1.929   5.083
  784    HB   THR 107           HB       THR 107  19.870  -3.770   6.194
  785    HG1  THR 107           HG1      THR 107  20.983  -5.518   5.072
  786   1HG2  THR 107          HG21      THR 107  17.915  -3.836   4.736
  787   2HG2  THR 107          HG22      THR 107  18.673  -5.426   4.846
  788   3HG2  THR 107          HG23      THR 107  18.913  -4.432   3.409
  789    HA   PRO 108           HA       PRO 108  22.384  -1.246   0.956
  790   1HB   PRO 108          HB2       PRO 108  22.298  -4.212   0.572
  791   2HB   PRO 108          HB1       PRO 108  23.536  -3.051   0.078
  792   1HG   PRO 108          HG2       PRO 108  23.575  -4.576   2.426
  793   2HG   PRO 108          HG1       PRO 108  24.573  -3.153   2.096
  794   1HD   PRO 108          HD2       PRO 108  22.589  -3.372   4.086
  795   2HD   PRO 108          HD1       PRO 108  23.355  -1.869   3.529
  796    HA   PRO 109           HA       PRO 109  18.113  -1.751  -0.617
  797   1HB   PRO 109          HB2       PRO 109  18.251   1.066  -1.251
  798   2HB   PRO 109          HB1       PRO 109  17.217   0.244  -0.082
  799   1HG   PRO 109          HG2       PRO 109  19.207   1.940   0.647
  800   2HG   PRO 109          HG1       PRO 109  18.679   0.581   1.643
  801   1HD   PRO 109          HD2       PRO 109  21.040   0.765  -0.191
  802   2HD   PRO 109          HD1       PRO 109  20.915   0.092   1.450
  803    H    GLY 110           HN       GLY 110  17.500   0.273  -2.544
  804   1HA   GLY 110          HA2       GLY 110  19.004   0.343  -4.825
  805   2HA   GLY 110          HA1       GLY 110  18.192  -1.227  -4.857
  806    H    ASN 111           HN       ASN 111  17.108  -0.251  -6.783
  807    HA   ASN 111           HA       ASN 111  15.202   1.840  -6.233
  808   1HB   ASN 111          HB2       ASN 111  16.359   1.410  -8.474
  809   2HB   ASN 111          HB1       ASN 111  15.287   0.033  -8.665
  810   1HD2  ASN 111          HD21      ASN 111  12.986   1.389  -7.456
  811   2HD2  ASN 111          HD22      ASN 111  12.449   2.526  -8.636
  812    H    TYR 112           HN       TYR 112  13.642   1.244  -4.812
  813    HA   TYR 112           HA       TYR 112  12.443  -1.387  -4.969
  814   1HB   TYR 112          HB2       TYR 112  12.153   0.924  -3.061
  815   2HB   TYR 112          HB1       TYR 112  10.983  -0.392  -3.064
  816    HD1  TYR 112           HD1      TYR 112  11.789  -2.729  -2.565
  817    HD2  TYR 112           HD2      TYR 112  14.261   0.691  -2.098
  818    HE1  TYR 112           HE1      TYR 112  13.279  -4.011  -1.110
  819    HE2  TYR 112           HE2      TYR 112  15.771  -0.595  -0.649
  820    HH   TYR 112           HH       TYR 112  15.528  -2.612   0.867
  821    H    THR 113           HN       THR 113  10.626  -1.865  -5.972
  822    HA   THR 113           HA       THR 113   8.949   0.342  -6.951
  823    HB   THR 113           HB       THR 113   9.708  -2.067  -8.608
  824    HG1  THR 113           HG1      THR 113  11.561  -1.004  -8.747
  825   1HG2  THR 113          HG21      THR 113   8.802  -0.755 -10.463
  826   2HG2  THR 113          HG22      THR 113   8.418   0.560  -9.354
  827   3HG2  THR 113          HG23      THR 113   7.586  -0.987  -9.207
  828    H    LEU 114           HN       LEU 114   7.257  -0.034  -5.625
  829    HA   LEU 114           HA       LEU 114   6.242  -2.777  -5.419
  830   1HB   LEU 114          HB2       LEU 114   4.828  -1.552  -3.532
  831   2HB   LEU 114          HB1       LEU 114   6.423  -2.217  -3.238
  832    HG   LEU 114           HG       LEU 114   6.190   0.646  -4.057
  833   1HD1  LEU 114          HD11      LEU 114   5.766  -0.370  -1.249
  834   2HD1  LEU 114          HD12      LEU 114   4.524   0.354  -2.272
  835   3HD1  LEU 114          HD13      LEU 114   5.903   1.319  -1.739
  836   1HD2  LEU 114          HD21      LEU 114   8.040  -0.839  -2.199
  837   2HD2  LEU 114          HD22      LEU 114   8.169   0.861  -2.647
  838   3HD2  LEU 114          HD23      LEU 114   8.393  -0.394  -3.868
  839    H    THR 115           HN       THR 115   4.838  -3.158  -6.924
  840    HA   THR 115           HA       THR 115   3.133  -1.137  -8.055
  841    HB   THR 115           HB       THR 115   2.746  -4.077  -8.502
  842    HG1  THR 115           HG1      THR 115   5.014  -3.767  -8.587
  843   1HG2  THR 115          HG21      THR 115   2.322  -3.337 -10.801
  844   2HG2  THR 115          HG22      THR 115   2.696  -1.676 -10.338
  845   3HG2  THR 115          HG23      THR 115   1.284  -2.485  -9.657
  846    H    LEU 116           HN       LEU 116   1.219  -0.521  -7.220
  847    HA   LEU 116           HA       LEU 116  -0.152  -2.354  -5.367
  848   1HB   LEU 116          HB2       LEU 116  -0.369   0.640  -5.675
  849   2HB   LEU 116          HB1       LEU 116  -1.332  -0.318  -4.569
  850    HG   LEU 116           HG       LEU 116   1.674  -0.075  -4.455
  851   1HD1  LEU 116          HD11      LEU 116   0.586   2.039  -3.924
  852   2HD1  LEU 116          HD12      LEU 116   1.285   1.307  -2.480
  853   3HD1  LEU 116          HD13      LEU 116  -0.454   1.220  -2.758
  854   1HD2  LEU 116          HD21      LEU 116   0.815  -2.191  -3.567
  855   2HD2  LEU 116          HD22      LEU 116  -0.288  -1.299  -2.517
  856   3HD2  LEU 116          HD23      LEU 116   1.455  -1.158  -2.288
  857    H    THR 117           HN       THR 117  -2.361  -2.747  -5.583
  858    HA   THR 117           HA       THR 117  -3.496  -1.998  -8.200
  859    HB   THR 117           HB       THR 117  -4.042  -4.567  -6.701
  860    HG1  THR 117           HG1      THR 117  -1.854  -3.954  -7.968
  861   1HG2  THR 117          HG21      THR 117  -5.842  -3.837  -8.208
  862   2HG2  THR 117          HG22      THR 117  -5.049  -5.294  -8.806
  863   3HG2  THR 117          HG23      THR 117  -4.683  -3.729  -9.533
  864    H    GLY 118           HN       GLY 118  -5.032  -0.525  -7.851
  865   1HA   GLY 118          HA2       GLY 118  -6.324  -0.193  -5.337
  866   2HA   GLY 118          HA1       GLY 118  -6.697   0.670  -6.820
  867    H    GLY 119           HN       GLY 119  -8.646  -0.149  -5.001
  868   1HA   GLY 119          HA2       GLY 119 -10.707  -0.990  -6.445
  869   2HA   GLY 119          HA1       GLY 119  -9.900  -2.521  -6.128
  870    H    TYR 120           HN       TYR 120 -12.456  -2.156  -5.232
  871    HA   TYR 120           HA       TYR 120 -12.288  -1.286  -2.471
  872   1HB   TYR 120          HB2       TYR 120 -14.704  -1.586  -2.393
  873   2HB   TYR 120          HB1       TYR 120 -14.246  -0.628  -3.791
  874    HD1  TYR 120           HD1      TYR 120 -15.811  -3.698  -2.643
  875    HD2  TYR 120           HD2      TYR 120 -14.381  -1.608  -6.063
  876    HE1  TYR 120           HE1      TYR 120 -17.069  -5.229  -4.100
  877    HE2  TYR 120           HE2      TYR 120 -15.642  -3.128  -7.526
  878    HH   TYR 120           HH       TYR 120 -16.576  -5.368  -7.475
  879    H    TRP 121           HN       TRP 121 -13.981  -2.869  -1.143
  880    HA   TRP 121           HA       TRP 121 -12.853  -5.564  -1.280
  881   1HB   TRP 121          HB2       TRP 121 -11.384  -4.602   0.270
  882   2HB   TRP 121          HB1       TRP 121 -12.627  -3.560   0.948
  883    HD1  TRP 121           HD1      TRP 121 -14.545  -4.936   2.418
  884    HE1  TRP 121           HE1      TRP 121 -14.216  -6.846   4.088
  885    HE3  TRP 121           HE3      TRP 121  -9.936  -6.519   0.908
  886    HZ2  TRP 121           HZ2      TRP 121 -12.274  -8.745   4.689
  887    HZ3  TRP 121           HZ3      TRP 121  -8.924  -8.410   2.132
  888    HH2  TRP 121           HH2      TRP 121 -10.069  -9.493   3.953
  889    H    ALA 122           HN       ALA 122 -14.165  -7.170  -0.356
  890    HA   ALA 122           HA       ALA 122 -16.804  -6.322   0.641
  891   1HB   ALA 122          HB1       ALA 122 -17.824  -8.208  -0.505
  892   2HB   ALA 122          HB2       ALA 122 -16.252  -8.695  -1.139
  893   3HB   ALA 122          HB3       ALA 122 -16.978  -7.176  -1.661
  894    H    LYS 123           HN       LYS 123 -17.695  -7.587   2.272
  895    HA   LYS 123           HA       LYS 123 -17.821  -9.002   4.049
  896   1HB   LYS 123          HB2       LYS 123 -16.448 -10.497   2.090
  897   2HB   LYS 123          HB1       LYS 123 -15.573 -10.727   3.596
  898   1HG   LYS 123          HG2       LYS 123 -18.545 -11.085   3.411
  899   2HG   LYS 123          HG1       LYS 123 -17.414 -12.388   3.045
  900   1HD   LYS 123          HD2       LYS 123 -16.445 -12.148   5.298
  901   2HD   LYS 123          HD1       LYS 123 -17.631 -10.889   5.656
  902   1HE   LYS 123          HE2       LYS 123 -19.436 -12.438   5.459
  903   2HE   LYS 123          HE1       LYS 123 -18.368 -13.690   4.831
  904   1HZ   LYS 123          HZ1       LYS 123 -18.903 -14.052   7.159
  905   2HZ   LYS 123          HZ2       LYS 123 -18.250 -12.546   7.571
  906   3HZ   LYS 123          HZ3       LYS 123 -17.243 -13.765   6.962
  907    H    ASP 124           HN       ASP 124 -15.288 -10.363   5.104
  908    HA   ASP 124           HA       ASP 124 -13.492  -8.202   5.651
  909   1HB   ASP 124          HB2       ASP 124 -13.777  -8.124   8.066
  910   2HB   ASP 124          HB1       ASP 124 -15.296  -7.721   7.273
  911    H    ASN 125           HN       ASN 125 -11.518  -8.921   5.974
  912    HA   ASN 125           HA       ASN 125  -9.721 -10.170   6.484
  913   1HB   ASN 125          HB2       ASN 125 -10.581 -10.359   8.655
  914   2HB   ASN 125          HB1       ASN 125 -11.738 -11.593   8.180
  915   1HD2  ASN 125          HD21      ASN 125 -11.106 -13.705   8.116
  916   2HD2  ASN 125          HD22      ASN 125  -9.545 -14.256   8.630
  917    H    LYS 126           HN       LYS 126 -12.491 -11.966   5.335
  918    HA   LYS 126           HA       LYS 126 -11.102 -14.298   4.542
  919   1HB   LYS 126          HB2       LYS 126 -13.092 -14.854   3.312
  920   2HB   LYS 126          HB1       LYS 126 -13.560 -14.140   4.848
  921   1HG   LYS 126          HG2       LYS 126 -14.940 -12.891   3.624
  922   2HG   LYS 126          HG1       LYS 126 -13.498 -11.960   3.204
  923   1HD   LYS 126          HD2       LYS 126 -13.169 -13.413   1.241
  924   2HD   LYS 126          HD1       LYS 126 -14.653 -14.275   1.650
  925   1HE   LYS 126          HE2       LYS 126 -15.826 -12.045   1.504
  926   2HE   LYS 126          HE1       LYS 126 -14.341 -11.404   0.806
  927   1HZ   LYS 126          HZ1       LYS 126 -15.853 -12.057  -0.942
  928   2HZ   LYS 126          HZ2       LYS 126 -15.969 -13.625  -0.314
  929   3HZ   LYS 126          HZ3       LYS 126 -14.500 -13.076  -0.954
  930    H    GLN 127           HN       GLN 127 -10.777 -11.232   3.490
  931    HA   GLN 127           HA       GLN 127  -9.642 -10.239   1.826
  932   1HB   GLN 127          HB2       GLN 127  -8.132 -12.258   2.117
  933   2HB   GLN 127          HB1       GLN 127  -8.970 -12.972   0.745
  934   1HG   GLN 127          HG2       GLN 127  -8.284 -11.082  -0.653
  935   2HG   GLN 127          HG1       GLN 127  -7.427 -10.384   0.720
  936   1HE2  GLN 127          HE21      GLN 127  -7.448 -12.899  -1.670
  937   2HE2  GLN 127          HE22      GLN 127  -5.806 -13.399  -1.449
  938    H    GLY 128           HN       GLY 128 -12.165 -10.040   1.419
  939   1HA   GLY 128          HA2       GLY 128 -12.871 -11.064  -1.206
  940   2HA   GLY 128          HA1       GLY 128 -13.884 -10.076  -0.162
  941    H    PHE 129           HN       PHE 129 -10.647  -9.651  -1.520
  942    HA   PHE 129           HA       PHE 129 -11.164  -6.843  -1.872
  943   1HB   PHE 129          HB2       PHE 129  -8.841  -6.667  -2.410
  944   2HB   PHE 129          HB1       PHE 129  -8.947  -7.888  -1.151
  945    HD1  PHE 129           HD1      PHE 129  -8.941 -10.343  -1.885
  946    HD2  PHE 129           HD2      PHE 129  -7.760  -7.139  -4.427
  947    HE1  PHE 129           HE1      PHE 129  -7.708 -11.928  -3.305
  948    HE2  PHE 129           HE2      PHE 129  -6.526  -8.721  -5.851
  949    HZ   PHE 129           HZ       PHE 129  -6.515 -11.101  -5.322
  950    H    THR 130           HN       THR 130 -11.519  -5.781  -3.795
  951    HA   THR 130           HA       THR 130 -11.607  -7.438  -6.237
  952    HB   THR 130           HB       THR 130 -13.253  -4.971  -5.618
  953    HG1  THR 130           HG1      THR 130 -13.570  -7.430  -4.736
  954   1HG2  THR 130          HG21      THR 130 -12.848  -5.301  -8.012
  955   2HG2  THR 130          HG22      THR 130 -14.538  -5.607  -7.603
  956   3HG2  THR 130          HG23      THR 130 -13.440  -6.958  -7.886
  957    HA   PRO 131           HA       PRO 131  -8.717  -4.358  -7.841
  958   1HB   PRO 131          HB2       PRO 131  -8.927  -5.602 -10.429
  959   2HB   PRO 131          HB1       PRO 131  -7.594  -5.700  -9.280
  960   1HG   PRO 131          HG2       PRO 131  -9.212  -7.817  -9.957
  961   2HG   PRO 131          HG1       PRO 131  -8.306  -7.695  -8.437
  962   1HD   PRO 131          HD2       PRO 131 -11.199  -7.139  -8.977
  963   2HD   PRO 131          HD1       PRO 131 -10.442  -7.920  -7.572
  964    H    SER 132           HN       SER 132  -9.632  -2.403  -8.145
  965    HA   SER 132           HA       SER 132 -11.187  -1.917 -10.536
  966   1HB   SER 132          HB2       SER 132 -12.366  -1.346  -7.802
  967   2HB   SER 132          HB1       SER 132 -13.071  -0.867  -9.345
  968    HG   SER 132           HG       SER 132 -12.581  -3.472  -9.456
  969    H    GLY 133           HN       GLY 133  -9.993  -0.305 -11.347
  970   1HA   GLY 133          HA2       GLY 133  -9.977   2.241 -10.916
  971   2HA   GLY 133          HA1       GLY 133  -9.035   1.782  -9.504
  972    H    THR 134           HN       THR 134  -6.973   2.237  -9.825
  973    HA   THR 134           HA       THR 134  -5.815   1.624 -12.463
  974    HB   THR 134           HB       THR 134  -4.931   3.907 -10.694
  975    HG1  THR 134           HG1      THR 134  -6.114   4.834 -12.862
  976   1HG2  THR 134          HG21      THR 134  -3.272   3.087 -12.312
  977   2HG2  THR 134          HG22      THR 134  -3.832   4.706 -12.728
  978   3HG2  THR 134          HG23      THR 134  -4.439   3.309 -13.616
  979    H    THR 135           HN       THR 135  -3.758   0.719 -12.458
  980    HA   THR 135           HA       THR 135  -2.840  -0.323  -9.895
  981    HB   THR 135           HB       THR 135  -1.646  -0.866 -12.621
  982    HG1  THR 135           HG1      THR 135  -3.043  -2.887 -12.269
  983   1HG2  THR 135          HG21      THR 135  -0.894  -2.952 -11.567
  984   2HG2  THR 135          HG22      THR 135  -1.638  -2.452 -10.049
  985   3HG2  THR 135          HG23      THR 135  -0.279  -1.540 -10.707
  986    H    GLY 136           HN       GLY 136  -1.847   1.343  -8.862
  987   1HA   GLY 136          HA2       GLY 136   0.009   3.054 -10.326
  988   2HA   GLY 136          HA1       GLY 136  -0.572   3.311  -8.685
  989    H    THR 137           HN       THR 137   2.138   2.829 -10.262
  990    HA   THR 137           HA       THR 137   3.248   0.794  -8.491
  991    HB   THR 137           HB       THR 137   4.949   2.248 -10.452
  992    HG1  THR 137           HG1      THR 137   3.233   1.934 -11.788
  993   1HG2  THR 137          HG21      THR 137   5.862   0.431  -9.103
  994   2HG2  THR 137          HG22      THR 137   5.835  -0.015 -10.810
  995   3HG2  THR 137          HG23      THR 137   4.616  -0.659  -9.709
  996    H    THR 138           HN       THR 138   3.698   1.602  -6.513
  997    HA   THR 138           HA       THR 138   4.653   4.297  -6.156
  998    HB   THR 138           HB       THR 138   4.628   2.062  -4.116
  999    HG1  THR 138           HG1      THR 138   2.572   3.409  -5.299
 1000   1HG2  THR 138          HG21      THR 138   4.560   5.068  -3.814
 1001   2HG2  THR 138          HG22      THR 138   5.956   4.035  -3.508
 1002   3HG2  THR 138          HG23      THR 138   4.515   3.895  -2.499
 1003    H    LYS 139           HN       LYS 139   6.682   4.768  -6.742
 1004    HA   LYS 139           HA       LYS 139   8.683   2.620  -6.590
 1005   1HB   LYS 139          HB2       LYS 139   8.193   3.680  -8.815
 1006   2HB   LYS 139          HB1       LYS 139   8.824   5.190  -8.175
 1007   1HG   LYS 139          HG2       LYS 139  11.000   4.231  -7.897
 1008   2HG   LYS 139          HG1       LYS 139  10.404   2.633  -8.349
 1009   1HD   LYS 139          HD2       LYS 139  10.475   5.068 -10.136
 1010   2HD   LYS 139          HD1       LYS 139  11.606   3.718 -10.195
 1011   1HE   LYS 139          HE2       LYS 139  10.187   3.063 -11.847
 1012   2HE   LYS 139          HE1       LYS 139   9.354   2.337 -10.474
 1013   1HZ   LYS 139          HZ1       LYS 139   7.982   4.417 -10.390
 1014   2HZ   LYS 139          HZ2       LYS 139   7.739   3.469 -11.767
 1015   3HZ   LYS 139          HZ3       LYS 139   8.678   4.876 -11.865
 1016    H    LEU 140           HN       LEU 140   9.764   2.654  -4.844
 1017    HA   LEU 140           HA       LEU 140  10.536   5.195  -3.616
 1018   1HB   LEU 140          HB2       LEU 140   9.489   3.873  -2.004
 1019   2HB   LEU 140          HB1       LEU 140  10.201   2.390  -2.606
 1020    HG   LEU 140           HG       LEU 140  12.359   3.031  -1.675
 1021   1HD1  LEU 140          HD11      LEU 140  10.914   5.456  -0.602
 1022   2HD1  LEU 140          HD12      LEU 140  12.151   5.464  -1.859
 1023   3HD1  LEU 140          HD13      LEU 140  12.570   4.984  -0.214
 1024   1HD2  LEU 140          HD21      LEU 140  10.103   3.216   0.312
 1025   2HD2  LEU 140          HD22      LEU 140  11.784   2.840   0.693
 1026   3HD2  LEU 140          HD23      LEU 140  10.837   1.734  -0.302
 1027    H    THR 141           HN       THR 141  12.293   5.837  -4.695
 1028    HA   THR 141           HA       THR 141  14.396   3.890  -5.293
 1029    HB   THR 141           HB       THR 141  14.184   6.764  -6.210
 1030    HG1  THR 141           HG1      THR 141  12.508   5.078  -6.881
 1031   1HG2  THR 141          HG21      THR 141  15.839   4.445  -7.215
 1032   2HG2  THR 141          HG22      THR 141  16.444   5.836  -6.314
 1033   3HG2  THR 141          HG23      THR 141  15.782   6.055  -7.934
 1034    H    VAL 142           HN       VAL 142  16.106   3.769  -3.993
 1035    HA   VAL 142           HA       VAL 142  16.368   5.584  -1.835
 1036    HB   VAL 142           HB       VAL 142  18.269   4.176  -1.221
 1037   1HG1  VAL 142          HG11      VAL 142  15.791   2.698  -2.034
 1038   2HG1  VAL 142          HG12      VAL 142  16.045   3.571  -0.522
 1039   3HG1  VAL 142          HG13      VAL 142  16.984   2.119  -0.872
 1040   1HG2  VAL 142          HG21      VAL 142  19.164   3.635  -3.408
 1041   2HG2  VAL 142          HG22      VAL 142  17.702   2.722  -3.787
 1042   3HG2  VAL 142          HG23      VAL 142  18.788   2.159  -2.518
 1043    H    THR 143           HN       THR 143  17.264   7.498  -1.976
 1044    HA   THR 143           HA       THR 143  19.788   7.855  -3.350
 1045    HB   THR 143           HB       THR 143  17.406   9.590  -4.053
 1046    HG1  THR 143           HG1      THR 143  18.203   7.227  -5.049
 1047   1HG2  THR 143          HG21      THR 143  20.237   9.557  -5.111
 1048   2HG2  THR 143          HG22      THR 143  19.528  10.802  -4.082
 1049   3HG2  THR 143          HG23      THR 143  18.925  10.565  -5.722
  Start of MODEL   11
    1    H    GLU   1           H        GLU   1 -20.650   0.805 -13.565
    2    HA   GLU   1           HA       GLU   1 -19.738   3.101 -11.943
    3   1HB   GLU   1          HB2       GLU   1 -22.017   1.176 -11.450
    4   2HB   GLU   1          HB1       GLU   1 -21.553   2.537 -10.436
    5   1HG   GLU   1          HG2       GLU   1 -22.848   2.562 -13.132
    6   2HG   GLU   1          HG1       GLU   1 -23.396   3.306 -11.628
    7    H    GLU   2           HN       GLU   2 -18.378   2.644 -10.351
    8    HA   GLU   2           HA       GLU   2 -17.988   0.089  -9.198
    9   1HB   GLU   2          HB2       GLU   2 -15.866  -0.511 -10.191
   10   2HB   GLU   2          HB1       GLU   2 -17.073  -0.357 -11.464
   11   1HG   GLU   2          HG2       GLU   2 -16.243   1.974 -11.835
   12   2HG   GLU   2          HG1       GLU   2 -14.942   1.597 -10.714
   13    H    CYS   3           HN       CYS   3 -16.156   0.089  -7.701
   14    HA   CYS   3           HA       CYS   3 -15.681   2.689  -6.576
   15   1HB   CYS   3          HB2       CYS   3 -14.803  -0.092  -5.831
   16   2HB   CYS   3          HB1       CYS   3 -14.162   1.324  -5.009
   17    H    GLN   4           HN       GLN   4 -14.497   3.790  -8.183
   18    HA   GLN   4           HA       GLN   4 -11.940   2.671  -8.989
   19   1HB   GLN   4          HB2       GLN   4 -13.253   5.318  -9.634
   20   2HB   GLN   4          HB1       GLN   4 -11.691   4.809 -10.264
   21   1HG   GLN   4          HG2       GLN   4 -12.786   2.871 -11.323
   22   2HG   GLN   4          HG1       GLN   4 -14.342   3.473 -10.751
   23   1HE2  GLN   4          HE21      GLN   4 -13.351   3.012 -13.472
   24   2HE2  GLN   4          HE22      GLN   4 -13.514   4.528 -14.292
   25    H    VAL   5           HN       VAL   5 -10.375   2.720  -7.539
   26    HA   VAL   5           HA       VAL   5 -10.062   5.103  -5.852
   27    HB   VAL   5           HB       VAL   5  -8.734   2.396  -5.595
   28   1HG1  VAL   5          HG11      VAL   5  -8.716   4.760  -3.717
   29   2HG1  VAL   5          HG12      VAL   5  -7.360   4.209  -4.698
   30   3HG1  VAL   5          HG13      VAL   5  -7.987   3.185  -3.407
   31   1HG2  VAL   5          HG21      VAL   5 -11.001   3.619  -4.026
   32   2HG2  VAL   5          HG22      VAL   5 -10.196   2.097  -3.644
   33   3HG2  VAL   5          HG23      VAL   5 -11.113   2.257  -5.142
   34    H    ARG   6           HN       ARG   6  -8.666   6.560  -6.495
   35    HA   ARG   6           HA       ARG   6  -6.819   5.970  -8.628
   36   1HB   ARG   6          HB2       ARG   6  -8.054   8.062  -8.670
   37   2HB   ARG   6          HB1       ARG   6  -7.370   8.528  -7.119
   38   1HG   ARG   6          HG2       ARG   6  -5.152   8.646  -8.106
   39   2HG   ARG   6          HG1       ARG   6  -5.802   8.119  -9.660
   40   1HD   ARG   6          HD2       ARG   6  -6.569  10.638  -8.195
   41   2HD   ARG   6          HD1       ARG   6  -5.477  10.549  -9.575
   42    HE   ARG   6           HE       ARG   6  -7.657   9.420 -10.598
   43   1HH1  ARG   6          HH11      ARG   6  -7.275  12.345  -8.694
   44   2HH1  ARG   6          HH12      ARG   6  -8.674  13.127  -9.372
   45   1HH2  ARG   6          HH21      ARG   6  -9.484  10.444 -11.514
   46   2HH2  ARG   6          HH22      ARG   6  -9.929  12.047 -11.003
   47    H    VAL   7           HN       VAL   7  -5.036   4.910  -8.092
   48    HA   VAL   7           HA       VAL   7  -3.292   6.170  -6.077
   49    HB   VAL   7           HB       VAL   7  -3.200   3.290  -7.021
   50   1HG1  VAL   7          HG11      VAL   7  -1.538   2.991  -5.241
   51   2HG1  VAL   7          HG12      VAL   7  -1.606   4.718  -4.892
   52   3HG1  VAL   7          HG13      VAL   7  -1.000   4.156  -6.451
   53   1HG2  VAL   7          HG21      VAL   7  -4.124   4.431  -4.384
   54   2HG2  VAL   7          HG22      VAL   7  -3.923   2.716  -4.743
   55   3HG2  VAL   7          HG23      VAL   7  -5.138   3.661  -5.603
   56    H    GLY   8           HN       GLY   8  -1.678   7.269  -7.021
   57   1HA   GLY   8          HA2       GLY   8  -1.152   6.731  -9.854
   58   2HA   GLY   8          HA1       GLY   8  -0.796   8.228  -9.009
   59    H    ASP   9           HN       ASP   9   0.814   6.328 -10.688
   60    HA   ASP   9           HA       ASP   9   2.845   5.142  -9.152
   61   1HB   ASP   9          HB2       ASP   9   3.089   6.415 -11.889
   62   2HB   ASP   9          HB1       ASP   9   4.231   5.287 -11.174
   63    H    LEU  10           HN       LEU  10   4.887   5.907  -8.498
   64    HA   LEU  10           HA       LEU  10   5.579   8.670  -8.928
   65   1HB   LEU  10          HB2       LEU  10   5.609   9.370  -6.624
   66   2HB   LEU  10          HB1       LEU  10   3.992   8.847  -7.046
   67    HG   LEU  10           HG       LEU  10   5.890   6.997  -5.633
   68   1HD1  LEU  10          HD11      LEU  10   4.916   7.725  -3.516
   69   2HD1  LEU  10          HD12      LEU  10   4.013   8.984  -4.357
   70   3HD1  LEU  10          HD13      LEU  10   5.776   9.045  -4.309
   71   1HD2  LEU  10          HD21      LEU  10   2.882   7.182  -5.740
   72   2HD2  LEU  10          HD22      LEU  10   3.808   5.986  -4.833
   73   3HD2  LEU  10          HD23      LEU  10   3.881   6.010  -6.596
   74    H    THR  11           HN       THR  11   7.701   8.781  -9.149
   75    HA   THR  11           HA       THR  11   9.348   6.771  -7.775
   76    HB   THR  11           HB       THR  11  10.130   8.474 -10.148
   77    HG1  THR  11           HG1      THR  11   8.415   6.662 -10.314
   78   1HG2  THR  11          HG21      THR  11  11.435   6.053  -8.894
   79   2HG2  THR  11          HG22      THR  11  12.022   7.713  -8.796
   80   3HG2  THR  11          HG23      THR  11  11.989   6.880 -10.350
   81    H    VAL  12           HN       VAL  12  10.308   7.459  -6.024
   82    HA   VAL  12           HA       VAL  12  11.383  10.171  -5.857
   83    HB   VAL  12           HB       VAL  12   9.505   9.042  -3.760
   84   1HG1  VAL  12          HG11      VAL  12   9.715  11.225  -2.676
   85   2HG1  VAL  12          HG12      VAL  12  10.881  11.722  -3.902
   86   3HG1  VAL  12          HG13      VAL  12  11.273  10.408  -2.792
   87   1HG2  VAL  12          HG21      VAL  12   8.006  10.905  -4.356
   88   2HG2  VAL  12          HG22      VAL  12   8.231   9.766  -5.683
   89   3HG2  VAL  12          HG23      VAL  12   9.076  11.313  -5.698
   90    H    ALA  13           HN       ALA  13  13.095  10.339  -4.335
   91    HA   ALA  13           HA       ALA  13  14.308   7.745  -3.771
   92   1HB   ALA  13          HB1       ALA  13  15.501  10.506  -3.604
   93   2HB   ALA  13          HB2       ALA  13  15.591   9.432  -5.000
   94   3HB   ALA  13          HB3       ALA  13  16.372   8.976  -3.485
   95    H    LYS  14           HN       LYS  14  14.302   6.855  -1.802
   96    HA   LYS  14           HA       LYS  14  14.757   8.556   0.508
   97   1HB   LYS  14          HB2       LYS  14  12.718   6.424   0.950
   98   2HB   LYS  14          HB1       LYS  14  13.000   7.897   1.850
   99   1HG   LYS  14          HG2       LYS  14  10.991   8.349   0.882
  100   2HG   LYS  14          HG1       LYS  14  12.092   9.046  -0.309
  101   1HD   LYS  14          HD2       LYS  14  11.955   6.980  -1.624
  102   2HD   LYS  14          HD1       LYS  14  10.823   6.314  -0.443
  103   1HE   LYS  14          HE2       LYS  14   9.221   8.033  -0.941
  104   2HE   LYS  14          HE1       LYS  14  10.384   8.844  -1.994
  105   1HZ   LYS  14          HZ1       LYS  14   9.246   6.139  -2.455
  106   2HZ   LYS  14          HZ2       LYS  14  10.340   6.938  -3.469
  107   3HZ   LYS  14          HZ3       LYS  14   8.775   7.549  -3.263
  108    H    THR  15           HN       THR  15  15.339   7.234   2.448
  109    HA   THR  15           HA       THR  15  16.370   4.560   1.740
  110    HB   THR  15           HB       THR  15  17.892   4.776   3.645
  111    HG1  THR  15           HG1      THR  15  17.861   7.185   4.448
  112   1HG2  THR  15          HG21      THR  15  17.983   7.234   1.887
  113   2HG2  THR  15          HG22      THR  15  18.686   5.661   1.505
  114   3HG2  THR  15          HG23      THR  15  19.323   6.610   2.850
  115    H    ARG  16           HN       ARG  16  16.064   2.891   3.527
  116    HA   ARG  16           HA       ARG  16  13.465   3.199   4.732
  117   1HB   ARG  16          HB2       ARG  16  15.468   1.007   5.311
  118   2HB   ARG  16          HB1       ARG  16  13.754   1.015   5.735
  119   1HG   ARG  16          HG2       ARG  16  13.582  -0.238   3.892
  120   2HG   ARG  16          HG1       ARG  16  13.548   1.334   3.090
  121   1HD   ARG  16          HD2       ARG  16  15.712   1.131   2.313
  122   2HD   ARG  16          HD1       ARG  16  16.171  -0.015   3.570
  123    HE   ARG  16           HE       ARG  16  14.644  -0.609   1.143
  124   1HH1  ARG  16          HH11      ARG  16  16.494  -1.730   3.909
  125   2HH1  ARG  16          HH12      ARG  16  16.293  -3.408   3.522
  126   1HH2  ARG  16          HH21      ARG  16  14.336  -2.854   0.708
  127   2HH2  ARG  16          HH22      ARG  16  15.097  -4.043   1.727
  128    H    GLY  17           HN       GLY  17  16.361   4.451   5.523
  129   1HA   GLY  17          HA2       GLY  17  15.999   4.372   8.415
  130   2HA   GLY  17          HA1       GLY  17  17.280   5.212   7.544
  131    H    GLN  18           HN       GLN  18  15.442   6.420   5.664
  132    HA   GLN  18           HA       GLN  18  14.530   8.743   6.957
  133   1HB   GLN  18          HB2       GLN  18  14.972   8.664   4.559
  134   2HB   GLN  18          HB1       GLN  18  13.722   7.454   4.336
  135   1HG   GLN  18          HG2       GLN  18  12.006   8.992   4.628
  136   2HG   GLN  18          HG1       GLN  18  13.066  10.163   5.415
  137   1HE2  GLN  18          HE21      GLN  18  11.307  10.534   3.141
  138   2HE2  GLN  18          HE22      GLN  18  12.308  11.063   1.836
  139    H    LEU  19           HN       LEU  19  13.147   5.643   6.295
  140    HA   LEU  19           HA       LEU  19  10.551   6.164   7.349
  141   1HB   LEU  19          HB2       LEU  19  12.142   3.662   6.821
  142   2HB   LEU  19          HB1       LEU  19  10.538   3.620   7.515
  143    HG   LEU  19           HG       LEU  19  10.658   3.144   5.072
  144   1HD1  LEU  19          HD11      LEU  19   8.698   4.506   4.509
  145   2HD1  LEU  19          HD12      LEU  19   9.012   5.522   5.916
  146   3HD1  LEU  19          HD13      LEU  19   8.580   3.825   6.133
  147   1HD2  LEU  19          HD21      LEU  19  12.348   4.748   4.417
  148   2HD2  LEU  19          HD22      LEU  19  11.272   6.076   4.854
  149   3HD2  LEU  19          HD23      LEU  19  10.854   5.002   3.516
  150    H    THR  20           HN       THR  20   9.937   6.154   9.436
  151    HA   THR  20           HA       THR  20  11.838   5.204  11.459
  152    HB   THR  20           HB       THR  20  11.935   7.693  11.233
  153    HG1  THR  20           HG1      THR  20  12.493   7.385  13.230
  154   1HG2  THR  20          HG21      THR  20   9.071   7.588  12.179
  155   2HG2  THR  20          HG22      THR  20   9.634   8.158  10.609
  156   3HG2  THR  20          HG23      THR  20  10.058   9.046  12.072
  157    H    ASP  21           HN       ASP  21   9.921   3.696  10.444
  158    HA   ASP  21           HA       ASP  21   8.182   2.333  10.895
  159   1HB   ASP  21          HB2       ASP  21   8.847   2.474  13.306
  160   2HB   ASP  21          HB1       ASP  21   7.733   3.830  13.478
  161    H    ALA  22           HN       ALA  22   7.123   5.393  12.365
  162    HA   ALA  22           HA       ALA  22   4.924   5.429  10.433
  163   1HB   ALA  22          HB1       ALA  22   3.906   7.132  11.870
  164   2HB   ALA  22          HB2       ALA  22   5.325   7.105  12.917
  165   3HB   ALA  22          HB3       ALA  22   4.296   5.678  12.791
  166    H    ALA  23           HN       ALA  23   6.190   6.080   8.643
  167    HA   ALA  23           HA       ALA  23   6.757   8.945   8.618
  168   1HB   ALA  23          HB1       ALA  23   8.738   6.878   7.667
  169   2HB   ALA  23          HB2       ALA  23   8.906   7.896   9.097
  170   3HB   ALA  23          HB3       ALA  23   8.901   8.627   7.492
  171    HA   PRO  24           HA       PRO  24   4.384   7.891   4.865
  172   1HB   PRO  24          HB2       PRO  24   3.308  10.398   4.660
  173   2HB   PRO  24          HB1       PRO  24   2.592   9.096   5.617
  174   1HG   PRO  24          HG2       PRO  24   4.255  11.409   6.502
  175   2HG   PRO  24          HG1       PRO  24   2.860  10.658   7.298
  176   1HD   PRO  24          HD2       PRO  24   5.428  10.197   8.062
  177   2HD   PRO  24          HD1       PRO  24   4.140   8.997   8.241
  178    H    ILE  25           HN       ILE  25   6.408   7.738   3.841
  179    HA   ILE  25           HA       ILE  25   7.778  10.089   2.895
  180    HB   ILE  25           HB       ILE  25   9.090   8.338   1.582
  181   1HG1  ILE  25          HG12      ILE  25   7.570   6.475   3.409
  182   2HG1  ILE  25          HG11      ILE  25   7.175   6.711   1.706
  183   1HG2  ILE  25          HG21      ILE  25  10.319   7.605   3.566
  184   2HG2  ILE  25          HG22      ILE  25   8.970   8.097   4.589
  185   3HG2  ILE  25          HG23      ILE  25   9.881   9.310   3.688
  186   1HD1  ILE  25          HD11      ILE  25   8.481   4.703   1.989
  187   2HD1  ILE  25          HD12      ILE  25   9.758   5.616   2.795
  188   3HD1  ILE  25          HD13      ILE  25   9.412   5.903   1.090
  189    H    GLY  26           HN       GLY  26   5.197   8.134   1.812
  190   1HA   GLY  26          HA2       GLY  26   5.187   9.593  -0.726
  191   2HA   GLY  26          HA1       GLY  26   5.119   7.838  -0.783
  192    HA   PRO  27           HA       PRO  27   0.884   9.242   1.059
  193   1HB   PRO  27          HB2       PRO  27   0.866  12.155   0.865
  194   2HB   PRO  27          HB1       PRO  27   0.511  11.129   2.255
  195   1HG   PRO  27          HG2       PRO  27   2.731  12.675   2.093
  196   2HG   PRO  27          HG1       PRO  27   2.680  11.146   2.988
  197   1HD   PRO  27          HD2       PRO  27   3.817  11.718   0.279
  198   2HD   PRO  27          HD1       PRO  27   4.446  10.676   1.569
  199    H    VAL  28           HN       VAL  28  -0.111   8.519  -0.727
  200    HA   VAL  28           HA       VAL  28   0.028   9.965  -3.235
  201    HB   VAL  28           HB       VAL  28  -1.550   7.479  -2.540
  202   1HG1  VAL  28          HG11      VAL  28  -2.376   8.627  -4.537
  203   2HG1  VAL  28          HG12      VAL  28  -1.615   7.091  -4.952
  204   3HG1  VAL  28          HG13      VAL  28  -0.753   8.606  -5.225
  205   1HG2  VAL  28          HG21      VAL  28   1.178   7.728  -3.806
  206   2HG2  VAL  28          HG22      VAL  28   0.274   6.229  -3.590
  207   3HG2  VAL  28          HG23      VAL  28   0.839   7.129  -2.183
  208    H    THR  29           HN       THR  29  -1.623  11.091  -4.189
  209    HA   THR  29           HA       THR  29  -3.729  12.102  -2.560
  210    HB   THR  29           HB       THR  29  -4.533  13.103  -4.762
  211    HG1  THR  29           HG1      THR  29  -3.357  11.367  -5.985
  212   1HG2  THR  29          HG21      THR  29  -3.122  14.366  -3.232
  213   2HG2  THR  29          HG22      THR  29  -2.648  14.692  -4.898
  214   3HG2  THR  29          HG23      THR  29  -1.680  13.605  -3.901
  215    H    VAL  30           HN       VAL  30  -5.166  10.617  -1.890
  216    HA   VAL  30           HA       VAL  30  -6.057   8.528  -3.667
  217    HB   VAL  30           HB       VAL  30  -7.119   9.051  -0.897
  218   1HG1  VAL  30          HG11      VAL  30  -7.516   6.618  -0.931
  219   2HG1  VAL  30          HG12      VAL  30  -6.891   6.543  -2.579
  220   3HG1  VAL  30          HG13      VAL  30  -8.368   7.440  -2.238
  221   1HG2  VAL  30          HG21      VAL  30  -5.395   7.470  -0.107
  222   2HG2  VAL  30          HG22      VAL  30  -4.714   8.972  -0.726
  223   3HG2  VAL  30          HG23      VAL  30  -4.655   7.507  -1.708
  224    H    GLN  31           HN       GLN  31  -8.023   8.206  -4.395
  225    HA   GLN  31           HA       GLN  31 -10.178  10.096  -3.966
  226   1HB   GLN  31          HB2       GLN  31  -8.629  10.943  -5.843
  227   2HB   GLN  31          HB1       GLN  31  -9.182   9.565  -6.775
  228   1HG   GLN  31          HG2       GLN  31 -11.039  11.644  -5.654
  229   2HG   GLN  31          HG1       GLN  31 -10.300  11.764  -7.248
  230   1HE2  GLN  31          HE21      GLN  31 -12.728  10.273  -5.327
  231   2HE2  GLN  31          HE22      GLN  31 -13.502   9.399  -6.604
  232    H    ALA  32           HN       ALA  32 -11.855   8.780  -3.606
  233    HA   ALA  32           HA       ALA  32 -11.873   6.162  -4.965
  234   1HB   ALA  32          HB1       ALA  32 -13.002   5.242  -3.009
  235   2HB   ALA  32          HB2       ALA  32 -12.945   6.818  -2.222
  236   3HB   ALA  32          HB3       ALA  32 -11.448   5.950  -2.566
  237    H    LEU  33           HN       LEU  33 -13.258   6.381  -6.588
  238    HA   LEU  33           HA       LEU  33 -15.694   7.922  -6.334
  239   1HB   LEU  33          HB2       LEU  33 -14.452   7.840  -8.459
  240   2HB   LEU  33          HB1       LEU  33 -14.724   6.110  -8.548
  241    HG   LEU  33           HG       LEU  33 -17.193   6.586  -8.627
  242   1HD1  LEU  33          HD11      LEU  33 -17.887   8.841  -9.268
  243   2HD1  LEU  33          HD12      LEU  33 -16.234   9.413  -9.041
  244   3HD1  LEU  33          HD13      LEU  33 -17.157   8.817  -7.662
  245   1HD2  LEU  33          HD21      LEU  33 -15.912   6.040 -10.627
  246   2HD2  LEU  33          HD22      LEU  33 -15.499   7.741 -10.837
  247   3HD2  LEU  33          HD23      LEU  33 -17.176   7.216 -10.987
  248    H    GLY  34           HN       GLY  34 -17.483   7.129  -5.442
  249   1HA   GLY  34          HA2       GLY  34 -19.280   5.618  -5.305
  250   2HA   GLY  34          HA1       GLY  34 -18.248   4.367  -5.986
  251    H    CYS  35           HN       CYS  35 -18.605   2.823  -4.450
  252    HA   CYS  35           HA       CYS  35 -18.366   1.680  -2.506
  253   1HB   CYS  35          HB2       CYS  35 -16.154   3.672  -2.374
  254   2HB   CYS  35          HB1       CYS  35 -16.517   2.740  -0.928
  255    H    ASN  36           HN       ASN  36 -20.373   3.722  -2.628
  256    HA   ASN  36           HA       ASN  36 -20.463   5.460  -0.451
  257   1HB   ASN  36          HB2       ASN  36 -22.010   5.505  -2.401
  258   2HB   ASN  36          HB1       ASN  36 -22.808   4.070  -1.770
  259   1HD2  ASN  36          HD21      ASN  36 -24.250   4.258  -0.120
  260   2HD2  ASN  36          HD22      ASN  36 -24.749   5.781   0.542
  261    H    ALA  37           HN       ALA  37 -21.205   2.057  -0.657
  262    HA   ALA  37           HA       ALA  37 -21.261   1.987   2.276
  263   1HB   ALA  37          HB1       ALA  37 -22.973   0.264   2.247
  264   2HB   ALA  37          HB2       ALA  37 -23.044   0.335   0.486
  265   3HB   ALA  37          HB3       ALA  37 -23.563   1.721   1.448
  266    H    ARG  38           HN       ARG  38 -18.919   1.642   1.164
  267    HA   ARG  38           HA       ARG  38 -18.474  -1.256   1.200
  268   1HB   ARG  38          HB2       ARG  38 -18.648  -0.338  -1.167
  269   2HB   ARG  38          HB1       ARG  38 -17.172   0.552  -0.825
  270   1HG   ARG  38          HG2       ARG  38 -16.549  -1.399  -1.996
  271   2HG   ARG  38          HG1       ARG  38 -16.080  -1.641  -0.311
  272   1HD   ARG  38          HD2       ARG  38 -17.089  -3.657  -1.154
  273   2HD   ARG  38          HD1       ARG  38 -18.157  -2.927   0.043
  274    HE   ARG  38           HE       ARG  38 -19.228  -1.933  -2.146
  275   1HH1  ARG  38          HH11      ARG  38 -18.024  -5.159  -1.585
  276   2HH1  ARG  38          HH12      ARG  38 -19.105  -5.914  -2.714
  277   1HH2  ARG  38          HH21      ARG  38 -20.674  -2.900  -3.627
  278   2HH2  ARG  38          HH22      ARG  38 -20.637  -4.621  -3.874
  279    H    GLN  39           HN       GLN  39 -16.377  -1.893   1.862
  280    HA   GLN  39           HA       GLN  39 -14.937   0.132   3.376
  281   1HB   GLN  39          HB2       GLN  39 -14.431  -2.848   3.298
  282   2HB   GLN  39          HB1       GLN  39 -13.918  -1.702   4.531
  283   1HG   GLN  39          HG2       GLN  39 -16.230  -1.353   5.199
  284   2HG   GLN  39          HG1       GLN  39 -16.776  -2.458   3.942
  285   1HE2  GLN  39          HE21      GLN  39 -17.752  -3.871   5.319
  286   2HE2  GLN  39          HE22      GLN  39 -16.873  -4.882   6.422
  287    H    VAL  40           HN       VAL  40 -13.862   1.235   1.777
  288    HA   VAL  40           HA       VAL  40 -12.446   0.215  -0.386
  289    HB   VAL  40           HB       VAL  40 -11.772   2.684   1.231
  290   1HG1  VAL  40          HG11      VAL  40 -10.731   3.499  -0.836
  291   2HG1  VAL  40          HG12      VAL  40 -11.045   1.942  -1.600
  292   3HG1  VAL  40          HG13      VAL  40  -9.939   2.046  -0.231
  293   1HG2  VAL  40          HG21      VAL  40 -13.548   2.350  -1.183
  294   2HG2  VAL  40          HG22      VAL  40 -13.101   3.890  -0.447
  295   3HG2  VAL  40          HG23      VAL  40 -14.074   2.731   0.458
  296    H    ALA  41           HN       ALA  41 -10.437  -0.672  -0.653
  297    HA   ALA  41           HA       ALA  41  -8.628  -0.782   1.617
  298   1HB   ALA  41          HB1       ALA  41  -9.601  -3.258   0.201
  299   2HB   ALA  41          HB2       ALA  41 -10.099  -2.747   1.816
  300   3HB   ALA  41          HB3       ALA  41  -8.418  -3.185   1.508
  301    H    LEU  42           HN       LEU  42  -6.503  -1.220   1.055
  302    HA   LEU  42           HA       LEU  42  -5.920  -0.942  -1.811
  303   1HB   LEU  42          HB2       LEU  42  -3.917  -0.717   0.413
  304   2HB   LEU  42          HB1       LEU  42  -3.853  -0.016  -1.194
  305    HG   LEU  42           HG       LEU  42  -5.794   0.825   0.940
  306   1HD1  LEU  42          HD11      LEU  42  -4.393   2.828   1.173
  307   2HD1  LEU  42          HD12      LEU  42  -3.211   2.115   0.074
  308   3HD1  LEU  42          HD13      LEU  42  -3.532   1.359   1.636
  309   1HD2  LEU  42          HD21      LEU  42  -6.124   2.786  -0.520
  310   2HD2  LEU  42          HD22      LEU  42  -6.602   1.276  -1.297
  311   3HD2  LEU  42          HD23      LEU  42  -5.072   2.042  -1.724
  312    H    LYS  43           HN       LYS  43  -4.267  -2.255  -2.759
  313    HA   LYS  43           HA       LYS  43  -3.441  -4.625  -1.241
  314   1HB   LYS  43          HB2       LYS  43  -4.456  -4.850  -4.084
  315   2HB   LYS  43          HB1       LYS  43  -3.999  -6.156  -3.005
  316   1HG   LYS  43          HG2       LYS  43  -6.294  -6.279  -2.971
  317   2HG   LYS  43          HG1       LYS  43  -5.959  -5.292  -1.546
  318   1HD   LYS  43          HD2       LYS  43  -6.343  -3.261  -2.922
  319   2HD   LYS  43          HD1       LYS  43  -6.810  -4.302  -4.269
  320   1HE   LYS  43          HE2       LYS  43  -8.703  -3.362  -2.918
  321   2HE   LYS  43          HE1       LYS  43  -8.697  -5.122  -3.086
  322   1HZ   LYS  43          HZ1       LYS  43  -9.174  -4.440  -0.826
  323   2HZ   LYS  43          HZ2       LYS  43  -7.709  -3.599  -0.746
  324   3HZ   LYS  43          HZ3       LYS  43  -7.708  -5.283  -0.896
  325    H    ALA  44           HN       ALA  44  -1.447  -5.477  -1.964
  326    HA   ALA  44           HA       ALA  44   0.075  -3.726  -3.703
  327   1HB   ALA  44          HB1       ALA  44   1.188  -4.624  -1.741
  328   2HB   ALA  44          HB2       ALA  44   1.957  -5.231  -3.209
  329   3HB   ALA  44          HB3       ALA  44   0.868  -6.269  -2.291
  330    H    ASP  45           HN       ASP  45   1.143  -4.516  -5.597
  331    HA   ASP  45           HA       ASP  45  -0.573  -6.110  -7.233
  332   1HB   ASP  45          HB2       ASP  45   0.784  -4.222  -8.107
  333   2HB   ASP  45          HB1       ASP  45   2.242  -5.154  -7.783
  334    H    THR  46           HN       THR  46   0.275  -8.031  -8.462
  335    HA   THR  46           HA       THR  46   0.714 -10.087  -6.654
  336    HB   THR  46           HB       THR  46  -0.341 -10.431  -8.818
  337    HG1  THR  46           HG1      THR  46   1.874 -11.973  -8.039
  338   1HG2  THR  46          HG21      THR  46   1.015 -10.611 -10.866
  339   2HG2  THR  46          HG22      THR  46   2.419 -10.028  -9.969
  340   3HG2  THR  46          HG23      THR  46   1.022  -8.977 -10.203
  341    H    ASP  47           HN       ASP  47   3.082  -8.085  -8.229
  342    HA   ASP  47           HA       ASP  47   5.256  -9.940  -7.847
  343   1HB   ASP  47          HB2       ASP  47   5.082  -7.082  -8.744
  344   2HB   ASP  47          HB1       ASP  47   6.640  -7.815  -8.375
  345    H    ASN  48           HN       ASN  48   3.602  -7.737  -5.879
  346    HA   ASN  48           HA       ASN  48   5.804  -7.741  -3.907
  347   1HB   ASN  48          HB2       ASN  48   3.751  -5.569  -4.416
  348   2HB   ASN  48          HB1       ASN  48   4.908  -5.551  -3.091
  349   1HD2  ASN  48          HD21      ASN  48   7.076  -5.276  -3.515
  350   2HD2  ASN  48          HD22      ASN  48   7.627  -4.575  -5.005
  351    H    PHE  49           HN       PHE  49   3.138  -9.263  -4.556
  352    HA   PHE  49           HA       PHE  49   2.079  -9.197  -1.815
  353   1HB   PHE  49          HB2       PHE  49   0.615  -7.884  -3.299
  354   2HB   PHE  49          HB1       PHE  49   0.460  -9.264  -4.373
  355    HD1  PHE  49           HD1      PHE  49  -0.349  -7.991  -1.005
  356    HD2  PHE  49           HD2      PHE  49  -1.149 -10.927  -3.976
  357    HE1  PHE  49           HE1      PHE  49  -2.354  -8.690   0.234
  358    HE2  PHE  49           HE2      PHE  49  -3.154 -11.636  -2.742
  359    HZ   PHE  49           HZ       PHE  49  -3.765 -10.510  -0.636
  360    H    GLU  50           HN       GLU  50   2.610 -11.145  -1.038
  361    HA   GLU  50           HA       GLU  50   1.744 -13.476  -2.594
  362   1HB   GLU  50          HB2       GLU  50   3.720 -14.741  -1.848
  363   2HB   GLU  50          HB1       GLU  50   4.161 -13.370  -2.851
  364   1HG   GLU  50          HG2       GLU  50   4.853 -12.116  -0.922
  365   2HG   GLU  50          HG1       GLU  50   4.276 -13.387   0.155
  366    H    GLN  51           HN       GLN  51   0.367 -14.671  -1.503
  367    HA   GLN  51           HA       GLN  51  -0.880 -15.552   0.172
  368   1HB   GLN  51          HB2       GLN  51   1.796 -15.473   1.569
  369   2HB   GLN  51          HB1       GLN  51   0.389 -16.333   2.180
  370   1HG   GLN  51          HG2       GLN  51   0.362 -17.675   0.104
  371   2HG   GLN  51          HG1       GLN  51   1.846 -16.867  -0.396
  372   1HE2  GLN  51          HE21      GLN  51   1.184 -17.707   2.921
  373   2HE2  GLN  51          HE22      GLN  51   2.352 -18.980   3.038
  374    H    GLY  52           HN       GLY  52  -1.013 -12.764  -0.040
  375   1HA   GLY  52          HA2       GLY  52  -2.075 -11.068   1.085
  376   2HA   GLY  52          HA1       GLY  52  -2.261 -12.164   2.447
  377    H    LYS  53           HN       LYS  53   0.807 -11.252   1.002
  378    HA   LYS  53           HA       LYS  53   1.333  -9.434   3.254
  379   1HB   LYS  53          HB2       LYS  53   3.358 -11.347   2.080
  380   2HB   LYS  53          HB1       LYS  53   3.593 -10.272   3.446
  381   1HG   LYS  53          HG2       LYS  53   1.683 -12.598   3.408
  382   2HG   LYS  53          HG1       LYS  53   3.308 -12.632   4.095
  383   1HD   LYS  53          HD2       LYS  53   2.670 -10.857   5.664
  384   2HD   LYS  53          HD1       LYS  53   1.041 -10.850   4.985
  385   1HE   LYS  53          HE2       LYS  53   2.371 -13.210   6.309
  386   2HE   LYS  53          HE1       LYS  53   1.190 -12.148   7.075
  387   1HZ   LYS  53          HZ1       LYS  53  -0.487 -12.874   5.582
  388   2HZ   LYS  53          HZ2       LYS  53   0.276 -14.269   6.178
  389   3HZ   LYS  53          HZ3       LYS  53   0.626 -13.711   4.617
  390    H    PHE  54           HN       PHE  54   2.209  -7.511   2.617
  391    HA   PHE  54           HA       PHE  54   3.240  -7.401  -0.122
  392   1HB   PHE  54          HB2       PHE  54   2.628  -4.929  -0.054
  393   2HB   PHE  54          HB1       PHE  54   1.332  -6.095  -0.234
  394    HD1  PHE  54           HD1      PHE  54  -0.477  -4.712   0.522
  395    HD2  PHE  54           HD2      PHE  54   2.985  -5.253   2.940
  396    HE1  PHE  54           HE1      PHE  54  -1.648  -3.692   2.430
  397    HE2  PHE  54           HE2      PHE  54   1.823  -4.231   4.855
  398    HZ   PHE  54           HZ       PHE  54  -0.602  -3.317   4.456
  399    H    PHE  55           HN       PHE  55   5.079  -6.310  -0.588
  400    HA   PHE  55           HA       PHE  55   6.625  -5.049   1.513
  401   1HB   PHE  55          HB2       PHE  55   8.540  -6.645   1.212
  402   2HB   PHE  55          HB1       PHE  55   7.144  -7.383   1.991
  403    HD1  PHE  55           HD1      PHE  55   9.232  -7.296  -0.988
  404    HD2  PHE  55           HD2      PHE  55   5.773  -9.011   0.805
  405    HE1  PHE  55           HE1      PHE  55   9.188  -9.034  -2.734
  406    HE2  PHE  55           HE2      PHE  55   5.729 -10.752  -0.931
  407    HZ   PHE  55           HZ       PHE  55   7.438 -10.765  -2.703
  408    H    LEU  56           HN       LEU  56   8.593  -4.094   0.663
  409    HA   LEU  56           HA       LEU  56   8.480  -3.460  -2.154
  410   1HB   LEU  56          HB2       LEU  56  10.665  -2.255  -1.592
  411   2HB   LEU  56          HB1       LEU  56   9.197  -1.650  -0.867
  412    HG   LEU  56           HG       LEU  56   9.942  -3.221   1.130
  413   1HD1  LEU  56          HD11      LEU  56  11.871  -4.164   0.020
  414   2HD1  LEU  56          HD12      LEU  56  12.379  -3.187   1.399
  415   3HD1  LEU  56          HD13      LEU  56  12.540  -2.553  -0.239
  416   1HD2  LEU  56          HD21      LEU  56  11.164  -0.523   0.570
  417   2HD2  LEU  56          HD22      LEU  56  11.033  -1.290   2.153
  418   3HD2  LEU  56          HD23      LEU  56   9.577  -0.819   1.278
  419    H    ILE  57           HN       ILE  57   9.926  -4.147  -3.740
  420    HA   ILE  57           HA       ILE  57  11.709  -6.328  -2.895
  421    HB   ILE  57           HB       ILE  57   9.683  -7.108  -4.160
  422   1HG1  ILE  57          HG12      ILE  57  11.015  -8.563  -5.722
  423   2HG1  ILE  57          HG11      ILE  57  12.421  -7.570  -5.364
  424   1HG2  ILE  57          HG21      ILE  57   9.470  -5.245  -5.713
  425   2HG2  ILE  57          HG22      ILE  57   9.621  -6.775  -6.578
  426   3HG2  ILE  57          HG23      ILE  57  11.001  -5.684  -6.466
  427   1HD1  ILE  57          HD11      ILE  57  12.448  -9.600  -4.055
  428   2HD1  ILE  57          HD12      ILE  57  10.866  -9.209  -3.381
  429   3HD1  ILE  57          HD13      ILE  57  12.258  -8.193  -3.008
  430    H    SER  58           HN       SER  58  13.677  -6.537  -3.991
  431    HA   SER  58           HA       SER  58  14.644  -3.992  -5.052
  432   1HB   SER  58          HB2       SER  58  16.913  -5.195  -4.560
  433   2HB   SER  58          HB1       SER  58  15.965  -4.554  -3.222
  434    HG   SER  58           HG       SER  58  15.403  -6.548  -2.616
  435    H    ASP  59           HN       ASP  59  16.565  -4.247  -6.576
  436    HA   ASP  59           HA       ASP  59  15.912  -5.399  -9.002
  437   1HB   ASP  59          HB2       ASP  59  18.734  -5.049  -7.964
  438   2HB   ASP  59          HB1       ASP  59  18.217  -5.053  -9.645
  439    H    ASN  60           HN       ASN  60  17.741  -6.721  -6.317
  440    HA   ASN  60           HA       ASN  60  18.506  -9.101  -7.773
  441   1HB   ASN  60          HB2       ASN  60  18.890  -8.832  -4.823
  442   2HB   ASN  60          HB1       ASN  60  19.964  -9.528  -6.031
  443   1HD2  ASN  60          HD21      ASN  60  21.354  -8.203  -7.163
  444   2HD2  ASN  60          HD22      ASN  60  21.666  -6.564  -6.686
  445    H    ASN  61           HN       ASN  61  15.828  -8.111  -5.994
  446    HA   ASN  61           HA       ASN  61  14.116  -9.115  -4.898
  447   1HB   ASN  61          HB2       ASN  61  15.091 -11.555  -6.407
  448   2HB   ASN  61          HB1       ASN  61  13.602 -11.505  -5.469
  449   1HD2  ASN  61          HD21      ASN  61  15.214 -10.440  -8.342
  450   2HD2  ASN  61          HD22      ASN  61  13.812  -9.834  -9.153
  451    H    ARG  62           HN       ARG  62  16.948  -9.126  -3.842
  452    HA   ARG  62           HA       ARG  62  17.046 -11.485  -2.183
  453   1HB   ARG  62          HB2       ARG  62  19.088 -10.762  -3.253
  454   2HB   ARG  62          HB1       ARG  62  18.908  -9.142  -2.590
  455   1HG   ARG  62          HG2       ARG  62  20.375  -9.938  -1.105
  456   2HG   ARG  62          HG1       ARG  62  18.898 -10.494  -0.329
  457   1HD   ARG  62          HD2       ARG  62  20.769 -12.099  -2.062
  458   2HD   ARG  62          HD1       ARG  62  20.473 -12.305  -0.338
  459    HE   ARG  62           HE       ARG  62  18.219 -13.070  -0.919
  460   1HH1  ARG  62          HH11      ARG  62  20.640 -12.974  -3.445
  461   2HH1  ARG  62          HH12      ARG  62  19.880 -14.206  -4.412
  462   1HH2  ARG  62          HH21      ARG  62  17.200 -14.702  -2.187
  463   2HH2  ARG  62          HH22      ARG  62  17.916 -15.182  -3.690
  464    H    ASP  63           HN       ASP  63  16.982  -7.940  -1.792
  465    HA   ASP  63           HA       ASP  63  16.342  -8.324   1.044
  466   1HB   ASP  63          HB2       ASP  63  18.239  -6.772   0.334
  467   2HB   ASP  63          HB1       ASP  63  16.996  -5.702  -0.308
  468    H    LYS  64           HN       LYS  64  14.425  -7.768   1.860
  469    HA   LYS  64           HA       LYS  64  12.569  -6.183   0.289
  470   1HB   LYS  64          HB2       LYS  64  10.749  -7.863   0.610
  471   2HB   LYS  64          HB1       LYS  64  12.025  -8.405  -0.468
  472   1HG   LYS  64          HG2       LYS  64  11.660 -10.277   0.796
  473   2HG   LYS  64          HG1       LYS  64  12.995  -9.523   1.667
  474   1HD   LYS  64          HD2       LYS  64  11.191  -8.428   3.116
  475   2HD   LYS  64          HD1       LYS  64  10.074  -9.595   2.399
  476   1HE   LYS  64          HE2       LYS  64  12.492 -10.110   4.116
  477   2HE   LYS  64          HE1       LYS  64  10.818 -10.571   4.416
  478   1HZ   LYS  64          HZ1       LYS  64  10.969 -12.104   2.524
  479   2HZ   LYS  64          HZ2       LYS  64  12.095 -12.479   3.735
  480   3HZ   LYS  64          HZ3       LYS  64  12.605 -11.693   2.324
  481    H    LEU  65           HN       LEU  65  10.809  -5.377   1.540
  482    HA   LEU  65           HA       LEU  65  10.858  -5.789   4.405
  483   1HB   LEU  65          HB2       LEU  65  12.489  -4.107   4.281
  484   2HB   LEU  65          HB1       LEU  65  11.599  -3.197   3.083
  485    HG   LEU  65           HG       LEU  65   9.867  -2.784   4.886
  486   1HD1  LEU  65          HD11      LEU  65  10.667  -2.961   7.201
  487   2HD1  LEU  65          HD12      LEU  65  12.105  -3.807   6.630
  488   3HD1  LEU  65          HD13      LEU  65  10.514  -4.539   6.431
  489   1HD2  LEU  65          HD21      LEU  65  12.659  -1.701   5.191
  490   2HD2  LEU  65          HD22      LEU  65  11.206  -0.973   5.873
  491   3HD2  LEU  65          HD23      LEU  65  11.399  -1.083   4.124
  492    H    TYR  66           HN       TYR  66   8.912  -5.517   5.280
  493    HA   TYR  66           HA       TYR  66   6.700  -5.194   3.479
  494   1HB   TYR  66          HB2       TYR  66   6.822  -5.677   6.459
  495   2HB   TYR  66          HB1       TYR  66   5.348  -5.742   5.491
  496    HD1  TYR  66           HD1      TYR  66   8.662  -7.358   6.003
  497    HD2  TYR  66           HD2      TYR  66   4.764  -7.709   4.312
  498    HE1  TYR  66           HE1      TYR  66   9.075  -9.734   5.543
  499    HE2  TYR  66           HE2      TYR  66   5.177 -10.088   3.848
  500    HH   TYR  66           HH       TYR  66   7.778 -11.802   5.194
  501    H    VAL  67           HN       VAL  67   5.442  -3.452   3.237
  502    HA   VAL  67           HA       VAL  67   5.890  -1.169   5.038
  503    HB   VAL  67           HB       VAL  67   5.504   0.308   3.015
  504   1HG1  VAL  67          HG11      VAL  67   7.714  -0.020   4.023
  505   2HG1  VAL  67          HG12      VAL  67   7.823   0.171   2.273
  506   3HG1  VAL  67          HG13      VAL  67   7.970  -1.431   2.997
  507   1HG2  VAL  67          HG21      VAL  67   6.002  -0.668   0.815
  508   2HG2  VAL  67          HG22      VAL  67   4.549  -1.370   1.529
  509   3HG2  VAL  67          HG23      VAL  67   6.066  -2.270   1.551
  510    H    ASN  68           HN       ASN  68   4.115  -0.185   5.785
  511    HA   ASN  68           HA       ASN  68   1.551  -1.369   4.982
  512   1HB   ASN  68          HB2       ASN  68   2.222   0.237   7.462
  513   2HB   ASN  68          HB1       ASN  68   0.694  -0.571   7.135
  514   1HD2  ASN  68          HD21      ASN  68   2.488  -0.928   9.373
  515   2HD2  ASN  68          HD22      ASN  68   2.971  -2.591   9.370
  516    H    ILE  69           HN       ILE  69   0.232  -0.221   3.762
  517    HA   ILE  69           HA       ILE  69   0.735   2.585   3.268
  518    HB   ILE  69           HB       ILE  69  -1.745   1.578   2.139
  519   1HG1  ILE  69          HG12      ILE  69   0.793   0.094   1.413
  520   2HG1  ILE  69          HG11      ILE  69  -0.546  -0.590   2.322
  521   1HG2  ILE  69          HG21      ILE  69  -0.699   2.360   0.061
  522   2HG2  ILE  69          HG22      ILE  69   0.825   2.580   0.922
  523   3HG2  ILE  69          HG23      ILE  69  -0.580   3.558   1.352
  524   1HD1  ILE  69          HD11      ILE  69  -0.668   0.401  -0.516
  525   2HD1  ILE  69          HD12      ILE  69  -2.006  -0.302   0.394
  526   3HD1  ILE  69          HD13      ILE  69  -0.597  -1.284  -0.004
  527    H    ARG  70           HN       ARG  70   0.220   3.617   5.192
  528    HA   ARG  70           HA       ARG  70  -2.430   3.109   6.347
  529   1HB   ARG  70          HB2       ARG  70  -0.255   4.758   7.624
  530   2HB   ARG  70          HB1       ARG  70  -1.600   3.935   8.399
  531   1HG   ARG  70          HG2       ARG  70  -0.568   1.776   7.918
  532   2HG   ARG  70          HG1       ARG  70   0.774   2.594   7.117
  533   1HD   ARG  70          HD2       ARG  70   0.986   3.858   9.390
  534   2HD   ARG  70          HD1       ARG  70   0.072   2.489  10.019
  535    HE   ARG  70           HE       ARG  70   2.414   1.812   8.454
  536   1HH1  ARG  70          HH11      ARG  70   1.055   2.333  11.638
  537   2HH1  ARG  70          HH12      ARG  70   2.393   1.585  12.466
  538   1HH2  ARG  70          HH21      ARG  70   4.186   0.829   9.559
  539   2HH2  ARG  70          HH22      ARG  70   4.147   0.726  11.294
  540    HA   PRO  71           HA       PRO  71  -4.140   6.984   4.941
  541   1HB   PRO  71          HB2       PRO  71  -5.122   7.134   7.752
  542   2HB   PRO  71          HB1       PRO  71  -6.010   7.342   6.239
  543   1HG   PRO  71          HG2       PRO  71  -6.224   5.091   7.651
  544   2HG   PRO  71          HG1       PRO  71  -6.196   5.064   5.877
  545   1HD   PRO  71          HD2       PRO  71  -4.077   4.296   7.819
  546   2HD   PRO  71          HD1       PRO  71  -4.425   3.645   6.205
  547    H    MET  72           HN       MET  72  -3.429   9.042   4.922
  548    HA   MET  72           HA       MET  72  -1.321   9.834   6.708
  549   1HB   MET  72          HB2       MET  72  -1.284  10.511   4.342
  550   2HB   MET  72          HB1       MET  72  -2.781  11.405   4.567
  551   1HG   MET  72          HG2       MET  72  -0.915  12.918   4.533
  552   2HG   MET  72          HG1       MET  72  -1.636  12.895   6.142
  553   1HE   MET  72          HE1       MET  72   1.244  14.112   5.518
  554   2HE   MET  72          HE2       MET  72   2.160  13.496   6.892
  555   3HE   MET  72          HE3       MET  72   0.518  14.091   7.124
  556    H    ASP  73           HN       ASP  73  -2.574   9.578   8.642
  557    HA   ASP  73           HA       ASP  73  -4.067  10.080  10.282
  558   1HB   ASP  73          HB2       ASP  73  -2.272  11.771  10.588
  559   2HB   ASP  73          HB1       ASP  73  -3.223  12.907   9.631
  560    H    ASN  74           HN       ASN  74  -6.016   9.441   9.365
  561    HA   ASN  74           HA       ASN  74  -7.764  11.614   8.514
  562   1HB   ASN  74          HB2       ASN  74  -6.472  10.342   6.556
  563   2HB   ASN  74          HB1       ASN  74  -7.787   9.195   6.782
  564   1HD2  ASN  74          HD21      ASN  74  -6.841  12.229   5.561
  565   2HD2  ASN  74          HD22      ASN  74  -8.367  12.711   4.903
  566    H    SER  75           HN       SER  75  -7.786   8.048   8.409
  567    HA   SER  75           HA       SER  75  -9.912   8.008  10.412
  568   1HB   SER  75          HB2       SER  75 -10.173   6.478   7.811
  569   2HB   SER  75          HB1       SER  75 -11.382   6.652   9.085
  570    HG   SER  75           HG       SER  75 -11.444   8.912   8.572
  571    H    ALA  76           HN       ALA  76 -10.317   5.728  11.162
  572    HA   ALA  76           HA       ALA  76  -7.764   4.373  11.435
  573   1HB   ALA  76          HB1       ALA  76 -10.432   3.777  12.708
  574   2HB   ALA  76          HB2       ALA  76  -9.125   4.720  13.426
  575   3HB   ALA  76          HB3       ALA  76  -8.902   3.000  13.110
  576    H    TRP  77           HN       TRP  77  -7.212   3.102   9.819
  577    HA   TRP  77           HA       TRP  77  -9.225   1.386   8.553
  578   1HB   TRP  77          HB2       TRP  77  -6.476   2.292   7.707
  579   2HB   TRP  77          HB1       TRP  77  -7.289   0.947   6.916
  580    HD1  TRP  77           HD1      TRP  77  -8.977   4.316   7.907
  581    HE1  TRP  77           HE1      TRP  77  -9.870   5.411   5.735
  582    HE3  TRP  77           HE3      TRP  77  -7.105   1.005   4.505
  583    HZ2  TRP  77           HZ2      TRP  77  -9.770   4.913   2.963
  584    HZ3  TRP  77           HZ3      TRP  77  -7.544   1.380   2.116
  585    HH2  TRP  77           HH2      TRP  77  -8.845   3.301   1.361
  586    H    THR  78           HN       THR  78  -9.123  -0.801   8.708
  587    HA   THR  78           HA       THR  78  -7.534  -2.009  10.737
  588    HB   THR  78           HB       THR  78  -9.066  -3.410   8.534
  589    HG1  THR  78           HG1      THR  78  -9.965  -2.318  11.023
  590   1HG2  THR  78          HG21      THR  78  -7.600  -4.846   9.874
  591   2HG2  THR  78          HG22      THR  78  -9.300  -5.194  10.193
  592   3HG2  THR  78          HG23      THR  78  -8.360  -4.249  11.347
  593    H    THR  79           HN       THR  79  -5.438  -2.506  10.530
  594    HA   THR  79           HA       THR  79  -4.324  -2.529   7.841
  595    HB   THR  79           HB       THR  79  -3.227  -1.000   9.302
  596    HG1  THR  79           HG1      THR  79  -1.951  -2.981   8.092
  597   1HG2  THR  79          HG21      THR  79  -2.709  -3.324  11.159
  598   2HG2  THR  79          HG22      THR  79  -3.795  -1.969  11.463
  599   3HG2  THR  79          HG23      THR  79  -2.057  -1.696  11.347
  600    H    ASP  80           HN       ASP  80  -4.517  -4.450   6.947
  601    HA   ASP  80           HA       ASP  80  -3.182  -6.714   8.272
  602   1HB   ASP  80          HB2       ASP  80  -5.174  -6.540   6.017
  603   2HB   ASP  80          HB1       ASP  80  -4.096  -7.927   6.123
  604    H    ASN  81           HN       ASN  81  -1.636  -7.945   6.853
  605    HA   ASN  81           HA       ASN  81   0.021  -6.013   5.453
  606   1HB   ASN  81          HB2       ASN  81   0.446  -8.780   6.473
  607   2HB   ASN  81          HB1       ASN  81   1.462  -8.221   5.149
  608   1HD2  ASN  81          HD21      ASN  81   2.778  -6.389   5.468
  609   2HD2  ASN  81          HD22      ASN  81   3.275  -5.916   7.053
  610    H    GLY  82           HN       GLY  82  -2.562  -7.704   4.536
  611   1HA   GLY  82          HA2       GLY  82  -1.493  -8.078   1.812
  612   2HA   GLY  82          HA1       GLY  82  -2.846  -8.997   2.462
  613    H    VAL  83           HN       VAL  83  -4.196  -6.877   3.698
  614    HA   VAL  83           HA       VAL  83  -4.850  -5.096   1.469
  615    HB   VAL  83           HB       VAL  83  -7.251  -5.278   2.027
  616   1HG1  VAL  83          HG11      VAL  83  -5.948  -7.888   1.242
  617   2HG1  VAL  83          HG12      VAL  83  -6.350  -6.556   0.157
  618   3HG1  VAL  83          HG13      VAL  83  -7.636  -7.457   0.962
  619   1HG2  VAL  83          HG21      VAL  83  -6.366  -7.585   3.763
  620   2HG2  VAL  83          HG22      VAL  83  -8.037  -7.172   3.378
  621   3HG2  VAL  83          HG23      VAL  83  -7.050  -6.058   4.322
  622    H    PHE  84           HN       PHE  84  -5.946  -3.148   2.139
  623    HA   PHE  84           HA       PHE  84  -5.647  -2.555   4.999
  624   1HB   PHE  84          HB2       PHE  84  -3.824  -1.687   3.167
  625   2HB   PHE  84          HB1       PHE  84  -4.986  -0.370   3.111
  626    HD1  PHE  84           HD1      PHE  84  -5.661   0.654   5.411
  627    HD2  PHE  84           HD2      PHE  84  -2.176  -1.698   4.757
  628    HE1  PHE  84           HE1      PHE  84  -4.628   1.625   7.424
  629    HE2  PHE  84           HE2      PHE  84  -1.140  -0.733   6.767
  630    HZ   PHE  84           HZ       PHE  84  -2.368   0.929   8.103
  631    H    TYR  85           HN       TYR  85  -7.815  -2.457   5.427
  632    HA   TYR  85           HA       TYR  85  -9.403  -0.635   3.744
  633   1HB   TYR  85          HB2       TYR  85 -11.386  -2.077   4.107
  634   2HB   TYR  85          HB1       TYR  85 -10.147  -2.880   3.162
  635    HD1  TYR  85           HD1      TYR  85 -12.525  -3.430   5.522
  636    HD2  TYR  85           HD2      TYR  85  -8.384  -4.178   4.900
  637    HE1  TYR  85           HE1      TYR  85 -12.646  -5.351   7.058
  638    HE2  TYR  85           HE2      TYR  85  -8.495  -6.109   6.422
  639    HH   TYR  85           HH       TYR  85  -9.892  -6.935   8.280
  640    H    LYS  86           HN       LYS  86 -10.776   0.716   4.772
  641    HA   LYS  86           HA       LYS  86 -10.474   1.069   7.587
  642   1HB   LYS  86          HB2       LYS  86 -12.244   2.792   7.332
  643   2HB   LYS  86          HB1       LYS  86 -10.907   3.009   6.216
  644   1HG   LYS  86          HG2       LYS  86 -12.177   2.290   4.376
  645   2HG   LYS  86          HG1       LYS  86 -13.435   1.605   5.410
  646   1HD   LYS  86          HD2       LYS  86 -14.013   3.858   6.185
  647   2HD   LYS  86          HD1       LYS  86 -12.764   4.534   5.142
  648   1HE   LYS  86          HE2       LYS  86 -14.992   2.842   4.043
  649   2HE   LYS  86          HE1       LYS  86 -15.177   4.581   4.295
  650   1HZ   LYS  86          HZ1       LYS  86 -14.509   4.124   2.051
  651   2HZ   LYS  86          HZ2       LYS  86 -13.149   3.262   2.583
  652   3HZ   LYS  86          HZ3       LYS  86 -13.255   4.927   2.860
  653    H    ASN  87           HN       ASN  87 -11.912   0.577   9.211
  654    HA   ASN  87           HA       ASN  87 -13.759  -1.580   8.700
  655   1HB   ASN  87          HB2       ASN  87 -12.234  -1.086  10.812
  656   2HB   ASN  87          HB1       ASN  87 -13.626  -0.138  11.326
  657   1HD2  ASN  87          HD21      ASN  87 -12.434  -3.314  10.576
  658   2HD2  ASN  87          HD22      ASN  87 -13.723  -4.199  11.326
  659    H    ASP  88           HN       ASP  88 -14.497   0.492   7.212
  660    HA   ASP  88           HA       ASP  88 -16.987   1.483   8.329
  661   1HB   ASP  88          HB2       ASP  88 -15.477   3.221   9.028
  662   2HB   ASP  88          HB1       ASP  88 -14.708   3.274   7.443
  663    H    VAL  89           HN       VAL  89 -18.372   2.339   6.669
  664    HA   VAL  89           HA       VAL  89 -17.551   1.469   3.980
  665    HB   VAL  89           HB       VAL  89 -19.925   1.002   3.476
  666   1HG1  VAL  89          HG11      VAL  89 -18.839  -0.466   5.877
  667   2HG1  VAL  89          HG12      VAL  89 -18.460  -0.803   4.187
  668   3HG1  VAL  89          HG13      VAL  89 -20.096  -1.060   4.792
  669   1HG2  VAL  89          HG21      VAL  89 -21.552   0.836   5.307
  670   2HG2  VAL  89          HG22      VAL  89 -20.983   2.492   5.098
  671   3HG2  VAL  89          HG23      VAL  89 -20.362   1.509   6.423
  672    H    GLY  90           HN       GLY  90 -17.448   3.000   2.490
  673   1HA   GLY  90          HA2       GLY  90 -19.147   4.890   1.711
  674   2HA   GLY  90          HA1       GLY  90 -18.462   5.656   3.137
  675    H    SER  91           HN       SER  91 -18.131   7.028   0.947
  676    HA   SER  91           HA       SER  91 -15.777   6.361  -0.534
  677   1HB   SER  91          HB2       SER  91 -16.065   8.851  -1.247
  678   2HB   SER  91          HB1       SER  91 -17.301   7.687  -1.728
  679    HG   SER  91           HG       SER  91 -17.645   8.966   0.731
  680    H    TRP  92           HN       TRP  92 -13.709   6.755   0.029
  681    HA   TRP  92           HA       TRP  92 -13.295   8.218   2.535
  682   1HB   TRP  92          HB2       TRP  92 -12.569   5.808   2.342
  683   2HB   TRP  92          HB1       TRP  92 -11.311   6.376   1.232
  684    HD1  TRP  92           HD1      TRP  92 -12.510   7.076   4.856
  685    HE1  TRP  92           HE1      TRP  92 -10.457   7.742   6.260
  686    HE3  TRP  92           HE3      TRP  92  -8.980   6.974   1.179
  687    HZ2  TRP  92           HZ2      TRP  92  -7.687   8.155   5.831
  688    HZ3  TRP  92           HZ3      TRP  92  -6.677   7.535   1.743
  689    HH2  TRP  92           HH2      TRP  92  -6.028   8.102   4.026
  690    H    GLY  93           HN       GLY  93 -12.053   8.013  -0.783
  691   1HA   GLY  93          HA2       GLY  93 -10.519   9.324  -1.921
  692   2HA   GLY  93          HA1       GLY  93 -11.280  10.659  -1.066
  693    H    GLY  94           HN       GLY  94  -9.685  11.889  -0.173
  694   1HA   GLY  94          HA2       GLY  94  -8.305  12.410   1.597
  695   2HA   GLY  94          HA1       GLY  94  -8.383  10.729   2.084
  696    H    THR  95           HN       THR  95  -6.266  10.470   2.540
  697    HA   THR  95           HA       THR  95  -4.468  10.164   0.292
  698    HB   THR  95           HB       THR  95  -2.698  11.402   1.863
  699    HG1  THR  95           HG1      THR  95  -4.823  13.183   2.240
  700   1HG2  THR  95          HG21      THR  95  -3.127  11.949  -0.484
  701   2HG2  THR  95          HG22      THR  95  -2.968  13.411   0.490
  702   3HG2  THR  95          HG23      THR  95  -4.566  12.856  -0.014
  703    H    ILE  96           HN       ILE  96  -3.175   8.428   0.590
  704    HA   ILE  96           HA       ILE  96  -2.685   7.511   3.340
  705    HB   ILE  96           HB       ILE  96  -2.465   5.160   2.282
  706   1HG1  ILE  96          HG12      ILE  96  -4.297   4.927   0.444
  707   2HG1  ILE  96          HG11      ILE  96  -3.977   6.630   0.146
  708   1HG2  ILE  96          HG21      ILE  96  -4.140   5.623   3.904
  709   2HG2  ILE  96          HG22      ILE  96  -4.899   4.737   2.582
  710   3HG2  ILE  96          HG23      ILE  96  -5.130   6.482   2.725
  711   1HD1  ILE  96          HD11      ILE  96  -1.969   4.402  -0.011
  712   2HD1  ILE  96          HD12      ILE  96  -1.647   6.109  -0.318
  713   3HD1  ILE  96          HD13      ILE  96  -2.740   5.214  -1.372
  714    H    GLY  97           HN       GLY  97  -0.623   6.485   3.688
  715   1HA   GLY  97          HA2       GLY  97   1.333   7.104   1.569
  716   2HA   GLY  97          HA1       GLY  97   1.587   7.674   3.211
  717    H    ILE  98           HN       ILE  98   3.488   6.158   2.027
  718    HA   ILE  98           HA       ILE  98   3.151   3.419   2.936
  719    HB   ILE  98           HB       ILE  98   5.392   4.805   1.455
  720   1HG1  ILE  98          HG12      ILE  98   4.798   3.018  -0.272
  721   2HG1  ILE  98          HG11      ILE  98   3.353   2.712   0.682
  722   1HG2  ILE  98          HG21      ILE  98   6.386   3.192   2.962
  723   2HG2  ILE  98          HG22      ILE  98   6.494   2.618   1.298
  724   3HG2  ILE  98          HG23      ILE  98   5.283   1.942   2.386
  725   1HD1  ILE  98          HD11      ILE  98   4.087   5.314  -0.640
  726   2HD1  ILE  98          HD12      ILE  98   2.640   5.020   0.324
  727   3HD1  ILE  98          HD13      ILE  98   2.876   4.161  -1.198
  728    H    TYR  99           HN       TYR  99   3.456   3.045   5.025
  729    HA   TYR  99           HA       TYR  99   5.700   4.374   6.401
  730   1HB   TYR  99          HB2       TYR  99   3.304   3.008   7.656
  731   2HB   TYR  99          HB1       TYR  99   4.543   3.932   8.490
  732    HD1  TYR  99           HD1      TYR  99   3.946   6.064   9.179
  733    HD2  TYR  99           HD2      TYR  99   2.060   4.438   5.743
  734    HE1  TYR  99           HE1      TYR  99   2.595   8.104   8.957
  735    HE2  TYR  99           HE2      TYR  99   0.703   6.465   5.514
  736    HH   TYR  99           HH       TYR  99   1.384   9.324   7.159
  737    H    VAL 100           HN       VAL 100   7.392   3.067   6.837
  738    HA   VAL 100           HA       VAL 100   7.575   0.384   6.120
  739    HB   VAL 100           HB       VAL 100   9.535   1.804   6.492
  740   1HG1  VAL 100          HG11      VAL 100  10.345   2.296   8.712
  741   2HG1  VAL 100          HG12      VAL 100   8.956   1.479   9.424
  742   3HG1  VAL 100          HG13      VAL 100   8.725   2.965   8.504
  743   1HG2  VAL 100          HG21      VAL 100  10.950   0.152   7.566
  744   2HG2  VAL 100          HG22      VAL 100   9.771  -0.632   6.513
  745   3HG2  VAL 100          HG23      VAL 100   9.530  -0.634   8.260
  746    H    ASP 101           HN       ASP 101   7.149  -1.543   7.163
  747    HA   ASP 101           HA       ASP 101   5.788  -1.422   9.730
  748   1HB   ASP 101          HB2       ASP 101   4.963  -2.947   7.942
  749   2HB   ASP 101          HB1       ASP 101   6.478  -3.838   8.030
  750    H    GLY 102           HN       GLY 102   7.485  -0.687  11.039
  751   1HA   GLY 102          HA2       GLY 102   9.211  -1.063  12.544
  752   2HA   GLY 102          HA1       GLY 102   9.405  -2.680  11.875
  753    H    GLN 103           HN       GLN 103  10.520   0.563  11.846
  754    HA   GLN 103           HA       GLN 103  11.752   0.970   9.477
  755   1HB   GLN 103          HB2       GLN 103  13.412   2.329  10.629
  756   2HB   GLN 103          HB1       GLN 103  11.822   2.574  11.333
  757   1HG   GLN 103          HG2       GLN 103  13.841   0.691  12.522
  758   2HG   GLN 103          HG1       GLN 103  13.780   2.402  12.931
  759   1HE2  GLN 103          HE21      GLN 103  10.901   2.587  12.827
  760   2HE2  GLN 103          HE22      GLN 103  10.305   1.781  14.238
  761    H    GLN 104           HN       GLN 104  13.067  -0.155   8.241
  762    HA   GLN 104           HA       GLN 104  14.525  -2.399   9.232
  763   1HB   GLN 104          HB2       GLN 104  13.462  -2.224   6.963
  764   2HB   GLN 104          HB1       GLN 104  14.725  -1.088   6.517
  765   1HG   GLN 104          HG2       GLN 104  15.183  -3.340   5.695
  766   2HG   GLN 104          HG1       GLN 104  16.412  -2.804   6.841
  767   1HE2  GLN 104          HE21      GLN 104  16.564  -3.791   8.835
  768   2HE2  GLN 104          HE22      GLN 104  15.735  -5.263   9.220
  769    H    THR 105           HN       THR 105  15.146   0.835   9.381
  770    HA   THR 105           HA       THR 105  16.928   2.035  10.109
  771    HB   THR 105           HB       THR 105  18.511  -0.519  10.376
  772    HG1  THR 105           HG1      THR 105  16.203  -0.412  11.340
  773   1HG2  THR 105          HG21      THR 105  18.428   2.014  12.023
  774   2HG2  THR 105          HG22      THR 105  19.662   1.618  10.827
  775   3HG2  THR 105          HG23      THR 105  19.498   0.638  12.285
  776    H    ASN 106           HN       ASN 106  16.593   1.198   7.274
  777    HA   ASN 106           HA       ASN 106  17.579   1.519   5.273
  778   1HB   ASN 106          HB2       ASN 106  18.110   3.716   6.094
  779   2HB   ASN 106          HB1       ASN 106  19.513   3.112   6.953
  780   1HD2  ASN 106          HD21      ASN 106  18.695   2.066   3.710
  781   2HD2  ASN 106          HD22      ASN 106  20.027   2.839   2.931
  782    H    THR 107           HN       THR 107  17.936  -0.861   5.621
  783    HA   THR 107           HA       THR 107  20.686  -1.697   5.552
  784    HB   THR 107           HB       THR 107  18.325  -3.276   4.521
  785    HG1  THR 107           HG1      THR 107  19.128  -2.938   7.246
  786   1HG2  THR 107          HG21      THR 107  20.539  -4.284   4.252
  787   2HG2  THR 107          HG22      THR 107  19.585  -5.178   5.438
  788   3HG2  THR 107          HG23      THR 107  20.851  -4.072   5.976
  789    HA   PRO 108           HA       PRO 108  22.190  -0.592   1.586
  790   1HB   PRO 108          HB2       PRO 108  22.155  -3.511   1.006
  791   2HB   PRO 108          HB1       PRO 108  23.459  -2.339   0.810
  792   1HG   PRO 108          HG2       PRO 108  23.091  -4.088   2.987
  793   2HG   PRO 108          HG1       PRO 108  24.223  -2.731   2.902
  794   1HD   PRO 108          HD2       PRO 108  22.011  -2.941   4.618
  795   2HD   PRO 108          HD1       PRO 108  22.927  -1.461   4.271
  796    HA   PRO 109           HA       PRO 109  18.221  -1.116  -0.538
  797   1HB   PRO 109          HB2       PRO 109  17.782   1.517  -0.994
  798   2HB   PRO 109          HB1       PRO 109  17.394   0.727   0.533
  799   1HG   PRO 109          HG2       PRO 109  19.570   2.598  -0.110
  800   2HG   PRO 109          HG1       PRO 109  18.825   2.231   1.450
  801   1HD   PRO 109          HD2       PRO 109  21.300   1.249   0.426
  802   2HD   PRO 109          HD1       PRO 109  20.502   0.816   1.954
  803    H    GLY 110           HN       GLY 110  17.458   0.179  -2.609
  804   1HA   GLY 110          HA2       GLY 110  19.420   0.879  -4.540
  805   2HA   GLY 110          HA1       GLY 110  18.888  -0.783  -4.751
  806    H    ASN 111           HN       ASN 111  17.405  -0.907  -6.290
  807    HA   ASN 111           HA       ASN 111  15.355   1.187  -6.443
  808   1HB   ASN 111          HB2       ASN 111  16.478   0.385  -8.559
  809   2HB   ASN 111          HB1       ASN 111  15.727  -1.187  -8.289
  810   1HD2  ASN 111          HD21      ASN 111  15.269   2.075  -9.278
  811   2HD2  ASN 111          HD22      ASN 111  13.637   1.907  -9.828
  812    H    TYR 112           HN       TYR 112  13.713   0.854  -5.072
  813    HA   TYR 112           HA       TYR 112  12.834  -1.915  -4.668
  814   1HB   TYR 112          HB2       TYR 112  12.636   0.521  -2.910
  815   2HB   TYR 112          HB1       TYR 112  11.662  -0.915  -2.614
  816    HD1  TYR 112           HD1      TYR 112  13.136  -3.193  -2.716
  817    HD2  TYR 112           HD2      TYR 112  14.606   0.683  -1.796
  818    HE1  TYR 112           HE1      TYR 112  14.965  -4.197  -1.440
  819    HE2  TYR 112           HE2      TYR 112  16.459  -0.317  -0.526
  820    HH   TYR 112           HH       TYR 112  16.925  -2.456   0.666
  821    H    THR 113           HN       THR 113  11.346  -2.406  -6.024
  822    HA   THR 113           HA       THR 113   9.358  -0.419  -6.830
  823    HB   THR 113           HB       THR 113   9.987  -3.152  -7.966
  824    HG1  THR 113           HG1      THR 113  11.623  -1.540  -8.327
  825   1HG2  THR 113          HG21      THR 113   7.650  -2.505  -8.348
  826   2HG2  THR 113          HG22      THR 113   8.572  -2.486  -9.850
  827   3HG2  THR 113          HG23      THR 113   8.185  -0.971  -9.034
  828    H    LEU 114           HN       LEU 114   7.508  -0.419  -5.727
  829    HA   LEU 114           HA       LEU 114   6.314  -3.011  -5.072
  830   1HB   LEU 114          HB2       LEU 114   5.355  -1.921  -2.992
  831   2HB   LEU 114          HB1       LEU 114   7.051  -2.349  -2.949
  832    HG   LEU 114           HG       LEU 114   6.397   0.421  -3.763
  833   1HD1  LEU 114          HD11      LEU 114   6.202   1.126  -1.413
  834   2HD1  LEU 114          HD12      LEU 114   6.147  -0.567  -0.925
  835   3HD1  LEU 114          HD13      LEU 114   4.854   0.108  -1.918
  836   1HD2  LEU 114          HD21      LEU 114   8.402   0.914  -2.477
  837   2HD2  LEU 114          HD22      LEU 114   8.708  -0.380  -3.637
  838   3HD2  LEU 114          HD23      LEU 114   8.477  -0.762  -1.933
  839    H    THR 115           HN       THR 115   4.847  -3.000  -6.684
  840    HA   THR 115           HA       THR 115   3.357  -0.661  -7.387
  841    HB   THR 115           HB       THR 115   2.656  -3.500  -8.136
  842    HG1  THR 115           HG1      THR 115   4.313  -3.536  -9.477
  843   1HG2  THR 115          HG21      THR 115   2.236  -0.846  -9.522
  844   2HG2  THR 115          HG22      THR 115   0.995  -1.803  -8.711
  845   3HG2  THR 115          HG23      THR 115   1.775  -2.421 -10.168
  846    H    LEU 116           HN       LEU 116   1.504   0.044  -6.518
  847    HA   LEU 116           HA       LEU 116   0.052  -1.779  -4.713
  848   1HB   LEU 116          HB2       LEU 116   0.310   1.222  -4.581
  849   2HB   LEU 116          HB1       LEU 116  -0.652   0.245  -3.487
  850    HG   LEU 116           HG       LEU 116   2.358   0.158  -3.758
  851   1HD1  LEU 116          HD11      LEU 116   0.606   1.217  -1.546
  852   2HD1  LEU 116          HD12      LEU 116   1.545   2.189  -2.679
  853   3HD1  LEU 116          HD13      LEU 116   2.367   1.136  -1.527
  854   1HD2  LEU 116          HD21      LEU 116   2.291  -1.324  -1.817
  855   2HD2  LEU 116          HD22      LEU 116   1.432  -2.031  -3.185
  856   3HD2  LEU 116          HD23      LEU 116   0.528  -1.306  -1.855
  857    H    THR 117           HN       THR 117  -2.005  -2.193  -5.228
  858    HA   THR 117           HA       THR 117  -3.161  -0.648  -7.450
  859    HB   THR 117           HB       THR 117  -3.946  -3.428  -6.561
  860    HG1  THR 117           HG1      THR 117  -1.684  -2.809  -7.608
  861   1HG2  THR 117          HG21      THR 117  -4.466  -1.895  -9.116
  862   2HG2  THR 117          HG22      THR 117  -5.650  -2.237  -7.854
  863   3HG2  THR 117          HG23      THR 117  -4.959  -3.558  -8.796
  864    H    GLY 118           HN       GLY 118  -4.871   0.579  -7.045
  865   1HA   GLY 118          HA2       GLY 118  -6.144   0.566  -4.468
  866   2HA   GLY 118          HA1       GLY 118  -6.554   1.595  -5.834
  867    H    GLY 119           HN       GLY 119  -8.431   0.290  -4.125
  868   1HA   GLY 119          HA2       GLY 119 -10.266  -0.657  -5.968
  869   2HA   GLY 119          HA1       GLY 119  -9.433  -2.070  -5.332
  870    H    TYR 120           HN       TYR 120 -11.758  -2.455  -4.694
  871    HA   TYR 120           HA       TYR 120 -12.192  -1.227  -2.064
  872   1HB   TYR 120          HB2       TYR 120 -14.549  -1.765  -2.258
  873   2HB   TYR 120          HB1       TYR 120 -14.036  -0.823  -3.648
  874    HD1  TYR 120           HD1      TYR 120 -15.228  -4.087  -2.489
  875    HD2  TYR 120           HD2      TYR 120 -13.996  -1.808  -5.876
  876    HE1  TYR 120           HE1      TYR 120 -16.237  -5.760  -3.981
  877    HE2  TYR 120           HE2      TYR 120 -15.000  -3.482  -7.369
  878    HH   TYR 120           HH       TYR 120 -15.735  -5.743  -7.406
  879    H    TRP 121           HN       TRP 121 -13.654  -2.853  -0.727
  880    HA   TRP 121           HA       TRP 121 -12.659  -5.574  -0.935
  881   1HB   TRP 121          HB2       TRP 121 -10.967  -4.802   0.464
  882   2HB   TRP 121          HB1       TRP 121 -12.013  -3.629   1.253
  883    HD1  TRP 121           HD1      TRP 121 -13.878  -4.729   2.949
  884    HE1  TRP 121           HE1      TRP 121 -13.623  -6.680   4.587
  885    HE3  TRP 121           HE3      TRP 121  -9.735  -6.944   0.922
  886    HZ2  TRP 121           HZ2      TRP 121 -11.902  -8.840   4.974
  887    HZ3  TRP 121           HZ3      TRP 121  -8.861  -8.970   2.037
  888    HH2  TRP 121           HH2      TRP 121  -9.930  -9.886   3.993
  889    H    ALA 122           HN       ALA 122 -14.013  -7.075   0.092
  890    HA   ALA 122           HA       ALA 122 -16.480  -5.986   1.261
  891   1HB   ALA 122          HB1       ALA 122 -16.891  -6.827  -0.998
  892   2HB   ALA 122          HB2       ALA 122 -17.728  -7.797   0.215
  893   3HB   ALA 122          HB3       ALA 122 -16.248  -8.400  -0.530
  894    H    LYS 123           HN       LYS 123 -17.335  -7.051   2.983
  895    HA   LYS 123           HA       LYS 123 -17.504  -8.303   4.837
  896   1HB   LYS 123          HB2       LYS 123 -17.051 -10.157   2.924
  897   2HB   LYS 123          HB1       LYS 123 -15.657 -10.444   3.957
  898   1HG   LYS 123          HG2       LYS 123 -18.309 -10.236   5.269
  899   2HG   LYS 123          HG1       LYS 123 -17.980 -11.680   4.314
  900   1HD   LYS 123          HD2       LYS 123 -16.198 -12.320   5.682
  901   2HD   LYS 123          HD1       LYS 123 -16.033 -10.705   6.377
  902   1HE   LYS 123          HE2       LYS 123 -18.485 -12.395   6.783
  903   2HE   LYS 123          HE1       LYS 123 -17.084 -12.495   7.849
  904   1HZ   LYS 123          HZ1       LYS 123 -18.554  -9.976   7.285
  905   2HZ   LYS 123          HZ2       LYS 123 -17.335 -10.212   8.437
  906   3HZ   LYS 123          HZ3       LYS 123 -18.848 -10.961   8.633
  907    H    ASP 124           HN       ASP 124 -14.999 -10.121   5.533
  908    HA   ASP 124           HA       ASP 124 -12.950  -8.185   5.995
  909   1HB   ASP 124          HB2       ASP 124 -13.008  -8.139   8.419
  910   2HB   ASP 124          HB1       ASP 124 -14.546  -7.566   7.786
  911    H    ASN 125           HN       ASN 125 -11.033  -9.073   6.399
  912    HA   ASN 125           HA       ASN 125  -9.366 -10.576   6.563
  913   1HB   ASN 125          HB2       ASN 125 -11.396 -12.205   8.055
  914   2HB   ASN 125          HB1       ASN 125  -9.688 -12.599   7.930
  915   1HD2  ASN 125          HD21      ASN 125 -12.061 -10.600   9.430
  916   2HD2  ASN 125          HD22      ASN 125 -10.989  -9.808  10.536
  917    H    LYS 126           HN       LYS 126 -12.388 -12.066   5.505
  918    HA   LYS 126           HA       LYS 126 -11.318 -14.420   4.431
  919   1HB   LYS 126          HB2       LYS 126 -13.450 -14.718   3.357
  920   2HB   LYS 126          HB1       LYS 126 -13.706 -14.044   4.959
  921   1HG   LYS 126          HG2       LYS 126 -15.052 -12.595   3.932
  922   2HG   LYS 126          HG1       LYS 126 -13.567 -11.795   3.410
  923   1HD   LYS 126          HD2       LYS 126 -13.587 -13.201   1.365
  924   2HD   LYS 126          HD1       LYS 126 -15.138 -13.872   1.877
  925   1HE   LYS 126          HE2       LYS 126 -16.004 -11.513   1.935
  926   2HE   LYS 126          HE1       LYS 126 -14.507 -11.023   1.149
  927   1HZ   LYS 126          HZ1       LYS 126 -16.477 -12.959   0.052
  928   2HZ   LYS 126          HZ2       LYS 126 -15.033 -12.494  -0.706
  929   3HZ   LYS 126          HZ3       LYS 126 -16.272 -11.359  -0.467
  930    H    GLN 127           HN       GLN 127 -10.729 -11.374   3.404
  931    HA   GLN 127           HA       GLN 127  -9.742 -10.458   1.613
  932   1HB   GLN 127          HB2       GLN 127  -9.336 -13.353   0.926
  933   2HB   GLN 127          HB1       GLN 127  -8.829 -12.075  -0.172
  934   1HG   GLN 127          HG2       GLN 127  -7.377 -11.142   1.513
  935   2HG   GLN 127          HG1       GLN 127  -7.943 -12.323   2.694
  936   1HE2  GLN 127          HE21      GLN 127  -7.240 -14.447   2.560
  937   2HE2  GLN 127          HE22      GLN 127  -5.886 -14.914   1.586
  938    H    GLY 128           HN       GLY 128 -12.111  -9.811   1.441
  939   1HA   GLY 128          HA2       GLY 128 -13.239 -10.676  -1.103
  940   2HA   GLY 128          HA1       GLY 128 -14.002  -9.593   0.058
  941    H    PHE 129           HN       PHE 129 -10.761  -9.463  -1.333
  942    HA   PHE 129           HA       PHE 129 -11.087  -6.620  -1.731
  943   1HB   PHE 129          HB2       PHE 129  -8.696  -6.633  -2.254
  944   2HB   PHE 129          HB1       PHE 129  -8.993  -7.560  -0.793
  945    HD1  PHE 129           HD1      PHE 129  -8.922 -10.048  -0.881
  946    HD2  PHE 129           HD2      PHE 129  -7.716  -7.624  -4.166
  947    HE1  PHE 129           HE1      PHE 129  -7.724 -11.964  -1.850
  948    HE2  PHE 129           HE2      PHE 129  -6.514  -9.539  -5.138
  949    HZ   PHE 129           HZ       PHE 129  -6.494 -11.699  -3.981
  950    H    THR 130           HN       THR 130 -10.866  -5.545  -3.740
  951    HA   THR 130           HA       THR 130 -10.597  -7.161  -6.154
  952    HB   THR 130           HB       THR 130 -12.920  -5.265  -5.745
  953    HG1  THR 130           HG1      THR 130 -12.643  -7.856  -5.144
  954   1HG2  THR 130          HG21      THR 130 -12.076  -5.246  -8.047
  955   2HG2  THR 130          HG22      THR 130 -13.658  -6.022  -7.954
  956   3HG2  THR 130          HG23      THR 130 -12.201  -7.004  -8.109
  957    HA   PRO 131           HA       PRO 131  -8.159  -3.516  -7.123
  958   1HB   PRO 131          HB2       PRO 131  -7.706  -4.821  -9.700
  959   2HB   PRO 131          HB1       PRO 131  -6.545  -4.452  -8.421
  960   1HG   PRO 131          HG2       PRO 131  -7.304  -6.979  -9.020
  961   2HG   PRO 131          HG1       PRO 131  -6.850  -6.479  -7.382
  962   1HD   PRO 131          HD2       PRO 131  -9.579  -6.863  -8.562
  963   2HD   PRO 131          HD1       PRO 131  -8.970  -7.327  -6.956
  964    H    SER 132           HN       SER 132  -9.278  -1.739  -7.669
  965    HA   SER 132           HA       SER 132 -10.581  -1.591 -10.251
  966   1HB   SER 132          HB2       SER 132 -12.718  -0.742  -9.154
  967   2HB   SER 132          HB1       SER 132 -12.409  -2.470  -8.993
  968    HG   SER 132           HG       SER 132 -12.125  -0.422  -7.068
  969    H    GLY 133           HN       GLY 133 -10.217   0.346 -11.121
  970   1HA   GLY 133          HA2       GLY 133 -10.439   2.785 -10.830
  971   2HA   GLY 133          HA1       GLY 133  -9.612   2.583  -9.293
  972    H    THR 134           HN       THR 134  -7.514   3.003  -9.271
  973    HA   THR 134           HA       THR 134  -6.001   2.699 -11.780
  974    HB   THR 134           HB       THR 134  -5.611   4.976  -9.834
  975    HG1  THR 134           HG1      THR 134  -7.505   4.634 -11.743
  976   1HG2  THR 134          HG21      THR 134  -4.322   5.965 -11.676
  977   2HG2  THR 134          HG22      THR 134  -4.609   4.521 -12.647
  978   3HG2  THR 134          HG23      THR 134  -3.646   4.415 -11.174
  979    H    THR 135           HN       THR 135  -4.056   1.713 -11.567
  980    HA   THR 135           HA       THR 135  -3.208   0.991  -8.856
  981    HB   THR 135           HB       THR 135  -3.531  -0.870 -10.464
  982    HG1  THR 135           HG1      THR 135  -1.797  -1.913  -9.715
  983   1HG2  THR 135          HG21      THR 135  -1.231   0.382 -11.971
  984   2HG2  THR 135          HG22      THR 135  -2.901   0.281 -12.528
  985   3HG2  THR 135          HG23      THR 135  -1.956  -1.191 -12.308
  986    H    GLY 136           HN       GLY 136  -1.162   1.499  -8.096
  987   1HA   GLY 136          HA2       GLY 136   0.388   3.341  -9.797
  988   2HA   GLY 136          HA1       GLY 136  -0.028   3.771  -8.143
  989    H    THR 137           HN       THR 137   2.371   2.655 -10.038
  990    HA   THR 137           HA       THR 137   3.524   0.704  -8.271
  991    HB   THR 137           HB       THR 137   4.987   2.257 -10.407
  992    HG1  THR 137           HG1      THR 137   3.206   1.440 -11.453
  993   1HG2  THR 137          HG21      THR 137   5.320  -0.553  -9.348
  994   2HG2  THR 137          HG22      THR 137   6.337   0.827  -8.934
  995   3HG2  THR 137          HG23      THR 137   6.315   0.212 -10.589
  996    H    THR 138           HN       THR 138   4.044   1.456  -6.271
  997    HA   THR 138           HA       THR 138   5.171   4.078  -5.910
  998    HB   THR 138           HB       THR 138   4.978   1.794  -3.930
  999    HG1  THR 138           HG1      THR 138   3.029   3.104  -5.028
 1000   1HG2  THR 138          HG21      THR 138   5.180   3.567  -2.239
 1001   2HG2  THR 138          HG22      THR 138   5.392   4.760  -3.523
 1002   3HG2  THR 138          HG23      THR 138   6.604   3.502  -3.278
 1003    H    LYS 139           HN       LYS 139   7.161   4.426  -6.620
 1004    HA   LYS 139           HA       LYS 139   9.100   2.239  -6.513
 1005   1HB   LYS 139          HB2       LYS 139   8.733   3.368  -8.669
 1006   2HB   LYS 139          HB1       LYS 139   9.227   4.889  -7.952
 1007   1HG   LYS 139          HG2       LYS 139  11.117   4.175  -9.088
 1008   2HG   LYS 139          HG1       LYS 139  11.433   3.709  -7.416
 1009   1HD   LYS 139          HD2       LYS 139  12.047   1.923  -8.961
 1010   2HD   LYS 139          HD1       LYS 139  10.712   1.426  -7.920
 1011   1HE   LYS 139          HE2       LYS 139   9.139   1.629  -9.651
 1012   2HE   LYS 139          HE1       LYS 139  10.232   2.591 -10.644
 1013   1HZ   LYS 139          HZ1       LYS 139   9.961   0.258 -11.393
 1014   2HZ   LYS 139          HZ2       LYS 139  10.708  -0.262  -9.961
 1015   3HZ   LYS 139          HZ3       LYS 139  11.567   0.689 -11.071
 1016    H    LEU 140           HN       LEU 140  10.248   2.129  -4.800
 1017    HA   LEU 140           HA       LEU 140  11.089   4.571  -3.426
 1018   1HB   LEU 140          HB2       LEU 140  10.118   3.188  -1.844
 1019   2HB   LEU 140          HB1       LEU 140  10.694   1.722  -2.610
 1020    HG   LEU 140           HG       LEU 140  12.965   2.211  -1.789
 1021   1HD1  LEU 140          HD11      LEU 140  12.838   4.622  -1.639
 1022   2HD1  LEU 140          HD12      LEU 140  13.279   3.930  -0.078
 1023   3HD1  LEU 140          HD13      LEU 140  11.634   4.497  -0.357
 1024   1HD2  LEU 140          HD21      LEU 140  10.844   2.169   0.349
 1025   2HD2  LEU 140          HD22      LEU 140  12.531   1.700   0.557
 1026   3HD2  LEU 140          HD23      LEU 140  11.480   0.766  -0.510
 1027    H    THR 141           HN       THR 141  12.783   5.213  -4.697
 1028    HA   THR 141           HA       THR 141  14.997   3.322  -5.062
 1029    HB   THR 141           HB       THR 141  14.668   6.036  -6.361
 1030    HG1  THR 141           HG1      THR 141  14.135   4.497  -8.225
 1031   1HG2  THR 141          HG21      THR 141  16.951   5.147  -6.348
 1032   2HG2  THR 141          HG22      THR 141  16.289   5.148  -7.983
 1033   3HG2  THR 141          HG23      THR 141  16.377   3.642  -7.068
 1034    H    VAL 142           HN       VAL 142  17.046   3.835  -4.230
 1035    HA   VAL 142           HA       VAL 142  17.053   6.031  -2.300
 1036    HB   VAL 142           HB       VAL 142  17.813   3.873  -1.471
 1037   1HG1  VAL 142          HG11      VAL 142  19.930   2.885  -2.264
 1038   2HG1  VAL 142          HG12      VAL 142  19.988   4.090  -3.552
 1039   3HG1  VAL 142          HG13      VAL 142  18.682   2.903  -3.511
 1040   1HG2  VAL 142          HG21      VAL 142  19.945   4.577  -0.488
 1041   2HG2  VAL 142          HG22      VAL 142  18.754   5.876  -0.472
 1042   3HG2  VAL 142          HG23      VAL 142  20.051   5.884  -1.666
 1043    H    THR 143           HN       THR 143  18.278   7.815  -2.504
 1044    HA   THR 143           HA       THR 143  20.300   7.946  -4.601
 1045    HB   THR 143           HB       THR 143  18.080   9.995  -4.350
 1046    HG1  THR 143           HG1      THR 143  18.129   7.676  -5.628
 1047   1HG2  THR 143          HG21      THR 143  20.219  10.985  -5.020
 1048   2HG2  THR 143          HG22      THR 143  19.075  10.988  -6.361
 1049   3HG2  THR 143          HG23      THR 143  20.372   9.794  -6.312
  Start of MODEL   12
    1    H    GLU   1           H        GLU   1 -18.054   4.802 -11.306
    2    HA   GLU   1           HA       GLU   1 -20.599   3.602 -12.231
    3   1HB   GLU   1          HB2       GLU   1 -17.764   2.555 -12.393
    4   2HB   GLU   1          HB1       GLU   1 -19.200   1.597 -12.726
    5   1HG   GLU   1          HG2       GLU   1 -19.765   3.059 -14.581
    6   2HG   GLU   1          HG1       GLU   1 -18.351   4.058 -14.238
    7    H    GLU   2           HN       GLU   2 -17.772   2.353 -10.547
    8    HA   GLU   2           HA       GLU   2 -19.491   1.623  -8.275
    9   1HB   GLU   2          HB2       GLU   2 -17.881  -0.258  -7.945
   10   2HB   GLU   2          HB1       GLU   2 -18.758  -0.346  -9.468
   11   1HG   GLU   2          HG2       GLU   2 -16.764   0.793 -10.517
   12   2HG   GLU   2          HG1       GLU   2 -15.908   0.470  -9.012
   13    H    CYS   3           HN       CYS   3 -17.579   0.926  -6.439
   14    HA   CYS   3           HA       CYS   3 -16.394   3.372  -5.612
   15   1HB   CYS   3          HB2       CYS   3 -16.997   1.608  -4.012
   16   2HB   CYS   3          HB1       CYS   3 -15.808   0.539  -4.741
   17    H    GLN   4           HN       GLN   4 -15.178   4.111  -7.320
   18    HA   GLN   4           HA       GLN   4 -13.016   2.444  -8.355
   19   1HB   GLN   4          HB2       GLN   4 -14.044   5.146  -9.229
   20   2HB   GLN   4          HB1       GLN   4 -12.811   4.208 -10.064
   21   1HG   GLN   4          HG2       GLN   4 -14.393   2.482 -10.573
   22   2HG   GLN   4          HG1       GLN   4 -15.623   3.267  -9.588
   23   1HE2  GLN   4          HE21      GLN   4 -13.873   3.333 -12.586
   24   2HE2  GLN   4          HE22      GLN   4 -14.904   4.476 -13.391
   25    H    VAL   5           HN       VAL   5 -11.029   2.630  -7.589
   26    HA   VAL   5           HA       VAL   5 -10.419   4.937  -5.891
   27    HB   VAL   5           HB       VAL   5  -8.959   2.303  -6.102
   28   1HG1  VAL   5          HG11      VAL   5  -7.531   4.111  -5.336
   29   2HG1  VAL   5          HG12      VAL   5  -7.879   2.995  -4.016
   30   3HG1  VAL   5          HG13      VAL   5  -8.714   4.546  -4.104
   31   1HG2  VAL   5          HG21      VAL   5 -11.213   1.995  -5.228
   32   2HG2  VAL   5          HG22      VAL   5 -10.932   3.257  -4.030
   33   3HG2  VAL   5          HG23      VAL   5 -10.013   1.754  -3.961
   34    H    ARG   6           HN       ARG   6  -9.339   6.504  -6.822
   35    HA   ARG   6           HA       ARG   6  -7.702   6.067  -9.150
   36   1HB   ARG   6          HB2       ARG   6  -8.982   8.122  -8.978
   37   2HB   ARG   6          HB1       ARG   6  -8.195   8.526  -7.461
   38   1HG   ARG   6          HG2       ARG   6  -6.124   8.930  -8.545
   39   2HG   ARG   6          HG1       ARG   6  -6.710   8.245 -10.060
   40   1HD   ARG   6          HD2       ARG   6  -7.737  10.751  -8.732
   41   2HD   ARG   6          HD1       ARG   6  -6.676  10.687 -10.139
   42    HE   ARG   6           HE       ARG   6  -8.713   9.281 -11.056
   43   1HH1  ARG   6          HH11      ARG   6  -8.703  12.283  -9.249
   44   2HH1  ARG   6          HH12      ARG   6 -10.218  12.831  -9.897
   45   1HH2  ARG   6          HH21      ARG   6 -10.726   9.985 -11.905
   46   2HH2  ARG   6          HH22      ARG   6 -11.373  11.525 -11.407
   47    H    VAL   7           HN       VAL   7  -5.825   5.083  -8.884
   48    HA   VAL   7           HA       VAL   7  -4.114   5.902  -6.625
   49    HB   VAL   7           HB       VAL   7  -3.964   3.299  -8.162
   50   1HG1  VAL   7          HG11      VAL   7  -2.464   2.598  -6.362
   51   2HG1  VAL   7          HG12      VAL   7  -2.600   4.194  -5.625
   52   3HG1  VAL   7          HG13      VAL   7  -1.837   4.013  -7.205
   53   1HG2  VAL   7          HG21      VAL   7  -6.029   3.396  -6.871
   54   2HG2  VAL   7          HG22      VAL   7  -5.116   3.831  -5.426
   55   3HG2  VAL   7          HG23      VAL   7  -4.899   2.242  -6.163
   56    H    GLY   8           HN       GLY   8  -2.381   7.039  -7.167
   57   1HA   GLY   8          HA2       GLY   8  -1.609   7.167  -9.986
   58   2HA   GLY   8          HA1       GLY   8  -1.145   8.307  -8.733
   59    H    ASP   9           HN       ASP   9   0.756   7.458 -10.417
   60    HA   ASP   9           HA       ASP   9   2.219   5.298  -9.086
   61   1HB   ASP   9          HB2       ASP   9   2.820   6.813 -11.635
   62   2HB   ASP   9          HB1       ASP   9   3.780   5.482 -11.000
   63    H    LEU  10           HN       LEU  10   3.755   5.733  -7.649
   64    HA   LEU  10           HA       LEU  10   4.691   8.511  -7.474
   65   1HB   LEU  10          HB2       LEU  10   4.542   6.356  -5.380
   66   2HB   LEU  10          HB1       LEU  10   5.302   7.914  -5.125
   67    HG   LEU  10           HG       LEU  10   2.378   7.381  -5.630
   68   1HD1  LEU  10          HD11      LEU  10   3.134   6.904  -3.370
   69   2HD1  LEU  10          HD12      LEU  10   2.110   8.341  -3.400
   70   3HD1  LEU  10          HD13      LEU  10   3.860   8.507  -3.263
   71   1HD2  LEU  10          HD21      LEU  10   2.988   9.420  -6.789
   72   2HD2  LEU  10          HD22      LEU  10   3.830  10.012  -5.358
   73   3HD2  LEU  10          HD23      LEU  10   2.079   9.811  -5.329
   74    H    THR  11           HN       THR  11   6.668   8.883  -8.170
   75    HA   THR  11           HA       THR  11   8.720   6.822  -7.673
   76    HB   THR  11           HB       THR  11   8.880   9.147  -9.611
   77    HG1  THR  11           HG1      THR  11   7.395   7.629 -10.399
   78   1HG2  THR  11          HG21      THR  11  10.673   6.746  -9.213
   79   2HG2  THR  11          HG22      THR  11  11.053   8.408  -8.761
   80   3HG2  THR  11          HG23      THR  11  10.864   7.977 -10.462
   81    H    VAL  12           HN       VAL  12   9.852   7.250  -5.895
   82    HA   VAL  12           HA       VAL  12  10.649  10.006  -5.314
   83    HB   VAL  12           HB       VAL  12   9.478   8.276  -3.131
   84   1HG1  VAL  12          HG11      VAL  12  11.037   9.987  -2.397
   85   2HG1  VAL  12          HG12      VAL  12   9.398  10.401  -1.894
   86   3HG1  VAL  12          HG13      VAL  12  10.130  11.220  -3.274
   87   1HG2  VAL  12          HG21      VAL  12   7.673   8.767  -4.687
   88   2HG2  VAL  12          HG22      VAL  12   8.076  10.483  -4.638
   89   3HG2  VAL  12          HG23      VAL  12   7.468   9.678  -3.190
   90    H    ALA  13           HN       ALA  13  12.542  10.149  -4.055
   91    HA   ALA  13           HA       ALA  13  13.992   7.598  -3.810
   92   1HB   ALA  13          HB1       ALA  13  15.116  10.361  -4.248
   93   2HB   ALA  13          HB2       ALA  13  14.930   9.118  -5.485
   94   3HB   ALA  13          HB3       ALA  13  16.043   8.866  -4.140
   95    H    LYS  14           HN       LYS  14  14.846   7.030  -1.907
   96    HA   LYS  14           HA       LYS  14  15.780   8.708   0.105
   97   1HB   LYS  14          HB2       LYS  14  14.090   8.526   1.840
   98   2HB   LYS  14          HB1       LYS  14  13.388   9.310   0.438
   99   1HG   LYS  14          HG2       LYS  14  12.362   7.163  -0.214
  100   2HG   LYS  14          HG1       LYS  14  13.027   6.433   1.249
  101   1HD   LYS  14          HD2       LYS  14  10.797   7.003   1.770
  102   2HD   LYS  14          HD1       LYS  14  11.802   8.234   2.540
  103   1HE   LYS  14          HE2       LYS  14  10.036   9.410   1.527
  104   2HE   LYS  14          HE1       LYS  14  11.425   9.631   0.459
  105   1HZ   LYS  14          HZ1       LYS  14   9.306   7.600   0.046
  106   2HZ   LYS  14          HZ2       LYS  14  10.572   7.977  -1.012
  107   3HZ   LYS  14          HZ3       LYS  14   9.348   9.108  -0.716
  108    H    THR  15           HN       THR  15  16.305   7.510   2.086
  109    HA   THR  15           HA       THR  15  16.850   4.730   1.507
  110    HB   THR  15           HB       THR  15  18.057   4.737   3.654
  111    HG1  THR  15           HG1      THR  15  18.247   6.981   4.609
  112   1HG2  THR  15          HG21      THR  15  18.691   7.117   1.908
  113   2HG2  THR  15          HG22      THR  15  19.265   5.467   1.670
  114   3HG2  THR  15          HG23      THR  15  19.793   6.391   3.077
  115    H    ARG  16           HN       ARG  16  16.284   3.033   3.076
  116    HA   ARG  16           HA       ARG  16  13.586   3.329   4.075
  117   1HB   ARG  16          HB2       ARG  16  15.526   1.018   4.312
  118   2HB   ARG  16          HB1       ARG  16  13.855   0.979   4.857
  119   1HG   ARG  16          HG2       ARG  16  13.652  -0.037   2.818
  120   2HG   ARG  16          HG1       ARG  16  13.339   1.640   2.379
  121   1HD   ARG  16          HD2       ARG  16  14.961   1.447   0.860
  122   2HD   ARG  16          HD1       ARG  16  16.099   1.374   2.202
  123    HE   ARG  16           HE       ARG  16  14.988  -0.933   0.746
  124   1HH1  ARG  16          HH11      ARG  16  17.371   0.514   2.838
  125   2HH1  ARG  16          HH12      ARG  16  18.359  -0.913   2.929
  126   1HH2  ARG  16          HH21      ARG  16  16.289  -2.865   0.909
  127   2HH2  ARG  16          HH22      ARG  16  17.750  -2.810   1.850
  128    H    GLY  17           HN       GLY  17  16.487   4.299   5.137
  129   1HA   GLY  17          HA2       GLY  17  15.953   3.840   7.972
  130   2HA   GLY  17          HA1       GLY  17  17.427   4.522   7.291
  131    H    GLN  18           HN       GLN  18  15.666   6.214   5.501
  132    HA   GLN  18           HA       GLN  18  15.319   8.498   7.169
  133   1HB   GLN  18          HB2       GLN  18  15.770   8.531   4.677
  134   2HB   GLN  18          HB1       GLN  18  14.110   8.003   4.436
  135   1HG   GLN  18          HG2       GLN  18  13.315  10.035   5.545
  136   2HG   GLN  18          HG1       GLN  18  14.981  10.562   5.750
  137   1HE2  GLN  18          HE21      GLN  18  12.363  10.163   3.551
  138   2HE2  GLN  18          HE22      GLN  18  13.075  11.010   2.219
  139    H    LEU  19           HN       LEU  19  13.430   5.808   6.214
  140    HA   LEU  19           HA       LEU  19  10.949   6.830   7.309
  141   1HB   LEU  19          HB2       LEU  19  11.648   4.010   6.486
  142   2HB   LEU  19          HB1       LEU  19  10.041   4.659   6.750
  143    HG   LEU  19           HG       LEU  19  11.890   5.528   4.525
  144   1HD1  LEU  19          HD11      LEU  19  10.394   4.267   3.057
  145   2HD1  LEU  19          HD12      LEU  19   9.504   3.681   4.464
  146   3HD1  LEU  19          HD13      LEU  19  11.190   3.215   4.227
  147   1HD2  LEU  19          HD21      LEU  19   9.917   6.641   3.633
  148   2HD2  LEU  19          HD22      LEU  19  10.291   7.243   5.249
  149   3HD2  LEU  19          HD23      LEU  19   8.968   6.101   5.018
  150    H    THR  20           HN       THR  20  10.615   6.812   9.440
  151    HA   THR  20           HA       THR  20  12.208   4.979  11.088
  152    HB   THR  20           HB       THR  20  11.802   6.679  12.924
  153    HG1  THR  20           HG1      THR  20  10.107   7.867  12.024
  154   1HG2  THR  20          HG21      THR  20  13.944   6.516  11.767
  155   2HG2  THR  20          HG22      THR  20  13.558   8.200  12.122
  156   3HG2  THR  20          HG23      THR  20  13.346   7.573  10.487
  157    H    ASP  21           HN       ASP  21  10.578   3.386  10.729
  158    HA   ASP  21           HA       ASP  21   8.770   2.135  11.225
  159   1HB   ASP  21          HB2       ASP  21   9.413   2.405  13.552
  160   2HB   ASP  21          HB1       ASP  21   8.577   3.954  13.632
  161    H    ALA  22           HN       ALA  22   7.435   5.094  12.605
  162    HA   ALA  22           HA       ALA  22   5.340   4.984  10.552
  163   1HB   ALA  22          HB1       ALA  22   4.543   4.674  12.860
  164   2HB   ALA  22          HB2       ALA  22   3.882   6.129  12.113
  165   3HB   ALA  22          HB3       ALA  22   5.195   6.257  13.284
  166    H    ALA  23           HN       ALA  23   6.629   6.108   9.077
  167    HA   ALA  23           HA       ALA  23   6.312   8.986   9.358
  168   1HB   ALA  23          HB1       ALA  23   8.946   7.730   8.571
  169   2HB   ALA  23          HB2       ALA  23   8.622   8.606  10.067
  170   3HB   ALA  23          HB3       ALA  23   8.570   9.453   8.521
  171    HA   PRO  24           HA       PRO  24   4.840   7.331   5.347
  172   1HB   PRO  24          HB2       PRO  24   2.792   9.075   5.077
  173   2HB   PRO  24          HB1       PRO  24   2.683   7.620   6.080
  174   1HG   PRO  24          HG2       PRO  24   3.274  10.439   6.920
  175   2HG   PRO  24          HG1       PRO  24   2.139   9.278   7.637
  176   1HD   PRO  24          HD2       PRO  24   4.579   9.691   8.689
  177   2HD   PRO  24          HD1       PRO  24   3.823   8.080   8.679
  178    H    ILE  25           HN       ILE  25   6.657   8.018   4.214
  179    HA   ILE  25           HA       ILE  25   6.588  10.818   3.298
  180    HB   ILE  25           HB       ILE  25   9.006   9.051   3.031
  181   1HG1  ILE  25          HG12      ILE  25   8.212  10.743   5.407
  182   2HG1  ILE  25          HG11      ILE  25   8.322   8.986   5.388
  183   1HG2  ILE  25          HG21      ILE  25  10.164  11.219   3.080
  184   2HG2  ILE  25          HG22      ILE  25   8.619  12.040   3.306
  185   3HG2  ILE  25          HG23      ILE  25   8.947  11.178   1.802
  186   1HD1  ILE  25          HD11      ILE  25  10.721   9.130   5.011
  187   2HD1  ILE  25          HD12      ILE  25  10.257  10.003   6.470
  188   3HD1  ILE  25          HD13      ILE  25  10.622  10.891   4.992
  189    H    GLY  26           HN       GLY  26   5.202   8.308   2.346
  190   1HA   GLY  26          HA2       GLY  26   5.600   9.073  -0.455
  191   2HA   GLY  26          HA1       GLY  26   5.521   7.362  -0.055
  192    HA   PRO  27           HA       PRO  27   1.109   8.989   1.224
  193   1HB   PRO  27          HB2       PRO  27   1.256  11.769   0.210
  194   2HB   PRO  27          HB1       PRO  27   0.453  11.126   1.648
  195   1HG   PRO  27          HG2       PRO  27   2.736  12.506   1.834
  196   2HG   PRO  27          HG1       PRO  27   2.399  11.124   2.894
  197   1HD   PRO  27          HD2       PRO  27   4.213  11.300   0.534
  198   2HD   PRO  27          HD1       PRO  27   4.389  10.370   2.028
  199    H    VAL  28           HN       VAL  28   0.096   7.854  -0.254
  200    HA   VAL  28           HA       VAL  28   0.140   8.599  -3.064
  201    HB   VAL  28           HB       VAL  28  -1.459   6.387  -1.758
  202   1HG1  VAL  28          HG11      VAL  28  -0.570   6.793  -4.611
  203   2HG1  VAL  28          HG12      VAL  28  -2.205   7.018  -3.990
  204   3HG1  VAL  28          HG13      VAL  28  -1.479   5.410  -3.999
  205   1HG2  VAL  28          HG21      VAL  28   1.315   6.246  -2.934
  206   2HG2  VAL  28          HG22      VAL  28   0.345   4.859  -2.439
  207   3HG2  VAL  28          HG23      VAL  28   0.882   6.033  -1.237
  208    H    THR  29           HN       THR  29  -1.431   9.769  -4.019
  209    HA   THR  29           HA       THR  29  -3.550  10.839  -2.423
  210    HB   THR  29           HB       THR  29  -4.222  11.839  -4.732
  211    HG1  THR  29           HG1      THR  29  -2.932  11.390  -6.352
  212   1HG2  THR  29          HG21      THR  29  -3.183  13.114  -2.921
  213   2HG2  THR  29          HG22      THR  29  -2.520  13.591  -4.483
  214   3HG2  THR  29          HG23      THR  29  -1.592  12.537  -3.416
  215    H    VAL  30           HN       VAL  30  -4.851   9.131  -1.846
  216    HA   VAL  30           HA       VAL  30  -5.944   7.382  -3.909
  217    HB   VAL  30           HB       VAL  30  -6.357   7.339  -0.915
  218   1HG1  VAL  30          HG11      VAL  30  -7.015   5.263  -3.001
  219   2HG1  VAL  30          HG12      VAL  30  -8.178   6.266  -2.136
  220   3HG1  VAL  30          HG13      VAL  30  -7.214   5.080  -1.258
  221   1HG2  VAL  30          HG21      VAL  30  -4.784   5.466  -0.910
  222   2HG2  VAL  30          HG22      VAL  30  -4.028   6.938  -1.521
  223   3HG2  VAL  30          HG23      VAL  30  -4.529   5.673  -2.643
  224    H    GLN  31           HN       GLN  31  -7.716   7.999  -4.908
  225    HA   GLN  31           HA       GLN  31  -9.717   9.536  -3.407
  226   1HB   GLN  31          HB2       GLN  31  -8.772  10.830  -5.238
  227   2HB   GLN  31          HB1       GLN  31  -9.152   9.543  -6.375
  228   1HG   GLN  31          HG2       GLN  31 -11.499   9.907  -6.100
  229   2HG   GLN  31          HG1       GLN  31 -11.213  11.049  -4.786
  230   1HE2  GLN  31          HE21      GLN  31 -12.605  11.392  -7.350
  231   2HE2  GLN  31          HE22      GLN  31 -11.821  12.722  -8.130
  232    H    ALA  32           HN       ALA  32 -11.356   8.325  -2.826
  233    HA   ALA  32           HA       ALA  32 -12.029   5.933  -4.364
  234   1HB   ALA  32          HB1       ALA  32 -13.347   5.292  -2.397
  235   2HB   ALA  32          HB2       ALA  32 -12.934   6.824  -1.627
  236   3HB   ALA  32          HB3       ALA  32 -11.672   5.642  -1.971
  237    H    LEU  33           HN       LEU  33 -13.325   6.437  -6.008
  238    HA   LEU  33           HA       LEU  33 -15.370   8.507  -5.674
  239   1HB   LEU  33          HB2       LEU  33 -13.625   8.164  -7.657
  240   2HB   LEU  33          HB1       LEU  33 -14.864   7.088  -8.251
  241    HG   LEU  33           HG       LEU  33 -15.401   9.983  -7.585
  242   1HD1  LEU  33          HD11      LEU  33 -15.246  10.421  -9.980
  243   2HD1  LEU  33          HD12      LEU  33 -14.737   8.754 -10.259
  244   3HD1  LEU  33          HD13      LEU  33 -13.707   9.850  -9.339
  245   1HD2  LEU  33          HD21      LEU  33 -17.367   9.650  -9.005
  246   2HD2  LEU  33          HD22      LEU  33 -17.372   8.541  -7.632
  247   3HD2  LEU  33          HD23      LEU  33 -16.917   7.959  -9.236
  248    H    GLY  34           HN       GLY  34 -17.417   7.953  -5.283
  249   1HA   GLY  34          HA2       GLY  34 -19.454   6.956  -5.668
  250   2HA   GLY  34          HA1       GLY  34 -18.691   6.006  -6.928
  251    H    CYS  35           HN       CYS  35 -17.471   5.875  -3.661
  252    HA   CYS  35           HA       CYS  35 -18.126   3.071  -3.528
  253   1HB   CYS  35          HB2       CYS  35 -16.921   4.803  -1.364
  254   2HB   CYS  35          HB1       CYS  35 -16.850   3.046  -1.485
  255    H    ASN  36           HN       ASN  36 -18.673   5.660  -1.157
  256    HA   ASN  36           HA       ASN  36 -20.447   6.358   0.021
  257   1HB   ASN  36          HB2       ASN  36 -21.942   4.861  -2.110
  258   2HB   ASN  36          HB1       ASN  36 -22.756   5.777  -0.847
  259   1HD2  ASN  36          HD21      ASN  36 -23.647   7.297  -2.213
  260   2HD2  ASN  36          HD22      ASN  36 -22.698   8.477  -3.061
  261    H    ALA  37           HN       ALA  37 -20.766   2.864  -0.674
  262    HA   ALA  37           HA       ALA  37 -21.410   2.492   2.174
  263   1HB   ALA  37          HB1       ALA  37 -23.187   0.924   1.629
  264   2HB   ALA  37          HB2       ALA  37 -22.915   1.192  -0.093
  265   3HB   ALA  37          HB3       ALA  37 -23.515   2.506   0.920
  266    H    ARG  38           HN       ARG  38 -18.954   2.017   0.618
  267    HA   ARG  38           HA       ARG  38 -18.692  -0.876   1.100
  268   1HB   ARG  38          HB2       ARG  38 -18.933  -0.247  -1.367
  269   2HB   ARG  38          HB1       ARG  38 -17.376   0.553  -1.209
  270   1HG   ARG  38          HG2       ARG  38 -16.916  -1.545  -2.144
  271   2HG   ARG  38          HG1       ARG  38 -16.454  -1.681  -0.447
  272   1HD   ARG  38          HD2       ARG  38 -19.144  -2.555  -1.476
  273   2HD   ARG  38          HD1       ARG  38 -17.749  -3.629  -1.463
  274    HE   ARG  38           HE       ARG  38 -17.781  -2.969   1.071
  275   1HH1  ARG  38          HH11      ARG  38 -20.497  -3.721  -1.015
  276   2HH1  ARG  38          HH12      ARG  38 -21.486  -4.317   0.291
  277   1HH2  ARG  38          HH21      ARG  38 -19.077  -3.767   2.776
  278   2HH2  ARG  38          HH22      ARG  38 -20.685  -4.332   2.433
  279    H    GLN  39           HN       GLN  39 -16.452  -1.545   1.528
  280    HA   GLN  39           HA       GLN  39 -14.830   0.563   2.704
  281   1HB   GLN  39          HB2       GLN  39 -13.340  -1.665   3.063
  282   2HB   GLN  39          HB1       GLN  39 -14.595  -1.147   4.179
  283   1HG   GLN  39          HG2       GLN  39 -15.349  -2.931   1.925
  284   2HG   GLN  39          HG1       GLN  39 -14.474  -3.615   3.295
  285   1HE2  GLN  39          HE21      GLN  39 -15.596  -1.815   5.222
  286   2HE2  GLN  39          HE22      GLN  39 -17.231  -2.318   5.482
  287    H    VAL  40           HN       VAL  40 -12.876   1.180   1.928
  288    HA   VAL  40           HA       VAL  40 -12.137   0.281  -0.746
  289    HB   VAL  40           HB       VAL  40 -10.968   2.515   0.934
  290   1HG1  VAL  40          HG11      VAL  40 -10.009   3.309  -1.179
  291   2HG1  VAL  40          HG12      VAL  40 -10.637   1.878  -1.995
  292   3HG1  VAL  40          HG13      VAL  40  -9.408   1.711  -0.739
  293   1HG2  VAL  40          HG21      VAL  40 -12.250   4.039  -0.484
  294   2HG2  VAL  40          HG22      VAL  40 -13.308   2.948   0.412
  295   3HG2  VAL  40          HG23      VAL  40 -12.991   2.660  -1.299
  296    H    ALA  41           HN       ALA  41 -10.227  -0.845  -1.136
  297    HA   ALA  41           HA       ALA  41  -8.647  -1.566   1.216
  298   1HB   ALA  41          HB1       ALA  41  -9.591  -3.427  -0.958
  299   2HB   ALA  41          HB2       ALA  41 -10.178  -3.389   0.707
  300   3HB   ALA  41          HB3       ALA  41  -8.508  -3.856   0.370
  301    H    LEU  42           HN       LEU  42  -6.521  -1.505   0.941
  302    HA   LEU  42           HA       LEU  42  -5.477  -0.939  -1.746
  303   1HB   LEU  42          HB2       LEU  42  -3.929  -0.738   0.824
  304   2HB   LEU  42          HB1       LEU  42  -3.644   0.099  -0.694
  305    HG   LEU  42           HG       LEU  42  -6.059   0.600   1.008
  306   1HD1  LEU  42          HD11      LEU  42  -4.900   2.606   1.828
  307   2HD1  LEU  42          HD12      LEU  42  -3.432   2.082   1.003
  308   3HD1  LEU  42          HD13      LEU  42  -4.088   1.126   2.332
  309   1HD2  LEU  42          HD21      LEU  42  -6.211   2.662  -0.274
  310   2HD2  LEU  42          HD22      LEU  42  -6.214   1.261  -1.348
  311   3HD2  LEU  42          HD23      LEU  42  -4.751   2.229  -1.165
  312    H    LYS  43           HN       LYS  43  -4.960  -2.790  -2.736
  313    HA   LYS  43           HA       LYS  43  -3.583  -4.868  -1.170
  314   1HB   LYS  43          HB2       LYS  43  -5.029  -5.160  -3.818
  315   2HB   LYS  43          HB1       LYS  43  -4.201  -6.442  -2.962
  316   1HG   LYS  43          HG2       LYS  43  -6.491  -6.764  -2.557
  317   2HG   LYS  43          HG1       LYS  43  -5.822  -6.094  -1.071
  318   1HD   LYS  43          HD2       LYS  43  -8.045  -5.149  -1.792
  319   2HD   LYS  43          HD1       LYS  43  -6.775  -3.959  -1.503
  320   1HE   LYS  43          HE2       LYS  43  -6.419  -3.640  -3.808
  321   2HE   LYS  43          HE1       LYS  43  -7.378  -5.060  -4.232
  322   1HZ   LYS  43          HZ1       LYS  43  -9.349  -3.883  -3.431
  323   2HZ   LYS  43          HZ2       LYS  43  -8.580  -3.015  -4.664
  324   3HZ   LYS  43          HZ3       LYS  43  -8.404  -2.530  -3.049
  325    H    ALA  44           HN       ALA  44  -1.496  -5.128  -1.582
  326    HA   ALA  44           HA       ALA  44  -0.218  -3.559  -3.593
  327   1HB   ALA  44          HB1       ALA  44   0.908  -3.988  -1.510
  328   2HB   ALA  44          HB2       ALA  44   1.835  -4.698  -2.831
  329   3HB   ALA  44          HB3       ALA  44   0.846  -5.726  -1.795
  330    H    ASP  45           HN       ASP  45   1.118  -4.419  -5.302
  331    HA   ASP  45           HA       ASP  45  -0.285  -6.374  -6.844
  332   1HB   ASP  45          HB2       ASP  45   0.850  -4.471  -7.901
  333   2HB   ASP  45          HB1       ASP  45   2.403  -5.063  -7.320
  334    H    THR  46           HN       THR  46   0.512  -8.406  -7.558
  335    HA   THR  46           HA       THR  46   1.368  -9.963  -5.392
  336    HB   THR  46           HB       THR  46  -0.102 -10.787  -7.195
  337    HG1  THR  46           HG1      THR  46   2.213 -12.159  -6.378
  338   1HG2  THR  46          HG21      THR  46   2.433 -10.875  -8.836
  339   2HG2  THR  46          HG22      THR  46   1.051  -9.818  -9.118
  340   3HG2  THR  46          HG23      THR  46   0.879 -11.562  -9.307
  341    H    ASP  47           HN       ASP  47   3.298  -8.114  -7.435
  342    HA   ASP  47           HA       ASP  47   5.581  -9.865  -7.425
  343   1HB   ASP  47          HB2       ASP  47   5.123  -8.035  -9.133
  344   2HB   ASP  47          HB1       ASP  47   5.609  -6.884  -7.892
  345    H    ASN  48           HN       ASN  48   4.248  -7.413  -5.369
  346    HA   ASN  48           HA       ASN  48   6.482  -7.790  -3.481
  347   1HB   ASN  48          HB2       ASN  48   6.202  -5.475  -2.724
  348   2HB   ASN  48          HB1       ASN  48   6.540  -5.488  -4.449
  349   1HD2  ASN  48          HD21      ASN  48   4.342  -4.639  -1.993
  350   2HD2  ASN  48          HD22      ASN  48   3.141  -3.917  -3.007
  351    H    PHE  49           HN       PHE  49   3.806  -9.058  -3.923
  352    HA   PHE  49           HA       PHE  49   2.676  -8.720  -1.230
  353   1HB   PHE  49          HB2       PHE  49   1.321  -7.348  -2.684
  354   2HB   PHE  49          HB1       PHE  49   1.197  -8.633  -3.863
  355    HD1  PHE  49           HD1      PHE  49   0.186  -7.627  -0.451
  356    HD2  PHE  49           HD2      PHE  49  -0.591 -10.133  -3.800
  357    HE1  PHE  49           HE1      PHE  49  -1.899  -8.389   0.609
  358    HE2  PHE  49           HE2      PHE  49  -2.682 -10.886  -2.751
  359    HZ   PHE  49           HZ       PHE  49  -3.508  -9.773  -0.736
  360    H    GLU  50           HN       GLU  50   3.029 -10.678  -0.375
  361    HA   GLU  50           HA       GLU  50   2.713 -13.047  -2.083
  362   1HB   GLU  50          HB2       GLU  50   4.075 -12.753   0.600
  363   2HB   GLU  50          HB1       GLU  50   3.993 -14.237  -0.341
  364   1HG   GLU  50          HG2       GLU  50   5.365 -11.686  -1.154
  365   2HG   GLU  50          HG1       GLU  50   6.145 -13.170  -0.606
  366    H    GLN  51           HN       GLN  51   0.572 -13.451  -2.041
  367    HA   GLN  51           HA       GLN  51  -1.371 -14.365  -1.338
  368   1HB   GLN  51          HB2       GLN  51  -0.031 -16.026  -0.163
  369   2HB   GLN  51          HB1       GLN  51   0.143 -14.946   1.213
  370   1HG   GLN  51          HG2       GLN  51  -1.517 -16.685   1.624
  371   2HG   GLN  51          HG1       GLN  51  -2.233 -15.075   1.656
  372   1HE2  GLN  51          HE21      GLN  51  -4.289 -15.822   1.224
  373   2HE2  GLN  51          HE22      GLN  51  -4.754 -16.419  -0.337
  374    H    GLY  52           HN       GLY  52   0.069 -12.491   1.317
  375   1HA   GLY  52          HA2       GLY  52  -1.972 -10.545   1.306
  376   2HA   GLY  52          HA1       GLY  52  -2.291 -11.722   2.580
  377    H    LYS  53           HN       LYS  53   0.886 -10.751   1.481
  378    HA   LYS  53           HA       LYS  53   1.208  -8.918   3.746
  379   1HB   LYS  53          HB2       LYS  53   3.362 -10.883   2.944
  380   2HB   LYS  53          HB1       LYS  53   3.340  -9.837   4.348
  381   1HG   LYS  53          HG2       LYS  53   1.302 -12.003   4.016
  382   2HG   LYS  53          HG1       LYS  53   2.906 -12.348   4.662
  383   1HD   LYS  53          HD2       LYS  53   1.122 -10.203   5.781
  384   2HD   LYS  53          HD1       LYS  53   1.087 -11.871   6.357
  385   1HE   LYS  53          HE2       LYS  53   3.571 -10.168   6.282
  386   2HE   LYS  53          HE1       LYS  53   2.533 -10.325   7.698
  387   1HZ   LYS  53          HZ1       LYS  53   4.500 -11.827   7.680
  388   2HZ   LYS  53          HZ2       LYS  53   3.822 -12.635   6.355
  389   3HZ   LYS  53          HZ3       LYS  53   3.016 -12.631   7.842
  390    H    PHE  54           HN       PHE  54   2.239  -7.044   3.065
  391    HA   PHE  54           HA       PHE  54   3.492  -7.198   0.422
  392   1HB   PHE  54          HB2       PHE  54   2.894  -4.736   0.181
  393   2HB   PHE  54          HB1       PHE  54   1.602  -5.908   0.011
  394    HD1  PHE  54           HD1      PHE  54  -0.346  -4.891   0.633
  395    HD2  PHE  54           HD2      PHE  54   3.106  -4.312   3.050
  396    HE1  PHE  54           HE1      PHE  54  -1.703  -3.617   2.251
  397    HE2  PHE  54           HE2      PHE  54   1.756  -3.051   4.676
  398    HZ   PHE  54           HZ       PHE  54  -0.646  -2.702   4.279
  399    H    PHE  55           HN       PHE  55   5.272  -6.029  -0.032
  400    HA   PHE  55           HA       PHE  55   6.657  -4.577   2.071
  401   1HB   PHE  55          HB2       PHE  55   8.746  -6.008   1.544
  402   2HB   PHE  55          HB1       PHE  55   7.546  -6.692   2.625
  403    HD1  PHE  55           HD1      PHE  55   8.856  -6.760  -0.823
  404    HD2  PHE  55           HD2      PHE  55   6.384  -8.680   2.060
  405    HE1  PHE  55           HE1      PHE  55   8.699  -8.736  -2.279
  406    HE2  PHE  55           HE2      PHE  55   6.219 -10.659   0.606
  407    HZ   PHE  55           HZ       PHE  55   7.356 -10.666  -1.594
  408    H    LEU  56           HN       LEU  56   8.915  -3.933   1.105
  409    HA   LEU  56           HA       LEU  56   8.529  -3.054  -1.647
  410   1HB   LEU  56          HB2       LEU  56  11.004  -2.689   0.045
  411   2HB   LEU  56          HB1       LEU  56  10.590  -1.834  -1.421
  412    HG   LEU  56           HG       LEU  56  10.090  -0.197   0.028
  413   1HD1  LEU  56          HD11      LEU  56   7.950  -0.688  -0.962
  414   2HD1  LEU  56          HD12      LEU  56   7.739  -0.141   0.703
  415   3HD1  LEU  56          HD13      LEU  56   7.601  -1.856   0.313
  416   1HD2  LEU  56          HD21      LEU  56   9.491  -0.510   2.366
  417   2HD2  LEU  56          HD22      LEU  56  10.963  -1.383   1.947
  418   3HD2  LEU  56          HD23      LEU  56   9.440  -2.254   2.122
  419    H    ILE  57           HN       ILE  57   9.168  -4.331  -3.303
  420    HA   ILE  57           HA       ILE  57  11.239  -6.332  -2.705
  421    HB   ILE  57           HB       ILE  57   9.147  -7.333  -3.492
  422   1HG1  ILE  57          HG12      ILE  57  10.082  -8.653  -5.374
  423   2HG1  ILE  57          HG11      ILE  57  11.404  -7.497  -5.498
  424   1HG2  ILE  57          HG21      ILE  57   8.354  -6.997  -5.784
  425   2HG2  ILE  57          HG22      ILE  57   9.562  -5.730  -6.008
  426   3HG2  ILE  57          HG23      ILE  57   8.268  -5.516  -4.829
  427   1HD1  ILE  57          HD11      ILE  57  10.795  -9.218  -3.108
  428   2HD1  ILE  57          HD12      ILE  57  12.133  -8.079  -3.253
  429   3HD1  ILE  57          HD13      ILE  57  12.066  -9.502  -4.293
  430    H    SER  58           HN       SER  58  13.188  -5.881  -3.410
  431    HA   SER  58           HA       SER  58  13.638  -3.620  -5.086
  432   1HB   SER  58          HB2       SER  58  15.189  -4.317  -3.240
  433   2HB   SER  58          HB1       SER  58  15.644  -5.716  -4.211
  434    HG   SER  58           HG       SER  58  15.822  -3.097  -5.261
  435    H    ASP  59           HN       ASP  59  14.408  -3.545  -7.171
  436    HA   ASP  59           HA       ASP  59  13.794  -5.674  -8.937
  437   1HB   ASP  59          HB2       ASP  59  15.563  -3.255  -9.398
  438   2HB   ASP  59          HB1       ASP  59  14.908  -4.298 -10.655
  439    H    ASN  60           HN       ASN  60  16.305  -5.205  -6.808
  440    HA   ASN  60           HA       ASN  60  18.215  -6.866  -8.268
  441   1HB   ASN  60          HB2       ASN  60  18.439  -5.629  -5.510
  442   2HB   ASN  60          HB1       ASN  60  19.736  -6.408  -6.409
  443   1HD2  ASN  60          HD21      ASN  60  17.786  -3.569  -6.070
  444   2HD2  ASN  60          HD22      ASN  60  18.686  -2.566  -7.168
  445    H    ASN  61           HN       ASN  61  15.547  -7.272  -6.435
  446    HA   ASN  61           HA       ASN  61  14.627  -8.839  -5.091
  447   1HB   ASN  61          HB2       ASN  61  14.647 -11.053  -5.992
  448   2HB   ASN  61          HB1       ASN  61  14.709  -9.917  -7.329
  449   1HD2  ASN  61          HD21      ASN  61  16.377 -12.390  -5.583
  450   2HD2  ASN  61          HD22      ASN  61  17.681 -12.599  -6.701
  451    H    ARG  62           HN       ARG  62  17.189  -7.861  -4.021
  452    HA   ARG  62           HA       ARG  62  18.372 -10.197  -2.782
  453   1HB   ARG  62          HB2       ARG  62  18.965  -7.253  -2.468
  454   2HB   ARG  62          HB1       ARG  62  19.841  -8.531  -1.636
  455   1HG   ARG  62          HG2       ARG  62  20.580  -9.437  -3.764
  456   2HG   ARG  62          HG1       ARG  62  19.670  -8.191  -4.620
  457   1HD   ARG  62          HD2       ARG  62  21.033  -6.466  -3.509
  458   2HD   ARG  62          HD1       ARG  62  21.971  -7.738  -2.726
  459    HE   ARG  62           HE       ARG  62  22.350  -8.439  -5.217
  460   1HH1  ARG  62          HH11      ARG  62  22.339  -5.228  -3.847
  461   2HH1  ARG  62          HH12      ARG  62  23.409  -4.562  -5.041
  462   1HH2  ARG  62          HH21      ARG  62  23.758  -7.598  -6.801
  463   2HH2  ARG  62          HH22      ARG  62  24.215  -5.916  -6.735
  464    H    ASP  63           HN       ASP  63  16.700  -7.260  -1.659
  465    HA   ASP  63           HA       ASP  63  16.039  -8.711   0.824
  466   1HB   ASP  63          HB2       ASP  63  16.580  -5.743   0.650
  467   2HB   ASP  63          HB1       ASP  63  16.373  -6.709   2.107
  468    H    LYS  64           HN       LYS  64  14.122  -7.959   1.916
  469    HA   LYS  64           HA       LYS  64  12.313  -6.254   0.408
  470   1HB   LYS  64          HB2       LYS  64  10.465  -7.863   0.505
  471   2HB   LYS  64          HB1       LYS  64  11.805  -8.496  -0.436
  472   1HG   LYS  64          HG2       LYS  64  11.330 -10.351   0.763
  473   2HG   LYS  64          HG1       LYS  64  12.421  -9.586   1.918
  474   1HD   LYS  64          HD2       LYS  64  10.501  -8.632   3.103
  475   2HD   LYS  64          HD1       LYS  64   9.410  -9.377   1.935
  476   1HE   LYS  64          HE2       LYS  64  11.278 -10.839   3.798
  477   2HE   LYS  64          HE1       LYS  64   9.536 -10.667   4.008
  478   1HZ   LYS  64          HZ1       LYS  64   9.974 -12.792   3.073
  479   2HZ   LYS  64          HZ2       LYS  64  10.945 -12.139   1.846
  480   3HZ   LYS  64          HZ3       LYS  64   9.276 -11.849   1.853
  481    H    LEU  65           HN       LEU  65  11.024  -5.039   1.730
  482    HA   LEU  65           HA       LEU  65  11.161  -5.613   4.613
  483   1HB   LEU  65          HB2       LEU  65  11.479  -2.881   3.363
  484   2HB   LEU  65          HB1       LEU  65  11.426  -3.219   5.074
  485    HG   LEU  65           HG       LEU  65  13.653  -2.838   4.650
  486   1HD1  LEU  65          HD11      LEU  65  13.317  -5.820   4.473
  487   2HD1  LEU  65          HD12      LEU  65  13.403  -4.850   5.943
  488   3HD1  LEU  65          HD13      LEU  65  14.814  -4.987   4.893
  489   1HD2  LEU  65          HD21      LEU  65  14.922  -3.792   2.777
  490   2HD2  LEU  65          HD22      LEU  65  13.585  -2.779   2.236
  491   3HD2  LEU  65          HD23      LEU  65  13.443  -4.535   2.171
  492    H    TYR  66           HN       TYR  66   9.251  -5.341   5.664
  493    HA   TYR  66           HA       TYR  66   6.920  -4.948   4.048
  494   1HB   TYR  66          HB2       TYR  66   7.168  -5.283   7.046
  495   2HB   TYR  66          HB1       TYR  66   5.673  -5.388   6.121
  496    HD1  TYR  66           HD1      TYR  66   8.936  -7.043   6.744
  497    HD2  TYR  66           HD2      TYR  66   5.067  -7.372   4.990
  498    HE1  TYR  66           HE1      TYR  66   9.296  -9.451   6.408
  499    HE2  TYR  66           HE2      TYR  66   5.416  -9.781   4.659
  500    HH   TYR  66           HH       TYR  66   7.229 -11.362   4.444
  501    H    VAL  67           HN       VAL  67   5.592  -3.241   3.952
  502    HA   VAL  67           HA       VAL  67   6.304  -0.847   5.513
  503    HB   VAL  67           HB       VAL  67   5.125   0.405   3.614
  504   1HG1  VAL  67          HG11      VAL  67   7.504   0.556   4.075
  505   2HG1  VAL  67          HG12      VAL  67   7.199   0.557   2.338
  506   3HG1  VAL  67          HG13      VAL  67   7.793  -0.904   3.128
  507   1HG2  VAL  67          HG21      VAL  67   5.778  -2.168   2.175
  508   2HG2  VAL  67          HG22      VAL  67   5.259  -0.666   1.413
  509   3HG2  VAL  67          HG23      VAL  67   4.163  -1.533   2.488
  510    H    ASN  68           HN       ASN  68   4.491   0.642   5.845
  511    HA   ASN  68           HA       ASN  68   1.904  -0.763   5.921
  512   1HB   ASN  68          HB2       ASN  68   2.978   1.307   7.856
  513   2HB   ASN  68          HB1       ASN  68   1.325   0.708   7.859
  514   1HD2  ASN  68          HD21      ASN  68   4.628   0.009   8.622
  515   2HD2  ASN  68          HD22      ASN  68   4.333  -1.440   9.515
  516    H    ILE  69           HN       ILE  69   0.796   0.009   4.246
  517    HA   ILE  69           HA       ILE  69   0.873   2.847   3.607
  518    HB   ILE  69           HB       ILE  69  -1.120   1.977   2.043
  519   1HG1  ILE  69          HG12      ILE  69   0.642  -0.450   2.337
  520   2HG1  ILE  69          HG11      ILE  69  -0.964  -0.315   3.044
  521   1HG2  ILE  69          HG21      ILE  69   1.797   1.517   1.456
  522   2HG2  ILE  69          HG22      ILE  69   0.937   3.049   1.289
  523   3HG2  ILE  69          HG23      ILE  69   0.507   1.679   0.262
  524   1HD1  ILE  69          HD11      ILE  69  -0.303  -0.224   0.108
  525   2HD1  ILE  69          HD12      ILE  69  -1.917  -0.074   0.804
  526   3HD1  ILE  69          HD13      ILE  69  -1.018  -1.583   0.975
  527    H    ARG  70           HN       ARG  70   0.047   3.708   5.490
  528    HA   ARG  70           HA       ARG  70  -2.734   2.970   6.112
  529   1HB   ARG  70          HB2       ARG  70  -0.958   2.371   7.796
  530   2HB   ARG  70          HB1       ARG  70  -0.653   4.086   7.991
  531   1HG   ARG  70          HG2       ARG  70  -2.863   4.430   8.881
  532   2HG   ARG  70          HG1       ARG  70  -3.286   2.744   8.563
  533   1HD   ARG  70          HD2       ARG  70  -1.451   2.052  10.075
  534   2HD   ARG  70          HD1       ARG  70  -1.164   3.746  10.456
  535    HE   ARG  70           HE       ARG  70  -3.690   3.574  11.173
  536   1HH1  ARG  70          HH11      ARG  70  -1.157   1.196  11.598
  537   2HH1  ARG  70          HH12      ARG  70  -1.752   0.636  13.129
  538   1HH2  ARG  70          HH21      ARG  70  -4.501   2.812  13.191
  539   2HH2  ARG  70          HH22      ARG  70  -3.656   1.545  14.032
  540    HA   PRO  71           HA       PRO  71  -4.061   7.024   4.901
  541   1HB   PRO  71          HB2       PRO  71  -5.551   6.743   7.482
  542   2HB   PRO  71          HB1       PRO  71  -6.117   7.298   5.908
  543   1HG   PRO  71          HG2       PRO  71  -6.654   4.831   6.751
  544   2HG   PRO  71          HG1       PRO  71  -6.283   5.161   5.049
  545   1HD   PRO  71          HD2       PRO  71  -4.630   3.838   7.120
  546   2HD   PRO  71          HD1       PRO  71  -4.605   3.645   5.356
  547    H    MET  72           HN       MET  72  -2.865   8.794   5.173
  548    HA   MET  72           HA       MET  72  -1.159   9.107   7.416
  549   1HB   MET  72          HB2       MET  72  -0.545   9.891   5.159
  550   2HB   MET  72          HB1       MET  72  -1.823  11.096   5.237
  551   1HG   MET  72          HG2       MET  72  -0.704  12.177   7.112
  552   2HG   MET  72          HG1       MET  72   0.566  10.956   7.063
  553   1HE   MET  72          HE1       MET  72   1.118  14.077   7.005
  554   2HE   MET  72          HE2       MET  72   2.357  14.191   5.755
  555   3HE   MET  72          HE3       MET  72   2.411  12.877   6.932
  556    H    ASP  73           HN       ASP  73  -2.478   9.174   9.198
  557    HA   ASP  73           HA       ASP  73  -3.817  10.021  10.815
  558   1HB   ASP  73          HB2       ASP  73  -1.903  11.591  10.902
  559   2HB   ASP  73          HB1       ASP  73  -2.753  12.658   9.789
  560    H    ASN  74           HN       ASN  74  -5.584   9.255   9.319
  561    HA   ASN  74           HA       ASN  74  -7.436  11.473   8.873
  562   1HB   ASN  74          HB2       ASN  74  -6.371   9.666   6.794
  563   2HB   ASN  74          HB1       ASN  74  -8.112   9.932   6.753
  564   1HD2  ASN  74          HD21      ASN  74  -4.988  11.316   6.245
  565   2HD2  ASN  74          HD22      ASN  74  -5.535  12.818   5.588
  566    H    SER  75           HN       SER  75  -7.140   7.915   8.750
  567    HA   SER  75           HA       SER  75  -9.516   7.687  10.405
  568   1HB   SER  75          HB2       SER  75  -9.391   6.278   7.729
  569   2HB   SER  75          HB1       SER  75 -10.738   6.298   8.867
  570    HG   SER  75           HG       SER  75 -10.525   8.736   8.485
  571    H    ALA  76           HN       ALA  76  -9.875   5.445  11.121
  572    HA   ALA  76           HA       ALA  76  -7.323   4.016  11.325
  573   1HB   ALA  76          HB1       ALA  76  -8.367   4.646  13.447
  574   2HB   ALA  76          HB2       ALA  76  -8.302   2.893  13.264
  575   3HB   ALA  76          HB3       ALA  76  -9.819   3.752  12.999
  576    H    TRP  77           HN       TRP  77  -7.425   3.022   9.306
  577    HA   TRP  77           HA       TRP  77  -9.646   1.376   8.536
  578   1HB   TRP  77          HB2       TRP  77  -6.856   1.725   7.430
  579   2HB   TRP  77          HB1       TRP  77  -8.014   0.594   6.744
  580    HD1  TRP  77           HD1      TRP  77  -9.157   4.103   7.855
  581    HE1  TRP  77           HE1      TRP  77  -9.851   5.429   5.742
  582    HE3  TRP  77           HE3      TRP  77  -7.593   0.802   4.286
  583    HZ2  TRP  77           HZ2      TRP  77  -9.724   5.097   2.940
  584    HZ3  TRP  77           HZ3      TRP  77  -7.912   1.372   1.922
  585    HH2  TRP  77           HH2      TRP  77  -8.952   3.479   1.261
  586    H    THR  78           HN       THR  78  -9.517  -0.948   8.231
  587    HA   THR  78           HA       THR  78  -8.286  -2.363  10.371
  588    HB   THR  78           HB       THR  78  -9.412  -3.529   7.810
  589    HG1  THR  78           HG1      THR  78 -10.663  -2.483  10.121
  590   1HG2  THR  78          HG21      THR  78  -9.895  -5.471   9.239
  591   2HG2  THR  78          HG22      THR  78  -9.126  -4.653  10.598
  592   3HG2  THR  78          HG23      THR  78  -8.170  -5.112   9.191
  593    H    THR  79           HN       THR  79  -6.215  -2.956  10.481
  594    HA   THR  79           HA       THR  79  -4.637  -2.587   8.052
  595    HB   THR  79           HB       THR  79  -3.919  -1.153   9.795
  596    HG1  THR  79           HG1      THR  79  -2.174  -3.384   9.502
  597   1HG2  THR  79          HG21      THR  79  -3.159  -1.966  11.999
  598   2HG2  THR  79          HG22      THR  79  -3.719  -3.584  11.574
  599   3HG2  THR  79          HG23      THR  79  -4.877  -2.263  11.726
  600    H    ASP  80           HN       ASP  80  -4.805  -4.509   7.030
  601    HA   ASP  80           HA       ASP  80  -3.549  -6.823   8.320
  602   1HB   ASP  80          HB2       ASP  80  -5.143  -6.437   5.802
  603   2HB   ASP  80          HB1       ASP  80  -4.047  -7.807   5.925
  604    H    ASN  81           HN       ASN  81  -1.741  -7.882   7.106
  605    HA   ASN  81           HA       ASN  81   0.124  -5.816   6.323
  606   1HB   ASN  81          HB2       ASN  81   0.573  -8.088   7.628
  607   2HB   ASN  81          HB1       ASN  81   0.776  -8.713   6.002
  608   1HD2  ASN  81          HD21      ASN  81   1.866  -6.156   5.008
  609   2HD2  ASN  81          HD22      ASN  81   3.483  -6.081   5.617
  610    H    GLY  82           HN       GLY  82  -2.222  -7.535   4.704
  611   1HA   GLY  82          HA2       GLY  82  -0.723  -7.303   2.170
  612   2HA   GLY  82          HA1       GLY  82  -1.932  -8.543   2.462
  613    H    VAL  83           HN       VAL  83  -3.818  -6.784   3.750
  614    HA   VAL  83           HA       VAL  83  -4.594  -5.119   1.457
  615    HB   VAL  83           HB       VAL  83  -6.955  -5.699   1.874
  616   1HG1  VAL  83          HG11      VAL  83  -5.198  -8.103   1.381
  617   2HG1  VAL  83          HG12      VAL  83  -5.720  -6.928   0.174
  618   3HG1  VAL  83          HG13      VAL  83  -6.908  -7.970   0.960
  619   1HG2  VAL  83          HG21      VAL  83  -5.847  -7.710   3.835
  620   2HG2  VAL  83          HG22      VAL  83  -7.529  -7.601   3.314
  621   3HG2  VAL  83          HG23      VAL  83  -6.804  -6.284   4.236
  622    H    PHE  84           HN       PHE  84  -5.870  -3.245   2.014
  623    HA   PHE  84           HA       PHE  84  -5.824  -2.611   4.876
  624   1HB   PHE  84          HB2       PHE  84  -3.955  -1.579   3.110
  625   2HB   PHE  84          HB1       PHE  84  -5.184  -0.319   3.176
  626    HD1  PHE  84           HD1      PHE  84  -5.775   0.707   5.359
  627    HD2  PHE  84           HD2      PHE  84  -2.495  -1.974   4.921
  628    HE1  PHE  84           HE1      PHE  84  -4.846   1.494   7.495
  629    HE2  PHE  84           HE2      PHE  84  -1.563  -1.188   7.058
  630    HZ   PHE  84           HZ       PHE  84  -2.742   0.547   8.350
  631    H    TYR  85           HN       TYR  85  -7.941  -2.489   5.245
  632    HA   TYR  85           HA       TYR  85  -9.514  -0.800   3.453
  633   1HB   TYR  85          HB2       TYR  85 -11.326  -2.407   3.340
  634   2HB   TYR  85          HB1       TYR  85  -9.848  -3.109   2.701
  635    HD1  TYR  85           HD1      TYR  85 -12.571  -3.562   4.935
  636    HD2  TYR  85           HD2      TYR  85  -8.490  -4.596   4.308
  637    HE1  TYR  85           HE1      TYR  85 -12.821  -5.462   6.480
  638    HE2  TYR  85           HE2      TYR  85  -8.735  -6.510   5.839
  639    HH   TYR  85           HH       TYR  85 -11.756  -7.626   6.941
  640    H    LYS  86           HN       LYS  86 -11.128   0.304   4.376
  641    HA   LYS  86           HA       LYS  86 -10.942   0.568   7.235
  642   1HB   LYS  86          HB2       LYS  86 -12.449   2.499   6.909
  643   2HB   LYS  86          HB1       LYS  86 -11.019   2.572   5.885
  644   1HG   LYS  86          HG2       LYS  86 -12.504   1.525   4.075
  645   2HG   LYS  86          HG1       LYS  86 -13.852   1.989   5.115
  646   1HD   LYS  86          HD2       LYS  86 -12.945   4.322   5.098
  647   2HD   LYS  86          HD1       LYS  86 -11.786   3.794   3.876
  648   1HE   LYS  86          HE2       LYS  86 -13.586   4.769   2.697
  649   2HE   LYS  86          HE1       LYS  86 -13.763   3.023   2.507
  650   1HZ   LYS  86          HZ1       LYS  86 -15.382   3.075   4.344
  651   2HZ   LYS  86          HZ2       LYS  86 -15.872   3.984   3.001
  652   3HZ   LYS  86          HZ3       LYS  86 -15.272   4.771   4.379
  653    H    ASN  87           HN       ASN  87 -12.457   0.098   8.720
  654    HA   ASN  87           HA       ASN  87 -14.464  -1.836   8.150
  655   1HB   ASN  87          HB2       ASN  87 -13.281  -1.553  10.349
  656   2HB   ASN  87          HB1       ASN  87 -14.169  -0.056  10.590
  657   1HD2  ASN  87          HD21      ASN  87 -14.075  -2.605  12.094
  658   2HD2  ASN  87          HD22      ASN  87 -15.726  -3.105  12.244
  659    H    ASP  88           HN       ASP  88 -14.348   1.621   8.560
  660    HA   ASP  88           HA       ASP  88 -17.054   2.297   8.473
  661   1HB   ASP  88          HB2       ASP  88 -14.718   3.789   7.232
  662   2HB   ASP  88          HB1       ASP  88 -16.303   4.468   7.570
  663    H    VAL  89           HN       VAL  89 -18.554   1.945   6.907
  664    HA   VAL  89           HA       VAL  89 -17.637   1.365   4.200
  665    HB   VAL  89           HB       VAL  89 -20.019   0.959   3.659
  666   1HG1  VAL  89          HG11      VAL  89 -18.631  -0.881   4.416
  667   2HG1  VAL  89          HG12      VAL  89 -20.282  -1.073   5.005
  668   3HG1  VAL  89          HG13      VAL  89 -19.016  -0.507   6.096
  669   1HG2  VAL  89          HG21      VAL  89 -21.682   0.875   5.463
  670   2HG2  VAL  89          HG22      VAL  89 -21.068   2.508   5.206
  671   3HG2  VAL  89          HG23      VAL  89 -20.496   1.556   6.577
  672    H    GLY  90           HN       GLY  90 -17.698   2.754   2.533
  673   1HA   GLY  90          HA2       GLY  90 -19.251   4.743   1.766
  674   2HA   GLY  90          HA1       GLY  90 -18.491   5.503   3.159
  675    H    SER  91           HN       SER  91 -17.788   7.035   1.427
  676    HA   SER  91           HA       SER  91 -15.647   6.135  -0.287
  677   1HB   SER  91          HB2       SER  91 -15.474   8.596  -0.811
  678   2HB   SER  91          HB1       SER  91 -17.067   7.905  -1.114
  679    HG   SER  91           HG       SER  91 -16.285   9.825   0.697
  680    H    TRP  92           HN       TRP  92 -13.700   7.976  -0.113
  681    HA   TRP  92           HA       TRP  92 -13.004   8.516   2.632
  682   1HB   TRP  92          HB2       TRP  92 -12.251   6.137   2.220
  683   2HB   TRP  92          HB1       TRP  92 -11.096   6.806   1.057
  684    HD1  TRP  92           HD1      TRP  92 -12.007   7.142   4.804
  685    HE1  TRP  92           HE1      TRP  92  -9.890   7.877   6.073
  686    HE3  TRP  92           HE3      TRP  92  -8.871   7.641   0.828
  687    HZ2  TRP  92           HZ2      TRP  92  -7.230   8.580   5.425
  688    HZ3  TRP  92           HZ3      TRP  92  -6.577   8.351   1.226
  689    HH2  TRP  92           HH2      TRP  92  -5.751   8.802   3.480
  690    H    GLY  93           HN       GLY  93 -11.496   8.220  -0.544
  691   1HA   GLY  93          HA2       GLY  93 -10.069   9.641  -1.689
  692   2HA   GLY  93          HA1       GLY  93 -11.398  10.746  -1.445
  693    H    GLY  94           HN       GLY  94  -8.226   9.788  -0.383
  694   1HA   GLY  94          HA2       GLY  94  -7.669  12.452   0.523
  695   2HA   GLY  94          HA1       GLY  94  -7.754  11.294   1.844
  696    H    THR  95           HN       THR  95  -5.640  11.181   2.428
  697    HA   THR  95           HA       THR  95  -3.813  10.126   0.391
  698    HB   THR  95           HB       THR  95  -2.011  11.423   1.773
  699    HG1  THR  95           HG1      THR  95  -2.801  12.829   3.145
  700   1HG2  THR  95          HG21      THR  95  -3.873  12.776  -0.183
  701   2HG2  THR  95          HG22      THR  95  -2.444  11.824  -0.582
  702   3HG2  THR  95          HG23      THR  95  -2.271  13.363   0.262
  703    H    ILE  96           HN       ILE  96  -3.000   8.257   0.928
  704    HA   ILE  96           HA       ILE  96  -2.729   7.496   3.756
  705    HB   ILE  96           HB       ILE  96  -2.215   5.230   2.868
  706   1HG1  ILE  96          HG12      ILE  96  -3.002   6.368   0.189
  707   2HG1  ILE  96          HG11      ILE  96  -1.329   6.125   0.680
  708   1HG2  ILE  96          HG21      ILE  96  -4.504   5.766   3.483
  709   2HG2  ILE  96          HG22      ILE  96  -4.486   4.702   2.077
  710   3HG2  ILE  96          HG23      ILE  96  -4.804   6.424   1.873
  711   1HD1  ILE  96          HD11      ILE  96  -3.419   3.973   0.432
  712   2HD1  ILE  96          HD12      ILE  96  -1.726   3.735   0.873
  713   3HD1  ILE  96          HD13      ILE  96  -2.145   4.318  -0.739
  714    H    GLY  97           HN       GLY  97  -0.594   6.428   4.333
  715   1HA   GLY  97          HA2       GLY  97   1.568   7.635   2.722
  716   2HA   GLY  97          HA1       GLY  97   1.552   7.753   4.472
  717    H    ILE  98           HN       ILE  98   3.503   6.547   2.583
  718    HA   ILE  98           HA       ILE  98   3.467   3.765   3.468
  719    HB   ILE  98           HB       ILE  98   5.055   5.212   1.349
  720   1HG1  ILE  98          HG12      ILE  98   3.262   2.815   1.201
  721   2HG1  ILE  98          HG11      ILE  98   2.696   4.450   0.921
  722   1HG2  ILE  98          HG21      ILE  98   6.577   3.676   2.466
  723   2HG2  ILE  98          HG22      ILE  98   6.155   3.069   0.864
  724   3HG2  ILE  98          HG23      ILE  98   5.405   2.368   2.298
  725   1HD1  ILE  98          HD11      ILE  98   4.196   4.652  -0.986
  726   2HD1  ILE  98          HD12      ILE  98   3.125   3.261  -1.167
  727   3HD1  ILE  98          HD13      ILE  98   4.805   3.023  -0.690
  728    H    TYR  99           HN       TYR  99   4.539   3.291   5.244
  729    HA   TYR  99           HA       TYR  99   7.203   4.417   5.573
  730   1HB   TYR  99          HB2       TYR  99   6.686   4.323   8.140
  731   2HB   TYR  99          HB1       TYR  99   6.279   5.741   7.190
  732    HD1  TYR  99           HD1      TYR  99   5.059   3.207   9.392
  733    HD2  TYR  99           HD2      TYR  99   3.859   5.992   6.416
  734    HE1  TYR  99           HE1      TYR  99   2.767   3.150  10.271
  735    HE2  TYR  99           HE2      TYR  99   1.561   5.934   7.272
  736    HH   TYR  99           HH       TYR  99   0.772   4.773  10.275
  737    H    VAL 100           HN       VAL 100   8.574   3.125   6.987
  738    HA   VAL 100           HA       VAL 100   8.201   0.379   6.131
  739    HB   VAL 100           HB       VAL 100  10.335   1.558   5.702
  740   1HG1  VAL 100          HG11      VAL 100  10.503   2.898   7.709
  741   2HG1  VAL 100          HG12      VAL 100  11.929   1.868   7.551
  742   3HG1  VAL 100          HG13      VAL 100  10.658   1.442   8.695
  743   1HG2  VAL 100          HG21      VAL 100  10.562  -0.860   7.488
  744   2HG2  VAL 100          HG22      VAL 100  11.801  -0.281   6.375
  745   3HG2  VAL 100          HG23      VAL 100  10.261  -0.872   5.751
  746    H    ASP 101           HN       ASP 101   7.974  -1.348   7.422
  747    HA   ASP 101           HA       ASP 101   6.805  -0.939   9.961
  748   1HB   ASP 101          HB2       ASP 101   6.197  -2.800   8.467
  749   2HB   ASP 101          HB1       ASP 101   7.791  -3.509   8.701
  750    H    GLY 102           HN       GLY 102   8.082  -0.085  11.505
  751   1HA   GLY 102          HA2       GLY 102   9.467  -0.208  13.330
  752   2HA   GLY 102          HA1       GLY 102   9.796  -1.876  12.896
  753    H    GLN 103           HN       GLN 103  10.402   0.915  10.842
  754    HA   GLN 103           HA       GLN 103  12.267   1.432   9.638
  755   1HB   GLN 103          HB2       GLN 103  14.050   2.442  11.028
  756   2HB   GLN 103          HB1       GLN 103  12.430   2.992  11.417
  757   1HG   GLN 103          HG2       GLN 103  12.413   1.495  13.366
  758   2HG   GLN 103          HG1       GLN 103  14.062   1.002  12.981
  759   1HE2  GLN 103          HE21      GLN 103  14.788   3.709  12.101
  760   2HE2  GLN 103          HE22      GLN 103  14.972   4.640  13.543
  761    H    GLN 104           HN       GLN 104  13.089  -0.095   8.409
  762    HA   GLN 104           HA       GLN 104  14.306  -2.443   9.536
  763   1HB   GLN 104          HB2       GLN 104  13.649  -1.574   6.732
  764   2HB   GLN 104          HB1       GLN 104  14.507  -3.073   7.059
  765   1HG   GLN 104          HG2       GLN 104  11.784  -2.356   8.129
  766   2HG   GLN 104          HG1       GLN 104  12.093  -3.399   6.743
  767   1HE2  GLN 104          HE21      GLN 104  14.422  -4.666   7.949
  768   2HE2  GLN 104          HE22      GLN 104  13.809  -5.724   9.174
  769    H    THR 105           HN       THR 105  15.569   0.398   9.407
  770    HA   THR 105           HA       THR 105  17.700   0.999   9.909
  771    HB   THR 105           HB       THR 105  18.640  -1.734   9.058
  772    HG1  THR 105           HG1      THR 105  17.079  -0.986  11.183
  773   1HG2  THR 105          HG21      THR 105  19.744   0.288  11.008
  774   2HG2  THR 105          HG22      THR 105  20.370  -0.026   9.389
  775   3HG2  THR 105          HG23      THR 105  20.457  -1.279  10.627
  776    H    ASN 106           HN       ASN 106  17.054  -0.577   6.897
  777    HA   ASN 106           HA       ASN 106  17.461   0.049   4.767
  778   1HB   ASN 106          HB2       ASN 106  17.365   2.395   5.435
  779   2HB   ASN 106          HB1       ASN 106  19.052   2.335   5.934
  780   1HD2  ASN 106          HD21      ASN 106  20.623   2.580   4.426
  781   2HD2  ASN 106          HD22      ASN 106  20.318   2.860   2.741
  782    H    THR 107           HN       THR 107  18.485  -1.898   4.637
  783    HA   THR 107           HA       THR 107  21.401  -1.975   4.739
  784    HB   THR 107           HB       THR 107  19.432  -4.157   3.989
  785    HG1  THR 107           HG1      THR 107  20.437  -3.253   6.482
  786   1HG2  THR 107          HG21      THR 107  21.724  -4.626   3.267
  787   2HG2  THR 107          HG22      THR 107  21.247  -5.693   4.587
  788   3HG2  THR 107          HG23      THR 107  22.309  -4.321   4.902
  789    HA   PRO 108           HA       PRO 108  22.659  -0.706   0.738
  790   1HB   PRO 108          HB2       PRO 108  23.262  -3.616   0.371
  791   2HB   PRO 108          HB1       PRO 108  24.243  -2.207  -0.042
  792   1HG   PRO 108          HG2       PRO 108  24.473  -3.690   2.299
  793   2HG   PRO 108          HG1       PRO 108  25.091  -2.048   2.060
  794   1HD   PRO 108          HD2       PRO 108  23.049  -2.851   3.852
  795   2HD   PRO 108          HD1       PRO 108  23.502  -1.186   3.433
  796    HA   PRO 109           HA       PRO 109  18.987  -2.129  -1.554
  797   1HB   PRO 109          HB2       PRO 109  17.947   0.452  -1.674
  798   2HB   PRO 109          HB1       PRO 109  17.530  -0.777  -0.481
  799   1HG   PRO 109          HG2       PRO 109  18.865   1.657   0.010
  800   2HG   PRO 109          HG1       PRO 109  18.661   0.314   1.138
  801   1HD   PRO 109          HD2       PRO 109  20.997   1.008  -0.575
  802   2HD   PRO 109          HD1       PRO 109  20.936   0.271   1.046
  803    H    GLY 110           HN       GLY 110  17.819  -0.332  -3.234
  804   1HA   GLY 110          HA2       GLY 110  19.553   1.095  -4.950
  805   2HA   GLY 110          HA1       GLY 110  19.189  -0.492  -5.628
  806    H    ASN 111           HN       ASN 111  17.349  -0.700  -6.762
  807    HA   ASN 111           HA       ASN 111  15.252   1.318  -6.366
  808   1HB   ASN 111          HB2       ASN 111  15.551  -0.741  -8.570
  809   2HB   ASN 111          HB1       ASN 111  14.260   0.447  -8.457
  810   1HD2  ASN 111          HD21      ASN 111  14.769   2.657  -8.779
  811   2HD2  ASN 111          HD22      ASN 111  16.190   3.124  -9.651
  812    H    TYR 112           HN       TYR 112  13.413   0.819  -5.367
  813    HA   TYR 112           HA       TYR 112  12.848  -2.016  -4.836
  814   1HB   TYR 112          HB2       TYR 112  12.868   0.356  -3.062
  815   2HB   TYR 112          HB1       TYR 112  11.541  -0.768  -2.812
  816    HD1  TYR 112           HD1      TYR 112  12.067  -3.168  -2.269
  817    HD2  TYR 112           HD2      TYR 112  15.046  -0.144  -2.365
  818    HE1  TYR 112           HE1      TYR 112  13.546  -4.588  -0.933
  819    HE2  TYR 112           HE2      TYR 112  16.543  -1.565  -1.039
  820    HH   TYR 112           HH       TYR 112  16.327  -3.452   0.572
  821    H    THR 113           HN       THR 113  11.070  -2.750  -5.714
  822    HA   THR 113           HA       THR 113   9.143  -0.851  -6.816
  823    HB   THR 113           HB       THR 113   9.506  -3.807  -7.334
  824    HG1  THR 113           HG1      THR 113  10.848  -3.214  -8.876
  825   1HG2  THR 113          HG21      THR 113   8.028  -3.435  -9.266
  826   2HG2  THR 113          HG22      THR 113   7.778  -1.769  -8.745
  827   3HG2  THR 113          HG23      THR 113   7.203  -3.102  -7.745
  828    H    LEU 114           HN       LEU 114   7.118  -0.701  -6.093
  829    HA   LEU 114           HA       LEU 114   5.851  -2.904  -4.729
  830   1HB   LEU 114          HB2       LEU 114   5.133  -1.429  -2.815
  831   2HB   LEU 114          HB1       LEU 114   6.816  -1.919  -2.801
  832    HG   LEU 114           HG       LEU 114   6.208   0.671  -4.080
  833   1HD1  LEU 114          HD11      LEU 114   6.109   0.279  -1.091
  834   2HD1  LEU 114          HD12      LEU 114   4.764   0.770  -2.121
  835   3HD1  LEU 114          HD13      LEU 114   6.156   1.835  -1.918
  836   1HD2  LEU 114          HD21      LEU 114   8.353  -0.256  -2.180
  837   2HD2  LEU 114          HD22      LEU 114   8.298   1.310  -2.990
  838   3HD2  LEU 114          HD23      LEU 114   8.488  -0.168  -3.935
  839    H    THR 115           HN       THR 115   4.368  -2.984  -6.334
  840    HA   THR 115           HA       THR 115   2.999  -0.588  -7.210
  841    HB   THR 115           HB       THR 115   2.395  -3.450  -7.979
  842    HG1  THR 115           HG1      THR 115   4.224  -3.420  -9.030
  843   1HG2  THR 115          HG21      THR 115   0.671  -1.827  -8.602
  844   2HG2  THR 115          HG22      THR 115   1.513  -2.429 -10.031
  845   3HG2  THR 115          HG23      THR 115   1.889  -0.827  -9.395
  846    H    LEU 116           HN       LEU 116   0.894  -0.062  -6.756
  847    HA   LEU 116           HA       LEU 116  -0.445  -1.700  -4.701
  848   1HB   LEU 116          HB2       LEU 116  -0.467   1.288  -5.087
  849   2HB   LEU 116          HB1       LEU 116  -1.456   0.434  -3.917
  850    HG   LEU 116           HG       LEU 116   1.563   0.539  -3.924
  851   1HD1  LEU 116          HD11      LEU 116  -0.462   1.881  -2.138
  852   2HD1  LEU 116          HD12      LEU 116   0.570   2.677  -3.326
  853   3HD1  LEU 116          HD13      LEU 116   1.287   1.905  -1.912
  854   1HD2  LEU 116          HD21      LEU 116  -0.352  -0.648  -1.920
  855   2HD2  LEU 116          HD22      LEU 116   1.402  -0.560  -1.757
  856   3HD2  LEU 116          HD23      LEU 116   0.682  -1.559  -3.020
  857    H    THR 117           HN       THR 117  -2.261  -2.601  -5.388
  858    HA   THR 117           HA       THR 117  -3.644  -1.459  -7.704
  859    HB   THR 117           HB       THR 117  -4.046  -4.146  -6.365
  860    HG1  THR 117           HG1      THR 117  -2.331  -3.236  -8.397
  861   1HG2  THR 117          HG21      THR 117  -6.011  -3.334  -7.611
  862   2HG2  THR 117          HG22      THR 117  -5.271  -4.732  -8.394
  863   3HG2  THR 117          HG23      THR 117  -5.001  -3.114  -9.042
  864    H    GLY 118           HN       GLY 118  -5.408  -0.275  -7.401
  865   1HA   GLY 118          HA2       GLY 118  -6.536  -0.003  -4.765
  866   2HA   GLY 118          HA1       GLY 118  -7.007   0.891  -6.202
  867    H    GLY 119           HN       GLY 119  -9.179   0.574  -5.433
  868   1HA   GLY 119          HA2       GLY 119 -11.101  -0.511  -6.441
  869   2HA   GLY 119          HA1       GLY 119 -10.233  -2.035  -6.294
  870    H    TYR 120           HN       TYR 120 -12.781  -1.863  -5.311
  871    HA   TYR 120           HA       TYR 120 -12.531  -1.227  -2.495
  872   1HB   TYR 120          HB2       TYR 120 -14.939  -1.638  -2.332
  873   2HB   TYR 120          HB1       TYR 120 -14.549  -0.459  -3.569
  874    HD1  TYR 120           HD1      TYR 120 -15.798  -3.840  -2.928
  875    HD2  TYR 120           HD2      TYR 120 -15.030  -0.899  -5.923
  876    HE1  TYR 120           HE1      TYR 120 -17.104  -5.154  -4.540
  877    HE2  TYR 120           HE2      TYR 120 -16.344  -2.214  -7.539
  878    HH   TYR 120           HH       TYR 120 -18.358  -4.814  -6.596
  879    H    TRP 121           HN       TRP 121 -13.922  -2.835  -1.116
  880    HA   TRP 121           HA       TRP 121 -12.775  -5.516  -1.513
  881   1HB   TRP 121          HB2       TRP 121 -11.301  -4.504   0.014
  882   2HB   TRP 121          HB1       TRP 121 -12.589  -3.633   0.833
  883    HD1  TRP 121           HD1      TRP 121 -14.250  -5.213   2.332
  884    HE1  TRP 121           HE1      TRP 121 -13.673  -7.219   3.821
  885    HE3  TRP 121           HE3      TRP 121  -9.734  -6.425   0.294
  886    HZ2  TRP 121           HZ2      TRP 121 -11.581  -9.059   4.088
  887    HZ3  TRP 121           HZ3      TRP 121  -8.521  -8.348   1.244
  888    HH2  TRP 121           HH2      TRP 121  -9.425  -9.626   3.091
  889    H    ALA 122           HN       ALA 122 -13.946  -7.206  -0.521
  890    HA   ALA 122           HA       ALA 122 -16.606  -6.536   0.522
  891   1HB   ALA 122          HB1       ALA 122 -16.855  -7.217  -1.814
  892   2HB   ALA 122          HB2       ALA 122 -17.570  -8.408  -0.726
  893   3HB   ALA 122          HB3       ALA 122 -16.002  -8.722  -1.471
  894    H    LYS 123           HN       LYS 123 -17.451  -8.082   2.000
  895    HA   LYS 123           HA       LYS 123 -17.378  -9.465   3.794
  896   1HB   LYS 123          HB2       LYS 123 -16.036 -10.871   1.716
  897   2HB   LYS 123          HB1       LYS 123 -15.159 -11.162   3.212
  898   1HG   LYS 123          HG2       LYS 123 -18.109 -11.618   2.784
  899   2HG   LYS 123          HG1       LYS 123 -16.863 -12.866   2.826
  900   1HD   LYS 123          HD2       LYS 123 -16.373 -12.373   5.131
  901   2HD   LYS 123          HD1       LYS 123 -17.463 -10.988   5.111
  902   1HE   LYS 123          HE2       LYS 123 -19.353 -12.506   4.702
  903   2HE   LYS 123          HE1       LYS 123 -18.252 -13.879   4.759
  904   1HZ   LYS 123          HZ1       LYS 123 -19.448 -13.509   6.857
  905   2HZ   LYS 123          HZ2       LYS 123 -18.711 -11.992   7.007
  906   3HZ   LYS 123          HZ3       LYS 123 -17.764 -13.401   7.045
  907    H    ASP 124           HN       ASP 124 -14.850 -10.801   4.748
  908    HA   ASP 124           HA       ASP 124 -13.074  -8.586   5.298
  909   1HB   ASP 124          HB2       ASP 124 -13.162  -8.775   7.714
  910   2HB   ASP 124          HB1       ASP 124 -14.768  -8.412   7.097
  911    H    ASN 125           HN       ASN 125 -11.075  -9.159   5.548
  912    HA   ASN 125           HA       ASN 125  -9.165 -10.302   5.433
  913   1HB   ASN 125          HB2       ASN 125  -8.617 -11.361   7.330
  914   2HB   ASN 125          HB1       ASN 125 -10.140 -10.650   7.839
  915   1HD2  ASN 125          HD21      ASN 125 -11.963 -11.995   8.089
  916   2HD2  ASN 125          HD22      ASN 125 -11.791 -13.711   8.252
  917    H    LYS 126           HN       LYS 126 -11.841 -11.999   4.290
  918    HA   LYS 126           HA       LYS 126 -10.399 -14.375   3.540
  919   1HB   LYS 126          HB2       LYS 126 -12.382 -15.026   2.347
  920   2HB   LYS 126          HB1       LYS 126 -12.856 -14.374   3.903
  921   1HG   LYS 126          HG2       LYS 126 -14.376 -13.252   2.710
  922   2HG   LYS 126          HG1       LYS 126 -13.035 -12.166   2.339
  923   1HD   LYS 126          HD2       LYS 126 -12.605 -13.332   0.267
  924   2HD   LYS 126          HD1       LYS 126 -13.822 -14.550   0.658
  925   1HE   LYS 126          HE2       LYS 126 -15.564 -12.857   0.574
  926   2HE   LYS 126          HE1       LYS 126 -14.363 -11.616   0.238
  927   1HZ   LYS 126          HZ1       LYS 126 -15.094 -13.907  -1.511
  928   2HZ   LYS 126          HZ2       LYS 126 -13.819 -12.838  -1.834
  929   3HZ   LYS 126          HZ3       LYS 126 -15.414 -12.267  -1.799
  930    H    GLN 127           HN       GLN 127 -10.194 -11.316   2.614
  931    HA   GLN 127           HA       GLN 127  -9.232 -10.175   0.948
  932   1HB   GLN 127          HB2       GLN 127  -7.622 -12.145   0.979
  933   2HB   GLN 127          HB1       GLN 127  -8.521 -12.774  -0.398
  934   1HG   GLN 127          HG2       GLN 127  -8.017 -10.777  -1.676
  935   2HG   GLN 127          HG1       GLN 127  -7.173 -10.084  -0.295
  936   1HE2  GLN 127          HE21      GLN 127  -6.030 -12.723   0.418
  937   2HE2  GLN 127          HE22      GLN 127  -4.733 -12.958  -0.702
  938    H    GLY 128           HN       GLY 128 -11.854 -10.255   0.800
  939   1HA   GLY 128          HA2       GLY 128 -12.551 -10.800  -1.970
  940   2HA   GLY 128          HA1       GLY 128 -13.614 -10.126  -0.735
  941    H    PHE 129           HN       PHE 129 -11.775  -9.403  -3.427
  942    HA   PHE 129           HA       PHE 129 -12.215  -6.572  -2.959
  943   1HB   PHE 129          HB2       PHE 129  -9.925  -5.904  -3.343
  944   2HB   PHE 129          HB1       PHE 129  -9.930  -7.076  -2.029
  945    HD1  PHE 129           HD1      PHE 129  -9.304  -9.483  -2.581
  946    HD2  PHE 129           HD2      PHE 129  -8.623  -6.235  -5.247
  947    HE1  PHE 129           HE1      PHE 129  -7.644 -10.831  -3.795
  948    HE2  PHE 129           HE2      PHE 129  -6.963  -7.579  -6.466
  949    HZ   PHE 129           HZ       PHE 129  -6.472  -9.880  -5.740
  950    H    THR 130           HN       THR 130 -11.610  -5.337  -5.024
  951    HA   THR 130           HA       THR 130 -11.249  -6.991  -7.389
  952    HB   THR 130           HB       THR 130 -13.668  -6.901  -7.257
  953    HG1  THR 130           HG1      THR 130 -12.940  -4.943  -9.184
  954   1HG2  THR 130          HG21      THR 130 -14.873  -4.769  -7.284
  955   2HG2  THR 130          HG22      THR 130 -13.342  -3.908  -7.135
  956   3HG2  THR 130          HG23      THR 130 -13.899  -4.949  -5.825
  957    HA   PRO 131           HA       PRO 131  -8.829  -3.428  -8.573
  958   1HB   PRO 131          HB2       PRO 131  -9.213  -4.277 -11.359
  959   2HB   PRO 131          HB1       PRO 131  -7.724  -4.184 -10.416
  960   1HG   PRO 131          HG2       PRO 131  -8.833  -6.537 -11.120
  961   2HG   PRO 131          HG1       PRO 131  -7.952  -6.324  -9.595
  962   1HD   PRO 131          HD2       PRO 131 -10.906  -6.381 -10.090
  963   2HD   PRO 131          HD1       PRO 131  -9.973  -7.104  -8.762
  964    H    SER 132           HN       SER 132  -9.992  -1.611  -8.297
  965    HA   SER 132           HA       SER 132 -11.818  -0.822 -10.458
  966   1HB   SER 132          HB2       SER 132 -12.281  -0.197  -7.532
  967   2HB   SER 132          HB1       SER 132 -13.377   0.110  -8.879
  968    HG   SER 132           HG       SER 132 -14.085  -1.862  -8.734
  969    H    GLY 133           HN       GLY 133 -11.194   1.042 -11.356
  970   1HA   GLY 133          HA2       GLY 133 -10.496   3.327 -11.233
  971   2HA   GLY 133          HA1       GLY 133  -9.665   2.954  -9.727
  972    H    THR 134           HN       THR 134  -7.541   2.658  -9.821
  973    HA   THR 134           HA       THR 134  -6.338   1.570 -12.254
  974    HB   THR 134           HB       THR 134  -4.503   3.297 -12.116
  975    HG1  THR 134           HG1      THR 134  -4.610   4.707 -10.561
  976   1HG2  THR 134          HG21      THR 134  -6.227   3.387 -13.857
  977   2HG2  THR 134          HG22      THR 134  -5.723   5.003 -13.362
  978   3HG2  THR 134          HG23      THR 134  -7.253   4.343 -12.789
  979    H    THR 135           HN       THR 135  -3.883   1.275 -11.851
  980    HA   THR 135           HA       THR 135  -3.369   0.719  -9.013
  981    HB   THR 135           HB       THR 135  -3.725  -1.406 -10.257
  982    HG1  THR 135           HG1      THR 135  -1.816  -0.828  -8.592
  983   1HG2  THR 135          HG21      THR 135  -2.879  -0.719 -12.448
  984   2HG2  THR 135          HG22      THR 135  -2.066  -2.174 -11.873
  985   3HG2  THR 135          HG23      THR 135  -1.247  -0.614 -11.787
  986    H    GLY 136           HN       GLY 136  -1.522   1.592  -8.232
  987   1HA   GLY 136          HA2       GLY 136   0.127   3.066 -10.190
  988   2HA   GLY 136          HA1       GLY 136  -0.162   3.587  -8.534
  989    H    THR 137           HN       THR 137   2.296   2.856 -10.211
  990    HA   THR 137           HA       THR 137   3.394   0.738  -8.503
  991    HB   THR 137           HB       THR 137   4.705   2.016 -10.910
  992    HG1  THR 137           HG1      THR 137   2.758   0.982 -11.553
  993   1HG2  THR 137          HG21      THR 137   6.236   0.845  -9.418
  994   2HG2  THR 137          HG22      THR 137   6.040  -0.052 -10.924
  995   3HG2  THR 137          HG23      THR 137   5.210  -0.589  -9.464
  996    H    THR 138           HN       THR 138   4.054   1.632  -6.626
  997    HA   THR 138           HA       THR 138   5.393   4.186  -6.580
  998    HB   THR 138           HB       THR 138   5.137   2.192  -4.320
  999    HG1  THR 138           HG1      THR 138   3.086   2.698  -4.358
 1000   1HG2  THR 138          HG21      THR 138   5.591   5.177  -4.340
 1001   2HG2  THR 138          HG22      THR 138   6.784   3.947  -3.924
 1002   3HG2  THR 138          HG23      THR 138   5.366   4.184  -2.902
 1003    H    LYS 139           HN       LYS 139   7.428   4.330  -7.235
 1004    HA   LYS 139           HA       LYS 139   9.193   2.016  -6.851
 1005   1HB   LYS 139          HB2       LYS 139   9.100   2.857  -9.145
 1006   2HB   LYS 139          HB1       LYS 139   9.529   4.470  -8.592
 1007   1HG   LYS 139          HG2       LYS 139  11.478   3.500  -9.526
 1008   2HG   LYS 139          HG1       LYS 139  11.698   3.528  -7.778
 1009   1HD   LYS 139          HD2       LYS 139  12.469   1.409  -8.482
 1010   2HD   LYS 139          HD1       LYS 139  10.871   1.119  -7.791
 1011   1HE   LYS 139          HE2       LYS 139   9.882   0.998  -9.966
 1012   2HE   LYS 139          HE1       LYS 139  11.380   1.515 -10.734
 1013   1HZ   LYS 139          HZ1       LYS 139  12.400  -0.573  -9.824
 1014   2HZ   LYS 139          HZ2       LYS 139  11.217  -0.811 -11.012
 1015   3HZ   LYS 139          HZ3       LYS 139  10.844  -1.073  -9.381
 1016    H    LEU 140           HN       LEU 140  10.158   2.032  -5.032
 1017    HA   LEU 140           HA       LEU 140  10.942   4.523  -3.760
 1018   1HB   LEU 140          HB2       LEU 140   9.893   3.111  -2.238
 1019   2HB   LEU 140          HB1       LEU 140  10.645   1.672  -2.894
 1020    HG   LEU 140           HG       LEU 140  12.803   2.429  -1.921
 1021   1HD1  LEU 140          HD11      LEU 140  12.345   4.811  -1.790
 1022   2HD1  LEU 140          HD12      LEU 140  12.768   4.167  -0.204
 1023   3HD1  LEU 140          HD13      LEU 140  11.085   4.515  -0.594
 1024   1HD2  LEU 140          HD21      LEU 140  10.533   2.104   0.035
 1025   2HD2  LEU 140          HD22      LEU 140  12.241   1.829   0.377
 1026   3HD2  LEU 140          HD23      LEU 140  11.396   0.797  -0.775
 1027    H    THR 141           HN       THR 141  12.692   5.236  -4.868
 1028    HA   THR 141           HA       THR 141  14.911   3.411  -5.371
 1029    HB   THR 141           HB       THR 141  14.677   6.337  -6.104
 1030    HG1  THR 141           HG1      THR 141  13.331   5.674  -7.585
 1031   1HG2  THR 141          HG21      THR 141  16.453   4.137  -7.165
 1032   2HG2  THR 141          HG22      THR 141  16.961   5.461  -6.115
 1033   3HG2  THR 141          HG23      THR 141  16.406   5.797  -7.755
 1034    H    VAL 142           HN       VAL 142  16.665   3.343  -4.081
 1035    HA   VAL 142           HA       VAL 142  16.772   5.349  -1.931
 1036    HB   VAL 142           HB       VAL 142  18.046   2.625  -1.946
 1037   1HG1  VAL 142          HG11      VAL 142  17.613   4.631   0.251
 1038   2HG1  VAL 142          HG12      VAL 142  19.154   4.167  -0.470
 1039   3HG1  VAL 142          HG13      VAL 142  18.236   2.997   0.477
 1040   1HG2  VAL 142          HG21      VAL 142  16.232   1.930  -0.447
 1041   2HG2  VAL 142          HG22      VAL 142  15.631   2.386  -2.040
 1042   3HG2  VAL 142          HG23      VAL 142  15.454   3.494  -0.681
 1043    H    THR 143           HN       THR 143  18.113   6.915  -2.557
 1044    HA   THR 143           HA       THR 143  20.849   6.100  -3.266
 1045    HB   THR 143           HB       THR 143  19.490   8.702  -4.015
 1046    HG1  THR 143           HG1      THR 143  19.586   6.228  -5.241
 1047   1HG2  THR 143          HG21      THR 143  22.173   7.553  -4.804
 1048   2HG2  THR 143          HG22      THR 143  21.911   8.920  -3.723
 1049   3HG2  THR 143          HG23      THR 143  21.474   9.047  -5.427
  Start of MODEL   13
    1    H    GLU   1           H        GLU   1 -23.042   2.640  -6.949
    2    HA   GLU   1           HA       GLU   1 -23.580   1.130  -8.725
    3   1HB   GLU   1          HB2       GLU   1 -22.987   1.731 -11.046
    4   2HB   GLU   1          HB1       GLU   1 -24.284   2.726 -10.405
    5   1HG   GLU   1          HG2       GLU   1 -22.700   4.539 -10.001
    6   2HG   GLU   1          HG1       GLU   1 -21.398   3.541 -10.647
    7    H    GLU   2           HN       GLU   2 -20.849   3.371  -8.417
    8    HA   GLU   2           HA       GLU   2 -19.081   1.180  -7.888
    9   1HB   GLU   2          HB2       GLU   2 -19.071   1.090 -10.326
   10   2HB   GLU   2          HB1       GLU   2 -18.685   2.802 -10.399
   11   1HG   GLU   2          HG2       GLU   2 -16.572   2.288  -9.162
   12   2HG   GLU   2          HG1       GLU   2 -16.943   0.579  -9.381
   13    H    CYS   3           HN       CYS   3 -17.927   1.911  -6.275
   14    HA   CYS   3           HA       CYS   3 -17.015   4.681  -6.196
   15   1HB   CYS   3          HB2       CYS   3 -17.676   3.918  -4.055
   16   2HB   CYS   3          HB1       CYS   3 -16.858   2.375  -4.261
   17    H    GLN   4           HN       GLN   4 -15.391   5.016  -7.579
   18    HA   GLN   4           HA       GLN   4 -13.430   2.886  -7.994
   19   1HB   GLN   4          HB2       GLN   4 -12.728   4.246  -9.964
   20   2HB   GLN   4          HB1       GLN   4 -14.400   3.715 -10.027
   21   1HG   GLN   4          HG2       GLN   4 -15.093   5.951  -9.238
   22   2HG   GLN   4          HG1       GLN   4 -13.409   6.462  -9.311
   23   1HE2  GLN   4          HE21      GLN   4 -14.908   4.285 -11.603
   24   2HE2  GLN   4          HE22      GLN   4 -14.845   5.368 -12.952
   25    H    VAL   5           HN       VAL   5 -11.281   3.125  -7.640
   26    HA   VAL   5           HA       VAL   5 -10.440   5.584  -6.253
   27    HB   VAL   5           HB       VAL   5  -9.540   2.736  -5.780
   28   1HG1  VAL   5          HG11      VAL   5  -8.036   3.665  -4.069
   29   2HG1  VAL   5          HG12      VAL   5  -8.454   5.295  -4.602
   30   3HG1  VAL   5          HG13      VAL   5  -7.602   4.200  -5.692
   31   1HG2  VAL   5          HG21      VAL   5 -11.639   3.328  -4.697
   32   2HG2  VAL   5          HG22      VAL   5 -10.887   4.756  -3.988
   33   3HG2  VAL   5          HG23      VAL   5 -10.357   3.146  -3.501
   34    H    ARG   6           HN       ARG   6  -9.061   6.742  -7.391
   35    HA   ARG   6           HA       ARG   6  -7.629   5.516  -9.606
   36   1HB   ARG   6          HB2       ARG   6  -7.837   8.404  -8.739
   37   2HB   ARG   6          HB1       ARG   6  -6.993   7.847 -10.176
   38   1HG   ARG   6          HG2       ARG   6  -9.944   7.598  -9.632
   39   2HG   ARG   6          HG1       ARG   6  -9.171   8.724 -10.748
   40   1HD   ARG   6          HD2       ARG   6  -9.171   5.716 -10.946
   41   2HD   ARG   6          HD1       ARG   6 -10.092   6.830 -11.953
   42    HE   ARG   6           HE       ARG   6  -7.155   6.955 -11.936
   43   1HH1  ARG   6          HH11      ARG   6 -10.171   6.443 -13.656
   44   2HH1  ARG   6          HH12      ARG   6  -9.396   6.337 -15.214
   45   1HH2  ARG   6          HH21      ARG   6  -6.157   6.798 -13.980
   46   2HH2  ARG   6          HH22      ARG   6  -7.124   6.536 -15.398
   47    H    VAL   7           HN       VAL   7  -5.837   4.476  -9.013
   48    HA   VAL   7           HA       VAL   7  -3.929   5.891  -7.272
   49    HB   VAL   7           HB       VAL   7  -4.108   2.917  -7.818
   50   1HG1  VAL   7          HG11      VAL   7  -1.810   3.603  -7.459
   51   2HG1  VAL   7          HG12      VAL   7  -2.399   2.710  -6.056
   52   3HG1  VAL   7          HG13      VAL   7  -2.273   4.468  -5.992
   53   1HG2  VAL   7          HG21      VAL   7  -4.772   4.485  -5.327
   54   2HG2  VAL   7          HG22      VAL   7  -4.768   2.726  -5.461
   55   3HG2  VAL   7          HG23      VAL   7  -5.928   3.678  -6.389
   56    H    GLY   8           HN       GLY   8  -2.352   6.816  -8.394
   57   1HA   GLY   8          HA2       GLY   8  -1.564   5.624 -10.964
   58   2HA   GLY   8          HA1       GLY   8  -1.294   7.296 -10.494
   59    H    ASP   9           HN       ASP   9   0.889   6.339 -11.438
   60    HA   ASP   9           HA       ASP   9   2.427   4.989  -9.364
   61   1HB   ASP   9          HB2       ASP   9   4.131   4.665 -10.973
   62   2HB   ASP   9          HB1       ASP   9   2.628   4.434 -11.858
   63    H    LEU  10           HN       LEU  10   4.201   5.889  -8.341
   64    HA   LEU  10           HA       LEU  10   4.786   8.702  -8.828
   65   1HB   LEU  10          HB2       LEU  10   4.684   9.279  -6.465
   66   2HB   LEU  10          HB1       LEU  10   3.125   8.734  -7.043
   67    HG   LEU  10           HG       LEU  10   4.967   6.865  -5.574
   68   1HD1  LEU  10          HD11      LEU  10   2.916   8.727  -4.377
   69   2HD1  LEU  10          HD12      LEU  10   4.663   8.839  -4.165
   70   3HD1  LEU  10          HD13      LEU  10   3.783   7.454  -3.518
   71   1HD2  LEU  10          HD21      LEU  10   2.881   5.731  -5.032
   72   2HD2  LEU  10          HD22      LEU  10   3.052   5.905  -6.781
   73   3HD2  LEU  10          HD23      LEU  10   1.967   6.973  -5.888
   74    H    THR  11           HN       THR  11   6.885   9.287  -8.344
   75    HA   THR  11           HA       THR  11   8.655   7.011  -7.719
   76    HB   THR  11           HB       THR  11   9.389   9.391  -9.422
   77    HG1  THR  11           HG1      THR  11   7.589   8.087 -10.287
   78   1HG2  THR  11          HG21      THR  11  10.577   6.628  -9.145
   79   2HG2  THR  11          HG22      THR  11  11.262   8.123  -8.508
   80   3HG2  THR  11          HG23      THR  11  11.140   7.881 -10.250
   81    H    VAL  12           HN       VAL  12   9.666   7.233  -5.837
   82    HA   VAL  12           HA       VAL  12  10.388   9.946  -4.936
   83    HB   VAL  12           HB       VAL  12   8.520   9.082  -3.597
   84   1HG1  VAL  12          HG11      VAL  12   8.919   6.699  -3.819
   85   2HG1  VAL  12          HG12      VAL  12   8.800   7.162  -2.123
   86   3HG1  VAL  12          HG13      VAL  12  10.378   6.839  -2.837
   87   1HG2  VAL  12          HG21      VAL  12  10.087  10.579  -2.524
   88   2HG2  VAL  12          HG22      VAL  12  11.125   9.221  -2.090
   89   3HG2  VAL  12          HG23      VAL  12   9.521   9.371  -1.370
   90    H    ALA  13           HN       ALA  13  12.408  10.216  -4.101
   91    HA   ALA  13           HA       ALA  13  14.134   7.826  -4.068
   92   1HB   ALA  13          HB1       ALA  13  14.895  10.667  -4.752
   93   2HB   ALA  13          HB2       ALA  13  14.721   9.332  -5.893
   94   3HB   ALA  13          HB3       ALA  13  16.001   9.295  -4.678
   95    H    LYS  14           HN       LYS  14  14.600   7.263  -2.053
   96    HA   LYS  14           HA       LYS  14  15.703   9.125  -0.192
   97   1HB   LYS  14          HB2       LYS  14  13.046   9.285  -0.117
   98   2HB   LYS  14          HB1       LYS  14  13.220   7.840   0.867
   99   1HG   LYS  14          HG2       LYS  14  13.118   9.698   2.338
  100   2HG   LYS  14          HG1       LYS  14  14.787   9.124   2.334
  101   1HD   LYS  14          HD2       LYS  14  14.916  11.478   2.207
  102   2HD   LYS  14          HD1       LYS  14  15.244  10.892   0.576
  103   1HE   LYS  14          HE2       LYS  14  13.760  12.666   0.251
  104   2HE   LYS  14          HE1       LYS  14  12.736  11.230   0.159
  105   1HZ   LYS  14          HZ1       LYS  14  11.621  12.794   1.512
  106   2HZ   LYS  14          HZ2       LYS  14  13.009  13.121   2.431
  107   3HZ   LYS  14          HZ3       LYS  14  12.233  11.625   2.575
  108    H    THR  15           HN       THR  15  15.799   7.928   2.068
  109    HA   THR  15           HA       THR  15  16.769   5.213   1.539
  110    HB   THR  15           HB       THR  15  17.598   5.908   4.076
  111    HG1  THR  15           HG1      THR  15  18.057   8.190   2.454
  112   1HG2  THR  15          HG21      THR  15  19.799   6.271   3.030
  113   2HG2  THR  15          HG22      THR  15  19.021   6.350   1.449
  114   3HG2  THR  15          HG23      THR  15  18.986   4.849   2.376
  115    H    ARG  16           HN       ARG  16  16.366   3.556   3.295
  116    HA   ARG  16           HA       ARG  16  13.550   3.694   3.958
  117   1HB   ARG  16          HB2       ARG  16  15.539   1.462   4.420
  118   2HB   ARG  16          HB1       ARG  16  13.827   1.366   4.827
  119   1HG   ARG  16          HG2       ARG  16  13.893   0.301   2.790
  120   2HG   ARG  16          HG1       ARG  16  13.467   1.950   2.324
  121   1HD   ARG  16          HD2       ARG  16  16.054   2.250   2.119
  122   2HD   ARG  16          HD1       ARG  16  16.045   0.492   1.987
  123    HE   ARG  16           HE       ARG  16  14.575   0.775   0.057
  124   1HH1  ARG  16          HH11      ARG  16  16.615   3.386   1.087
  125   2HH1  ARG  16          HH12      ARG  16  16.450   4.296  -0.382
  126   1HH2  ARG  16          HH21      ARG  16  14.410   1.921  -1.959
  127   2HH2  ARG  16          HH22      ARG  16  15.230   3.438  -2.128
  128    H    GLY  17           HN       GLY  17  16.395   4.551   5.516
  129   1HA   GLY  17          HA2       GLY  17  15.535   4.141   8.220
  130   2HA   GLY  17          HA1       GLY  17  16.811   5.230   7.684
  131    H    GLN  18           HN       GLN  18  14.690   6.286   5.741
  132    HA   GLN  18           HA       GLN  18  13.852   8.555   7.194
  133   1HB   GLN  18          HB2       GLN  18  14.142   8.724   4.829
  134   2HB   GLN  18          HB1       GLN  18  13.061   7.375   4.530
  135   1HG   GLN  18          HG2       GLN  18  11.743   9.138   3.939
  136   2HG   GLN  18          HG1       GLN  18  11.277   8.923   5.623
  137   1HE2  GLN  18          HE21      GLN  18  13.776  10.107   6.618
  138   2HE2  GLN  18          HE22      GLN  18  13.608  11.807   6.369
  139    H    LEU  19           HN       LEU  19  12.443   5.423   6.664
  140    HA   LEU  19           HA       LEU  19   9.726   6.363   7.145
  141   1HB   LEU  19          HB2       LEU  19  10.513   3.506   6.693
  142   2HB   LEU  19          HB1       LEU  19   8.991   4.302   6.331
  143    HG   LEU  19           HG       LEU  19  11.576   4.756   4.840
  144   1HD1  LEU  19          HD11      LEU  19   9.089   3.237   4.058
  145   2HD1  LEU  19          HD12      LEU  19  10.659   2.531   4.437
  146   3HD1  LEU  19          HD13      LEU  19  10.475   3.556   3.015
  147   1HD2  LEU  19          HD21      LEU  19   8.781   5.742   4.293
  148   2HD2  LEU  19          HD22      LEU  19  10.197   6.008   3.277
  149   3HD2  LEU  19          HD23      LEU  19  10.121   6.721   4.887
  150    H    THR  20           HN       THR  20  11.840   6.124   9.304
  151    HA   THR  20           HA       THR  20  11.903   3.996  10.878
  152    HB   THR  20           HB       THR  20  11.785   5.757  12.856
  153    HG1  THR  20           HG1      THR  20  11.004   7.524  11.799
  154   1HG2  THR  20          HG21      THR  20  14.132   6.323  12.379
  155   2HG2  THR  20          HG22      THR  20  13.939   5.694  10.743
  156   3HG2  THR  20          HG23      THR  20  13.802   4.609  12.125
  157    H    ASP  21           HN       ASP  21  10.149   2.702  10.935
  158    HA   ASP  21           HA       ASP  21   8.380   1.686  11.876
  159   1HB   ASP  21          HB2       ASP  21   8.283   4.057  13.742
  160   2HB   ASP  21          HB1       ASP  21   7.366   2.566  13.932
  161    H    ALA  22           HN       ALA  22   7.687   5.178  11.697
  162    HA   ALA  22           HA       ALA  22   5.718   4.683   9.674
  163   1HB   ALA  22          HB1       ALA  22   4.389   4.218  11.674
  164   2HB   ALA  22          HB2       ALA  22   3.808   5.641  10.811
  165   3HB   ALA  22          HB3       ALA  22   4.754   5.830  12.288
  166    H    ALA  23           HN       ALA  23   7.420   5.976   8.705
  167    HA   ALA  23           HA       ALA  23   6.561   8.777   8.768
  168   1HB   ALA  23          HB1       ALA  23   8.850   9.572   8.487
  169   2HB   ALA  23          HB2       ALA  23   9.453   7.919   8.608
  170   3HB   ALA  23          HB3       ALA  23   8.686   8.682  10.001
  171    HA   PRO  24           HA       PRO  24   5.991   7.360   4.635
  172   1HB   PRO  24          HB2       PRO  24   4.584   9.436   3.702
  173   2HB   PRO  24          HB1       PRO  24   3.925   8.331   4.915
  174   1HG   PRO  24          HG2       PRO  24   5.122  11.051   5.282
  175   2HG   PRO  24          HG1       PRO  24   3.678  10.355   6.037
  176   1HD   PRO  24          HD2       PRO  24   6.136  10.480   7.258
  177   2HD   PRO  24          HD1       PRO  24   4.895   9.277   7.649
  178    H    ILE  25           HN       ILE  25   7.320   7.319   2.977
  179    HA   ILE  25           HA       ILE  25   8.985   9.526   2.201
  180    HB   ILE  25           HB       ILE  25   9.056   7.980   0.017
  181   1HG1  ILE  25          HG12      ILE  25   8.336   6.055   2.237
  182   2HG1  ILE  25          HG11      ILE  25   7.304   6.462   0.870
  183   1HG2  ILE  25          HG21      ILE  25  10.495   7.417   2.599
  184   2HG2  ILE  25          HG22      ILE  25  10.977   8.569   1.354
  185   3HG2  ILE  25          HG23      ILE  25  10.996   6.840   1.011
  186   1HD1  ILE  25          HD11      ILE  25   8.400   4.332   0.530
  187   2HD1  ILE  25          HD12      ILE  25   9.980   5.096   0.731
  188   3HD1  ILE  25          HD13      ILE  25   8.967   5.513  -0.652
  189    H    GLY  26           HN       GLY  26   6.283   7.830   0.652
  190   1HA   GLY  26          HA2       GLY  26   5.458  10.360  -0.582
  191   2HA   GLY  26          HA1       GLY  26   5.695   8.938  -1.592
  192    HA   PRO  27           HA       PRO  27   1.716   8.405   1.155
  193   1HB   PRO  27          HB2       PRO  27   0.345  10.772   1.314
  194   2HB   PRO  27          HB1       PRO  27   1.396  10.156   2.591
  195   1HG   PRO  27          HG2       PRO  27   1.928  12.245   0.538
  196   2HG   PRO  27          HG1       PRO  27   2.448  12.172   2.231
  197   1HD   PRO  27          HD2       PRO  27   4.082  11.577   0.128
  198   2HD   PRO  27          HD1       PRO  27   4.272  10.869   1.742
  199    H    VAL  28           HN       VAL  28   0.280   7.517  -0.165
  200    HA   VAL  28           HA       VAL  28   0.009   8.465  -2.877
  201    HB   VAL  28           HB       VAL  28  -1.421   6.176  -1.506
  202   1HG1  VAL  28          HG11      VAL  28  -2.564   6.923  -3.513
  203   2HG1  VAL  28          HG12      VAL  28  -1.805   5.358  -3.793
  204   3HG1  VAL  28          HG13      VAL  28  -1.064   6.827  -4.430
  205   1HG2  VAL  28          HG21      VAL  28   1.107   6.174  -3.156
  206   2HG2  VAL  28          HG22      VAL  28   0.245   4.735  -2.613
  207   3HG2  VAL  28          HG23      VAL  28   0.973   5.820  -1.432
  208    H    THR  29           HN       THR  29  -1.489   9.835  -3.534
  209    HA   THR  29           HA       THR  29  -3.571  10.707  -1.768
  210    HB   THR  29           HB       THR  29  -2.631  12.422  -3.094
  211    HG1  THR  29           HG1      THR  29  -5.159  11.680  -4.188
  212   1HG2  THR  29          HG21      THR  29  -2.574  12.397  -5.549
  213   2HG2  THR  29          HG22      THR  29  -3.243  10.763  -5.544
  214   3HG2  THR  29          HG23      THR  29  -1.642  11.065  -4.865
  215    H    VAL  30           HN       VAL  30  -4.539   8.572  -1.556
  216    HA   VAL  30           HA       VAL  30  -5.884   7.359  -3.763
  217    HB   VAL  30           HB       VAL  30  -6.228   7.000  -0.779
  218   1HG1  VAL  30          HG11      VAL  30  -7.381   5.375  -3.044
  219   2HG1  VAL  30          HG12      VAL  30  -8.280   6.346  -1.876
  220   3HG1  VAL  30          HG13      VAL  30  -7.409   4.909  -1.345
  221   1HG2  VAL  30          HG21      VAL  30  -4.991   4.904  -1.162
  222   2HG2  VAL  30          HG22      VAL  30  -4.044   6.327  -1.591
  223   3HG2  VAL  30          HG23      VAL  30  -4.787   5.349  -2.857
  224    H    GLN  31           HN       GLN  31  -7.535   8.274  -4.719
  225    HA   GLN  31           HA       GLN  31  -9.469   9.768  -3.109
  226   1HB   GLN  31          HB2       GLN  31  -9.956  11.118  -5.093
  227   2HB   GLN  31          HB1       GLN  31  -8.260  11.230  -4.653
  228   1HG   GLN  31          HG2       GLN  31  -7.787   9.517  -6.419
  229   2HG   GLN  31          HG1       GLN  31  -9.465   9.689  -6.935
  230   1HE2  GLN  31          HE21      GLN  31  -9.004  10.531  -8.928
  231   2HE2  GLN  31          HE22      GLN  31  -8.336  12.109  -9.157
  232    H    ALA  32           HN       ALA  32 -11.439   9.021  -3.039
  233    HA   ALA  32           HA       ALA  32 -12.193   6.863  -4.888
  234   1HB   ALA  32          HB1       ALA  32 -11.947   6.152  -2.554
  235   2HB   ALA  32          HB2       ALA  32 -13.615   6.004  -3.106
  236   3HB   ALA  32          HB3       ALA  32 -13.147   7.350  -2.067
  237    H    LEU  33           HN       LEU  33 -13.970   7.098  -6.093
  238    HA   LEU  33           HA       LEU  33 -15.511   9.585  -5.736
  239   1HB   LEU  33          HB2       LEU  33 -14.115   9.369  -7.797
  240   2HB   LEU  33          HB1       LEU  33 -15.085   7.984  -8.256
  241    HG   LEU  33           HG       LEU  33 -17.091   9.441  -8.333
  242   1HD1  LEU  33          HD11      LEU  33 -15.098  11.661  -7.882
  243   2HD1  LEU  33          HD12      LEU  33 -16.369  11.160  -6.765
  244   3HD1  LEU  33          HD13      LEU  33 -16.793  11.868  -8.324
  245   1HD2  LEU  33          HD21      LEU  33 -16.505  10.567 -10.406
  246   2HD2  LEU  33          HD22      LEU  33 -15.796   8.953 -10.353
  247   3HD2  LEU  33          HD23      LEU  33 -14.790  10.369 -10.046
  248    H    GLY  34           HN       GLY  34 -17.456   9.243  -4.911
  249   1HA   GLY  34          HA2       GLY  34 -19.628   8.517  -4.772
  250   2HA   GLY  34          HA1       GLY  34 -19.395   7.744  -6.329
  251    H    CYS  35           HN       CYS  35 -18.679   7.316  -2.874
  252    HA   CYS  35           HA       CYS  35 -18.716   4.420  -3.347
  253   1HB   CYS  35          HB2       CYS  35 -17.688   5.807  -0.880
  254   2HB   CYS  35          HB1       CYS  35 -17.374   4.156  -1.407
  255    H    ASN  36           HN       ASN  36 -19.494   6.530  -0.586
  256    HA   ASN  36           HA       ASN  36 -21.219   6.625   0.857
  257   1HB   ASN  36          HB2       ASN  36 -22.664   5.208  -1.364
  258   2HB   ASN  36          HB1       ASN  36 -23.456   5.678   0.135
  259   1HD2  ASN  36          HD21      ASN  36 -22.169   6.735  -2.878
  260   2HD2  ASN  36          HD22      ASN  36 -22.668   8.390  -2.754
  261    H    ALA  37           HN       ALA  37 -21.002   3.364  -0.562
  262    HA   ALA  37           HA       ALA  37 -20.718   2.294   2.137
  263   1HB   ALA  37          HB1       ALA  37 -22.366   0.537   1.772
  264   2HB   ALA  37          HB2       ALA  37 -22.751   1.210   0.188
  265   3HB   ALA  37          HB3       ALA  37 -23.119   2.126   1.649
  266    H    ARG  38           HN       ARG  38 -18.530   2.293   1.107
  267    HA   ARG  38           HA       ARG  38 -18.024  -0.301  -0.105
  268   1HB   ARG  38          HB2       ARG  38 -18.439   1.306  -1.979
  269   2HB   ARG  38          HB1       ARG  38 -17.081   2.260  -1.407
  270   1HG   ARG  38          HG2       ARG  38 -16.602  -0.601  -2.020
  271   2HG   ARG  38          HG1       ARG  38 -16.845   0.507  -3.371
  272   1HD   ARG  38          HD2       ARG  38 -15.075   1.827  -1.679
  273   2HD   ARG  38          HD1       ARG  38 -14.545   0.146  -1.651
  274    HE   ARG  38           HE       ARG  38 -15.042   1.279  -4.279
  275   1HH1  ARG  38          HH11      ARG  38 -12.710   0.469  -1.818
  276   2HH1  ARG  38          HH12      ARG  38 -11.348   0.576  -2.890
  277   1HH2  ARG  38          HH21      ARG  38 -13.282   1.427  -5.700
  278   2HH2  ARG  38          HH22      ARG  38 -11.674   1.134  -5.107
  279    H    GLN  39           HN       GLN  39 -16.183  -1.174   0.678
  280    HA   GLN  39           HA       GLN  39 -14.567   0.446   2.461
  281   1HB   GLN  39          HB2       GLN  39 -14.564  -2.502   1.805
  282   2HB   GLN  39          HB1       GLN  39 -13.398  -1.756   2.892
  283   1HG   GLN  39          HG2       GLN  39 -15.163  -1.069   4.383
  284   2HG   GLN  39          HG1       GLN  39 -16.382  -1.679   3.269
  285   1HE2  GLN  39          HE21      GLN  39 -15.830  -2.355   6.066
  286   2HE2  GLN  39          HE22      GLN  39 -15.584  -4.067   6.087
  287    H    VAL  40           HN       VAL  40 -12.709   1.364   1.928
  288    HA   VAL  40           HA       VAL  40 -11.661   0.838  -0.753
  289    HB   VAL  40           HB       VAL  40 -11.121   3.129   1.148
  290   1HG1  VAL  40          HG11      VAL  40  -9.830   4.134  -0.684
  291   2HG1  VAL  40          HG12      VAL  40 -10.023   2.654  -1.623
  292   3HG1  VAL  40          HG13      VAL  40  -9.101   2.631  -0.119
  293   1HG2  VAL  40          HG21      VAL  40 -12.557   2.998  -1.501
  294   2HG2  VAL  40          HG22      VAL  40 -12.240   4.470  -0.580
  295   3HG2  VAL  40          HG23      VAL  40 -13.301   3.226   0.082
  296    H    ALA  41           HN       ALA  41 -10.106  -0.617  -0.876
  297    HA   ALA  41           HA       ALA  41  -8.250  -0.899   1.377
  298   1HB   ALA  41          HB1       ALA  41  -8.216  -3.221   1.082
  299   2HB   ALA  41          HB2       ALA  41  -8.942  -3.114  -0.520
  300   3HB   ALA  41          HB3       ALA  41  -9.921  -2.793   0.908
  301    H    LEU  42           HN       LEU  42  -6.102  -1.046   0.930
  302    HA   LEU  42           HA       LEU  42  -5.303  -0.776  -1.879
  303   1HB   LEU  42          HB2       LEU  42  -3.630  -0.407   0.603
  304   2HB   LEU  42          HB1       LEU  42  -3.154  -0.035  -1.042
  305    HG   LEU  42           HG       LEU  42  -5.288   1.361   0.557
  306   1HD1  LEU  42          HD11      LEU  42  -3.763   3.288   0.372
  307   2HD1  LEU  42          HD12      LEU  42  -2.568   2.244  -0.399
  308   3HD1  LEU  42          HD13      LEU  42  -3.054   1.947   1.271
  309   1HD2  LEU  42          HD21      LEU  42  -5.910   1.255  -1.796
  310   2HD2  LEU  42          HD22      LEU  42  -4.323   1.872  -2.257
  311   3HD2  LEU  42          HD23      LEU  42  -5.438   2.896  -1.353
  312    H    LYS  43           HN       LYS  43  -4.331  -2.393  -2.893
  313    HA   LYS  43           HA       LYS  43  -3.399  -4.682  -1.292
  314   1HB   LYS  43          HB2       LYS  43  -4.470  -4.885  -4.110
  315   2HB   LYS  43          HB1       LYS  43  -4.114  -6.198  -3.001
  316   1HG   LYS  43          HG2       LYS  43  -6.415  -6.101  -2.952
  317   2HG   LYS  43          HG1       LYS  43  -5.961  -5.143  -1.539
  318   1HD   LYS  43          HD2       LYS  43  -6.131  -3.100  -2.982
  319   2HD   LYS  43          HD1       LYS  43  -6.800  -4.127  -4.251
  320   1HE   LYS  43          HE2       LYS  43  -7.956  -3.731  -1.502
  321   2HE   LYS  43          HE1       LYS  43  -8.551  -2.986  -2.986
  322   1HZ   LYS  43          HZ1       LYS  43  -8.622  -5.825  -2.199
  323   2HZ   LYS  43          HZ2       LYS  43  -8.824  -5.346  -3.807
  324   3HZ   LYS  43          HZ3       LYS  43  -9.918  -4.818  -2.625
  325    H    ALA  44           HN       ALA  44  -1.545  -5.751  -2.098
  326    HA   ALA  44           HA       ALA  44   0.114  -4.039  -3.772
  327   1HB   ALA  44          HB1       ALA  44   1.928  -5.605  -3.112
  328   2HB   ALA  44          HB2       ALA  44   0.753  -6.479  -2.131
  329   3HB   ALA  44          HB3       ALA  44   1.142  -4.802  -1.755
  330    H    ASP  45           HN       ASP  45   1.365  -5.005  -5.513
  331    HA   ASP  45           HA       ASP  45  -0.308  -6.800  -7.084
  332   1HB   ASP  45          HB2       ASP  45   0.734  -4.686  -8.037
  333   2HB   ASP  45          HB1       ASP  45   2.295  -5.492  -7.909
  334    H    THR  46           HN       THR  46   1.086  -8.496  -8.414
  335    HA   THR  46           HA       THR  46   1.863 -10.359  -6.433
  336    HB   THR  46           HB       THR  46   0.782 -10.998  -8.559
  337    HG1  THR  46           HG1      THR  46   3.217 -12.367  -8.685
  338   1HG2  THR  46          HG21      THR  46   1.965  -9.495 -10.065
  339   2HG2  THR  46          HG22      THR  46   2.115 -11.168 -10.603
  340   3HG2  THR  46          HG23      THR  46   3.465 -10.381  -9.788
  341    H    ASP  47           HN       ASP  47   3.609  -7.818  -7.595
  342    HA   ASP  47           HA       ASP  47   6.172  -9.178  -7.610
  343   1HB   ASP  47          HB2       ASP  47   7.102  -6.877  -8.045
  344   2HB   ASP  47          HB1       ASP  47   6.011  -7.493  -9.275
  345    H    ASN  48           HN       ASN  48   4.210  -7.271  -5.447
  346    HA   ASN  48           HA       ASN  48   6.312  -7.635  -3.411
  347   1HB   ASN  48          HB2       ASN  48   5.801  -5.475  -2.421
  348   2HB   ASN  48          HB1       ASN  48   6.270  -5.265  -4.104
  349   1HD2  ASN  48          HD21      ASN  48   4.708  -3.558  -2.311
  350   2HD2  ASN  48          HD22      ASN  48   3.201  -3.288  -3.118
  351    H    PHE  49           HN       PHE  49   3.530  -8.798  -4.252
  352    HA   PHE  49           HA       PHE  49   2.367  -8.827  -1.537
  353   1HB   PHE  49          HB2       PHE  49   0.953  -7.920  -3.425
  354   2HB   PHE  49          HB1       PHE  49   1.018  -9.506  -4.160
  355    HD1  PHE  49           HD1      PHE  49  -0.263  -7.603  -1.252
  356    HD2  PHE  49           HD2      PHE  49  -0.454 -11.214  -3.502
  357    HE1  PHE  49           HE1      PHE  49  -2.345  -8.204  -0.107
  358    HE2  PHE  49           HE2      PHE  49  -2.537 -11.824  -2.345
  359    HZ   PHE  49           HZ       PHE  49  -3.496 -10.306  -0.653
  360    H    GLU  50           HN       GLU  50   3.345 -10.574  -0.594
  361    HA   GLU  50           HA       GLU  50   3.542 -13.047  -2.139
  362   1HB   GLU  50          HB2       GLU  50   4.868 -13.892  -0.194
  363   2HB   GLU  50          HB1       GLU  50   5.572 -12.494  -0.991
  364   1HG   GLU  50          HG2       GLU  50   4.943 -11.052   0.765
  365   2HG   GLU  50          HG1       GLU  50   3.887 -12.266   1.478
  366    H    GLN  51           HN       GLN  51   1.502 -13.795  -2.228
  367    HA   GLN  51           HA       GLN  51  -0.298 -15.033  -1.647
  368   1HB   GLN  51          HB2       GLN  51   1.006 -15.303   1.067
  369   2HB   GLN  51          HB1       GLN  51  -0.322 -16.277   0.450
  370   1HG   GLN  51          HG2       GLN  51   2.501 -16.203  -0.581
  371   2HG   GLN  51          HG1       GLN  51   1.718 -17.522   0.284
  372   1HE2  GLN  51          HE21      GLN  51   2.988 -17.494  -2.341
  373   2HE2  GLN  51          HE22      GLN  51   1.777 -17.994  -3.477
  374    H    GLY  52           HN       GLY  52   0.598 -12.917   1.069
  375   1HA   GLY  52          HA2       GLY  52  -1.733 -11.313   0.791
  376   2HA   GLY  52          HA1       GLY  52  -1.913 -12.438   2.136
  377    H    LYS  53           HN       LYS  53   1.069 -10.966   1.041
  378    HA   LYS  53           HA       LYS  53   1.159  -9.227   3.403
  379   1HB   LYS  53          HB2       LYS  53   3.461 -10.967   2.495
  380   2HB   LYS  53          HB1       LYS  53   3.431  -9.915   3.899
  381   1HG   LYS  53          HG2       LYS  53   1.534 -12.219   3.649
  382   2HG   LYS  53          HG1       LYS  53   3.175 -12.436   4.258
  383   1HD   LYS  53          HD2       LYS  53   1.244 -10.430   5.394
  384   2HD   LYS  53          HD1       LYS  53   1.388 -12.081   6.001
  385   1HE   LYS  53          HE2       LYS  53   3.646 -10.084   5.854
  386   2HE   LYS  53          HE1       LYS  53   2.717 -10.451   7.307
  387   1HZ   LYS  53          HZ1       LYS  53   3.509 -12.708   7.243
  388   2HZ   LYS  53          HZ2       LYS  53   4.838 -11.655   7.204
  389   3HZ   LYS  53          HZ3       LYS  53   4.332 -12.434   5.783
  390    H    PHE  54           HN       PHE  54   1.982  -7.213   2.880
  391    HA   PHE  54           HA       PHE  54   3.356  -7.038   0.301
  392   1HB   PHE  54          HB2       PHE  54   2.533  -4.624   0.235
  393   2HB   PHE  54          HB1       PHE  54   1.393  -5.906  -0.107
  394    HD1  PHE  54           HD1      PHE  54  -0.637  -4.727   0.362
  395    HD2  PHE  54           HD2      PHE  54   2.495  -4.879   3.239
  396    HE1  PHE  54           HE1      PHE  54  -2.158  -3.817   2.069
  397    HE2  PHE  54           HE2      PHE  54   0.981  -3.962   4.948
  398    HZ   PHE  54           HZ       PHE  54  -1.461  -3.322   4.199
  399    H    PHE  55           HN       PHE  55   5.001  -5.554   0.007
  400    HA   PHE  55           HA       PHE  55   6.268  -4.326   2.297
  401   1HB   PHE  55          HB2       PHE  55   8.409  -5.698   1.782
  402   2HB   PHE  55          HB1       PHE  55   7.163  -6.460   2.758
  403    HD1  PHE  55           HD1      PHE  55   8.575  -6.245  -0.647
  404    HD2  PHE  55           HD2      PHE  55   6.113  -8.447   2.033
  405    HE1  PHE  55           HE1      PHE  55   8.521  -8.115  -2.240
  406    HE2  PHE  55           HE2      PHE  55   6.052 -10.323   0.438
  407    HZ   PHE  55           HZ       PHE  55   7.175 -10.144  -1.709
  408    H    LEU  56           HN       LEU  56   8.490  -3.499   1.631
  409    HA   LEU  56           HA       LEU  56   8.485  -2.461  -1.087
  410   1HB   LEU  56          HB2       LEU  56  10.664  -2.148   0.979
  411   2HB   LEU  56          HB1       LEU  56  10.364  -1.147  -0.421
  412    HG   LEU  56           HG       LEU  56   8.504  -1.293   1.946
  413   1HD1  LEU  56          HD11      LEU  56  10.644   0.737   1.315
  414   2HD1  LEU  56          HD12      LEU  56  10.673  -0.425   2.642
  415   3HD1  LEU  56          HD13      LEU  56   9.458   0.852   2.615
  416   1HD2  LEU  56          HD21      LEU  56   7.573   0.743   1.008
  417   2HD2  LEU  56          HD22      LEU  56   7.488  -0.573  -0.164
  418   3HD2  LEU  56          HD23      LEU  56   8.725   0.677  -0.325
  419    H    ILE  57           HN       ILE  57   9.184  -3.879  -2.621
  420    HA   ILE  57           HA       ILE  57  11.428  -5.644  -1.911
  421    HB   ILE  57           HB       ILE  57   9.443  -6.849  -2.683
  422   1HG1  ILE  57          HG12      ILE  57  10.489  -8.116  -4.572
  423   2HG1  ILE  57          HG11      ILE  57  11.741  -6.880  -4.650
  424   1HG2  ILE  57          HG21      ILE  57   8.419  -5.159  -4.061
  425   2HG2  ILE  57          HG22      ILE  57   8.660  -6.631  -5.002
  426   3HG2  ILE  57          HG23      ILE  57   9.745  -5.257  -5.220
  427   1HD1  ILE  57          HD11      ILE  57  12.506  -8.835  -3.432
  428   2HD1  ILE  57          HD12      ILE  57  11.169  -8.668  -2.296
  429   3HD1  ILE  57          HD13      ILE  57  12.423  -7.429  -2.371
  430    H    SER  58           HN       SER  58  13.294  -5.619  -3.121
  431    HA   SER  58           HA       SER  58  13.581  -3.232  -4.796
  432   1HB   SER  58          HB2       SER  58  14.995  -3.678  -2.652
  433   2HB   SER  58          HB1       SER  58  15.889  -4.798  -3.680
  434    HG   SER  58           HG       SER  58  16.752  -3.178  -4.732
  435    H    ASP  59           HN       ASP  59  14.829  -3.327  -6.690
  436    HA   ASP  59           HA       ASP  59  14.071  -5.205  -8.527
  437   1HB   ASP  59          HB2       ASP  59  14.903  -3.140  -9.314
  438   2HB   ASP  59          HB1       ASP  59  16.434  -3.341  -8.471
  439    H    ASN  60           HN       ASN  60  17.076  -5.239  -6.642
  440    HA   ASN  60           HA       ASN  60  18.299  -7.340  -8.076
  441   1HB   ASN  60          HB2       ASN  60  19.567  -5.806  -6.641
  442   2HB   ASN  60          HB1       ASN  60  18.769  -6.468  -5.217
  443   1HD2  ASN  60          HD21      ASN  60  21.034  -7.110  -7.786
  444   2HD2  ASN  60          HD22      ASN  60  21.799  -8.475  -7.045
  445    H    ASN  61           HN       ASN  61  15.796  -7.358  -5.739
  446    HA   ASN  61           HA       ASN  61  14.652  -8.977  -4.647
  447   1HB   ASN  61          HB2       ASN  61  14.538 -10.001  -6.920
  448   2HB   ASN  61          HB1       ASN  61  16.005 -10.902  -6.559
  449   1HD2  ASN  61          HD21      ASN  61  12.611 -10.603  -6.001
  450   2HD2  ASN  61          HD22      ASN  61  12.404 -12.113  -5.163
  451    H    ARG  62           HN       ARG  62  15.772  -8.618  -2.731
  452    HA   ARG  62           HA       ARG  62  17.438 -10.792  -1.824
  453   1HB   ARG  62          HB2       ARG  62  19.234  -9.191  -1.009
  454   2HB   ARG  62          HB1       ARG  62  19.215  -9.523  -2.736
  455   1HG   ARG  62          HG2       ARG  62  18.355  -7.413  -3.251
  456   2HG   ARG  62          HG1       ARG  62  17.841  -7.120  -1.589
  457   1HD   ARG  62          HD2       ARG  62  20.720  -7.427  -2.408
  458   2HD   ARG  62          HD1       ARG  62  19.893  -5.870  -2.320
  459    HE   ARG  62           HE       ARG  62  19.420  -6.706   0.115
  460   1HH1  ARG  62          HH11      ARG  62  22.366  -7.213  -1.702
  461   2HH1  ARG  62          HH12      ARG  62  23.394  -7.104  -0.304
  462   1HH2  ARG  62          HH21      ARG  62  20.733  -6.571   1.930
  463   2HH2  ARG  62          HH22      ARG  62  22.458  -6.743   1.783
  464    H    ASP  63           HN       ASP  63  16.055  -7.621  -1.177
  465    HA   ASP  63           HA       ASP  63  15.434  -8.517   1.541
  466   1HB   ASP  63          HB2       ASP  63  16.709  -5.929   0.696
  467   2HB   ASP  63          HB1       ASP  63  15.715  -5.998   2.149
  468    H    LYS  64           HN       LYS  64  13.573  -7.574   2.463
  469    HA   LYS  64           HA       LYS  64  11.888  -5.899   0.826
  470   1HB   LYS  64          HB2       LYS  64   9.950  -7.499   0.959
  471   2HB   LYS  64          HB1       LYS  64  11.236  -7.985  -0.130
  472   1HG   LYS  64          HG2       LYS  64  10.842  -9.968   0.893
  473   2HG   LYS  64          HG1       LYS  64  12.056  -9.321   1.991
  474   1HD   LYS  64          HD2       LYS  64  10.175  -8.440   3.405
  475   2HD   LYS  64          HD1       LYS  64   9.063  -9.336   2.372
  476   1HE   LYS  64          HE2       LYS  64   9.553 -10.647   4.334
  477   2HE   LYS  64          HE1       LYS  64  10.275 -11.419   2.919
  478   1HZ   LYS  64          HZ1       LYS  64  11.794 -11.412   4.789
  479   2HZ   LYS  64          HZ2       LYS  64  11.707  -9.721   4.898
  480   3HZ   LYS  64          HZ3       LYS  64  12.410 -10.451   3.533
  481    H    LEU  65           HN       LEU  65  10.782  -4.550   2.085
  482    HA   LEU  65           HA       LEU  65  10.720  -5.163   4.969
  483   1HB   LEU  65          HB2       LEU  65  10.528  -2.374   3.940
  484   2HB   LEU  65          HB1       LEU  65  11.164  -2.964   5.466
  485    HG   LEU  65           HG       LEU  65  12.518  -3.272   2.799
  486   1HD1  LEU  65          HD11      LEU  65  13.147  -1.417   5.086
  487   2HD1  LEU  65          HD12      LEU  65  12.447  -0.943   3.539
  488   3HD1  LEU  65          HD13      LEU  65  14.085  -1.596   3.604
  489   1HD2  LEU  65          HD21      LEU  65  13.085  -5.067   4.349
  490   2HD2  LEU  65          HD22      LEU  65  13.492  -3.880   5.589
  491   3HD2  LEU  65          HD23      LEU  65  14.457  -3.983   4.117
  492    H    TYR  66           HN       TYR  66   8.742  -5.472   5.768
  493    HA   TYR  66           HA       TYR  66   6.447  -5.140   4.139
  494   1HB   TYR  66          HB2       TYR  66   6.707  -5.751   7.086
  495   2HB   TYR  66          HB1       TYR  66   5.191  -5.807   6.192
  496    HD1  TYR  66           HD1      TYR  66   8.480  -7.409   6.629
  497    HD2  TYR  66           HD2      TYR  66   4.682  -7.640   4.731
  498    HE1  TYR  66           HE1      TYR  66   8.935  -9.744   6.015
  499    HE2  TYR  66           HE2      TYR  66   5.127  -9.976   4.110
  500    HH   TYR  66           HH       TYR  66   7.109 -11.440   3.727
  501    H    VAL  67           HN       VAL  67   5.077  -3.499   3.957
  502    HA   VAL  67           HA       VAL  67   5.456  -1.203   5.756
  503    HB   VAL  67           HB       VAL  67   4.836   0.241   3.792
  504   1HG1  VAL  67          HG11      VAL  67   7.105   0.119   4.607
  505   2HG1  VAL  67          HG12      VAL  67   7.111   0.186   2.842
  506   3HG1  VAL  67          HG13      VAL  67   7.395  -1.348   3.669
  507   1HG2  VAL  67          HG21      VAL  67   5.471  -2.272   2.241
  508   2HG2  VAL  67          HG22      VAL  67   5.220  -0.667   1.552
  509   3HG2  VAL  67          HG23      VAL  67   3.889  -1.500   2.358
  510    H    ASN  68           HN       ASN  68   3.728  -0.637   6.829
  511    HA   ASN  68           HA       ASN  68   1.118  -1.517   5.850
  512   1HB   ASN  68          HB2       ASN  68   2.102  -0.665   8.558
  513   2HB   ASN  68          HB1       ASN  68   0.384  -0.612   8.183
  514   1HD2  ASN  68          HD21      ASN  68   3.114  -2.632   8.806
  515   2HD2  ASN  68          HD22      ASN  68   2.248  -4.124   8.911
  516    H    ILE  69           HN       ILE  69   0.097  -0.158   4.617
  517    HA   ILE  69           HA       ILE  69   0.826   2.604   4.452
  518    HB   ILE  69           HB       ILE  69  -1.630   1.517   3.139
  519   1HG1  ILE  69          HG12      ILE  69   1.196   0.932   2.222
  520   2HG1  ILE  69          HG11      ILE  69   0.112  -0.251   2.946
  521   1HG2  ILE  69          HG21      ILE  69  -0.976   2.994   1.355
  522   2HG2  ILE  69          HG22      ILE  69   0.585   3.294   2.121
  523   3HG2  ILE  69          HG23      ILE  69  -0.895   3.878   2.879
  524   1HD1  ILE  69          HD11      ILE  69  -1.416  -0.008   1.073
  525   2HD1  ILE  69          HD12      ILE  69   0.200  -0.461   0.523
  526   3HD1  ILE  69          HD13      ILE  69  -0.356   1.207   0.357
  527    H    ARG  70           HN       ARG  70   0.297   3.464   6.472
  528    HA   ARG  70           HA       ARG  70  -2.470   3.283   7.383
  529   1HB   ARG  70          HB2       ARG  70  -0.022   4.456   8.734
  530   2HB   ARG  70          HB1       ARG  70  -1.615   4.301   9.467
  531   1HG   ARG  70          HG2       ARG  70  -1.491   1.943   9.467
  532   2HG   ARG  70          HG1       ARG  70  -0.073   1.946   8.421
  533   1HD   ARG  70          HD2       ARG  70   1.228   3.004  10.221
  534   2HD   ARG  70          HD1       ARG  70  -0.195   2.952  11.263
  535    HE   ARG  70           HE       ARG  70  -0.076   0.444  10.910
  536   1HH1  ARG  70          HH11      ARG  70   2.759   2.501  10.948
  537   2HH1  ARG  70          HH12      ARG  70   3.852   1.209  11.320
  538   1HH2  ARG  70          HH21      ARG  70   1.345  -1.252  11.411
  539   2HH2  ARG  70          HH22      ARG  70   3.053  -0.955  11.570
  540    HA   PRO  71           HA       PRO  71  -3.795   7.118   5.715
  541   1HB   PRO  71          HB2       PRO  71  -4.957   7.592   8.425
  542   2HB   PRO  71          HB1       PRO  71  -5.726   7.694   6.835
  543   1HG   PRO  71          HG2       PRO  71  -6.172   5.603   8.418
  544   2HG   PRO  71          HG1       PRO  71  -5.983   5.392   6.667
  545   1HD   PRO  71          HD2       PRO  71  -4.064   4.786   8.867
  546   2HD   PRO  71          HD1       PRO  71  -4.335   3.932   7.335
  547    H    MET  72           HN       MET  72  -2.835   9.028   5.484
  548    HA   MET  72           HA       MET  72  -0.797   9.867   7.314
  549   1HB   MET  72          HB2       MET  72  -0.558  10.178   4.886
  550   2HB   MET  72          HB1       MET  72  -1.948  11.254   4.882
  551   1HG   MET  72          HG2       MET  72   0.061  12.547   4.763
  552   2HG   MET  72          HG1       MET  72  -0.712  12.817   6.322
  553   1HE   MET  72          HE1       MET  72   1.513  13.922   7.215
  554   2HE   MET  72          HE2       MET  72   2.295  13.638   5.658
  555   3HE   MET  72          HE3       MET  72   3.095  13.142   7.151
  556    H    ASP  73           HN       ASP  73  -2.293   9.981   9.140
  557    HA   ASP  73           HA       ASP  73  -3.608  11.025  10.657
  558   1HB   ASP  73          HB2       ASP  73  -1.714  12.595  10.656
  559   2HB   ASP  73          HB1       ASP  73  -2.476  13.518   9.364
  560    H    ASN  74           HN       ASN  74  -5.479  10.180   9.563
  561    HA   ASN  74           HA       ASN  74  -7.252  12.296   8.637
  562   1HB   ASN  74          HB2       ASN  74  -6.301  10.063   6.901
  563   2HB   ASN  74          HB1       ASN  74  -7.993  10.531   6.781
  564   1HD2  ASN  74          HD21      ASN  74  -4.716  11.447   6.145
  565   2HD2  ASN  74          HD22      ASN  74  -5.075  12.855   5.214
  566    H    SER  75           HN       SER  75  -7.087   8.734   8.931
  567    HA   SER  75           HA       SER  75  -9.414   8.758  10.662
  568   1HB   SER  75          HB2       SER  75  -9.461   7.237   8.046
  569   2HB   SER  75          HB1       SER  75 -10.740   7.288   9.256
  570    HG   SER  75           HG       SER  75 -11.222   9.328   8.701
  571    H    ALA  76           HN       ALA  76 -10.060   6.329  11.052
  572    HA   ALA  76           HA       ALA  76  -7.578   4.823  11.536
  573   1HB   ALA  76          HB1       ALA  76  -8.900   5.402  13.536
  574   2HB   ALA  76          HB2       ALA  76  -8.791   3.661  13.287
  575   3HB   ALA  76          HB3       ALA  76 -10.273   4.520  12.866
  576    H    TRP  77           HN       TRP  77  -7.228   3.101  10.311
  577    HA   TRP  77           HA       TRP  77  -9.506   1.916   8.859
  578   1HB   TRP  77          HB2       TRP  77  -6.626   2.317   8.103
  579   2HB   TRP  77          HB1       TRP  77  -7.607   1.110   7.295
  580    HD1  TRP  77           HD1      TRP  77  -9.165   4.511   8.188
  581    HE1  TRP  77           HE1      TRP  77  -9.665   5.776   5.985
  582    HE3  TRP  77           HE3      TRP  77  -6.816   1.375   4.906
  583    HZ2  TRP  77           HZ2      TRP  77  -9.116   5.461   3.231
  584    HZ3  TRP  77           HZ3      TRP  77  -6.849   1.928   2.511
  585    HH2  TRP  77           HH2      TRP  77  -7.977   3.927   1.693
  586    H    THR  78           HN       THR  78  -9.168  -0.403   8.264
  587    HA   THR  78           HA       THR  78  -8.173  -1.947  10.518
  588    HB   THR  78           HB       THR  78  -9.448  -2.936   7.953
  589    HG1  THR  78           HG1      THR  78 -10.764  -2.521  10.453
  590   1HG2  THR  78          HG21      THR  78  -9.208  -4.225  10.677
  591   2HG2  THR  78          HG22      THR  78  -8.241  -4.643   9.262
  592   3HG2  THR  78          HG23      THR  78  -9.982  -4.927   9.256
  593    H    THR  79           HN       THR  79  -6.313  -3.140  10.465
  594    HA   THR  79           HA       THR  79  -4.628  -2.647   8.115
  595    HB   THR  79           HB       THR  79  -3.808  -1.495  10.044
  596    HG1  THR  79           HG1      THR  79  -2.367  -3.275   8.748
  597   1HG2  THR  79          HG21      THR  79  -4.919  -2.817  11.782
  598   2HG2  THR  79          HG22      THR  79  -3.202  -2.600  12.127
  599   3HG2  THR  79          HG23      THR  79  -3.785  -4.140  11.496
  600    H    ASP  80           HN       ASP  80  -4.465  -4.346   6.857
  601    HA   ASP  80           HA       ASP  80  -3.555  -6.860   8.100
  602   1HB   ASP  80          HB2       ASP  80  -5.877  -7.017   7.017
  603   2HB   ASP  80          HB1       ASP  80  -5.075  -6.711   5.483
  604    H    ASN  81           HN       ASN  81  -2.028  -8.067   6.600
  605    HA   ASN  81           HA       ASN  81  -0.300  -6.113   5.324
  606   1HB   ASN  81          HB2       ASN  81   0.040  -9.039   5.920
  607   2HB   ASN  81          HB1       ASN  81   1.174  -8.159   4.905
  608   1HD2  ASN  81          HD21      ASN  81   2.442  -6.522   5.810
  609   2HD2  ASN  81          HD22      ASN  81   2.725  -6.438   7.521
  610    H    GLY  82           HN       GLY  82  -2.873  -7.985   4.373
  611   1HA   GLY  82          HA2       GLY  82  -1.866  -8.227   1.642
  612   2HA   GLY  82          HA1       GLY  82  -3.340  -8.959   2.262
  613    H    VAL  83           HN       VAL  83  -4.356  -6.618   3.531
  614    HA   VAL  83           HA       VAL  83  -4.720  -4.733   1.334
  615    HB   VAL  83           HB       VAL  83  -7.161  -4.685   1.641
  616   1HG1  VAL  83          HG11      VAL  83  -7.684  -6.776   0.462
  617   2HG1  VAL  83          HG12      VAL  83  -6.082  -7.396   0.872
  618   3HG1  VAL  83          HG13      VAL  83  -6.240  -5.993  -0.186
  619   1HG2  VAL  83          HG21      VAL  83  -6.719  -7.126   3.360
  620   2HG2  VAL  83          HG22      VAL  83  -8.285  -6.521   2.824
  621   3HG2  VAL  83          HG23      VAL  83  -7.290  -5.550   3.909
  622    H    PHE  84           HN       PHE  84  -5.621  -2.715   2.009
  623    HA   PHE  84           HA       PHE  84  -5.662  -2.309   4.917
  624   1HB   PHE  84          HB2       PHE  84  -3.590  -1.430   3.335
  625   2HB   PHE  84          HB1       PHE  84  -4.652  -0.026   3.360
  626    HD1  PHE  84           HD1      PHE  84  -5.534   0.667   5.734
  627    HD2  PHE  84           HD2      PHE  84  -2.078  -1.717   5.037
  628    HE1  PHE  84           HE1      PHE  84  -4.680   1.259   7.965
  629    HE2  PHE  84           HE2      PHE  84  -1.214  -1.123   7.258
  630    HZ   PHE  84           HZ       PHE  84  -2.517   0.364   8.731
  631    H    TYR  85           HN       TYR  85  -7.706  -1.760   5.351
  632    HA   TYR  85           HA       TYR  85  -9.035   0.213   3.668
  633   1HB   TYR  85          HB2       TYR  85 -10.996  -1.139   3.278
  634   2HB   TYR  85          HB1       TYR  85  -9.590  -2.008   2.697
  635    HD1  TYR  85           HD1      TYR  85 -12.534  -2.239   4.647
  636    HD2  TYR  85           HD2      TYR  85  -8.568  -3.757   4.346
  637    HE1  TYR  85           HE1      TYR  85 -13.178  -4.187   6.006
  638    HE2  TYR  85           HE2      TYR  85  -9.207  -5.707   5.700
  639    HH   TYR  85           HH       TYR  85 -10.858  -6.378   7.286
  640    H    LYS  86           HN       LYS  86 -10.714   1.318   4.728
  641    HA   LYS  86           HA       LYS  86 -10.703   1.022   7.590
  642   1HB   LYS  86          HB2       LYS  86 -11.982   2.974   7.735
  643   2HB   LYS  86          HB1       LYS  86 -10.907   3.266   6.383
  644   1HG   LYS  86          HG2       LYS  86 -13.624   2.190   5.837
  645   2HG   LYS  86          HG1       LYS  86 -13.465   3.878   6.309
  646   1HD   LYS  86          HD2       LYS  86 -11.799   4.143   4.450
  647   2HD   LYS  86          HD1       LYS  86 -12.228   2.511   3.924
  648   1HE   LYS  86          HE2       LYS  86 -14.549   3.193   3.635
  649   2HE   LYS  86          HE1       LYS  86 -14.165   4.809   4.229
  650   1HZ   LYS  86          HZ1       LYS  86 -12.967   3.614   1.801
  651   2HZ   LYS  86          HZ2       LYS  86 -12.821   5.211   2.336
  652   3HZ   LYS  86          HZ3       LYS  86 -14.318   4.635   1.793
  653    H    ASN  87           HN       ASN  87 -12.297   0.229   8.849
  654    HA   ASN  87           HA       ASN  87 -13.919  -1.821   7.878
  655   1HB   ASN  87          HB2       ASN  87 -13.235  -1.591  10.244
  656   2HB   ASN  87          HB1       ASN  87 -14.305  -0.201  10.408
  657   1HD2  ASN  87          HD21      ASN  87 -14.105  -3.661  10.122
  658   2HD2  ASN  87          HD22      ASN  87 -15.752  -3.993  10.529
  659    H    ASP  88           HN       ASP  88 -14.568   1.586   8.340
  660    HA   ASP  88           HA       ASP  88 -17.347   1.604   7.974
  661   1HB   ASP  88          HB2       ASP  88 -15.238   3.685   7.392
  662   2HB   ASP  88          HB1       ASP  88 -16.958   3.988   7.179
  663    H    VAL  89           HN       VAL  89 -18.511   1.024   6.267
  664    HA   VAL  89           HA       VAL  89 -17.334   0.915   3.635
  665    HB   VAL  89           HB       VAL  89 -19.669   0.296   2.894
  666   1HG1  VAL  89          HG11      VAL  89 -17.997  -1.400   3.380
  667   2HG1  VAL  89          HG12      VAL  89 -19.597  -1.942   3.886
  668   3HG1  VAL  89          HG13      VAL  89 -18.440  -1.368   5.085
  669   1HG2  VAL  89          HG21      VAL  89 -21.279  -0.355   4.635
  670   2HG2  VAL  89          HG22      VAL  89 -20.949   1.377   4.662
  671   3HG2  VAL  89          HG23      VAL  89 -20.211   0.320   5.864
  672    H    GLY  90           HN       GLY  90 -16.920   2.830   2.682
  673   1HA   GLY  90          HA2       GLY  90 -18.911   4.468   1.683
  674   2HA   GLY  90          HA1       GLY  90 -18.438   5.176   3.219
  675    H    SER  91           HN       SER  91 -17.804   7.007   1.895
  676    HA   SER  91           HA       SER  91 -15.568   6.662   0.107
  677   1HB   SER  91          HB2       SER  91 -16.949   9.190   1.037
  678   2HB   SER  91          HB1       SER  91 -15.843   9.045  -0.330
  679    HG   SER  91           HG       SER  91 -18.447   8.737  -0.368
  680    H    TRP  92           HN       TRP  92 -13.642   8.052   0.360
  681    HA   TRP  92           HA       TRP  92 -12.957   8.876   3.058
  682   1HB   TRP  92          HB2       TRP  92 -12.366   6.436   2.850
  683   2HB   TRP  92          HB1       TRP  92 -11.202   6.912   1.607
  684    HD1  TRP  92           HD1      TRP  92 -11.910   7.507   5.365
  685    HE1  TRP  92           HE1      TRP  92  -9.674   8.101   6.502
  686    HE3  TRP  92           HE3      TRP  92  -8.972   7.664   1.225
  687    HZ2  TRP  92           HZ2      TRP  92  -6.986   8.563   5.704
  688    HZ3  TRP  92           HZ3      TRP  92  -6.611   8.195   1.468
  689    HH2  TRP  92           HH2      TRP  92  -5.618   8.631   3.661
  690    H    GLY  93           HN       GLY  93 -11.424   8.169  -0.031
  691   1HA   GLY  93          HA2       GLY  93  -9.863   9.363  -1.262
  692   2HA   GLY  93          HA1       GLY  93 -11.148  10.543  -1.229
  693    H    GLY  94           HN       GLY  94  -8.017   9.666   0.016
  694   1HA   GLY  94          HA2       GLY  94  -7.514  12.416   0.702
  695   2HA   GLY  94          HA1       GLY  94  -7.548  11.346   2.096
  696    H    THR  95           HN       THR  95  -5.542  10.905   2.723
  697    HA   THR  95           HA       THR  95  -3.571  10.152   0.684
  698    HB   THR  95           HB       THR  95  -1.861  11.379   2.208
  699    HG1  THR  95           HG1      THR  95  -3.249  13.401   2.915
  700   1HG2  THR  95          HG21      THR  95  -2.157  13.464   0.949
  701   2HG2  THR  95          HG22      THR  95  -3.770  12.940   0.463
  702   3HG2  THR  95          HG23      THR  95  -2.350  12.051  -0.088
  703    H    ILE  96           HN       ILE  96  -2.421   8.390   1.164
  704    HA   ILE  96           HA       ILE  96  -2.205   7.527   3.971
  705    HB   ILE  96           HB       ILE  96  -2.134   5.203   2.363
  706   1HG1  ILE  96          HG12      ILE  96  -4.320   7.115   1.648
  707   2HG1  ILE  96          HG11      ILE  96  -3.352   6.099   0.593
  708   1HG2  ILE  96          HG21      ILE  96  -4.057   4.542   3.721
  709   2HG2  ILE  96          HG22      ILE  96  -4.241   6.209   4.264
  710   3HG2  ILE  96          HG23      ILE  96  -2.796   5.295   4.697
  711   1HD1  ILE  96          HD11      ILE  96  -5.496   5.130   2.463
  712   2HD1  ILE  96          HD12      ILE  96  -4.538   4.129   1.372
  713   3HD1  ILE  96          HD13      ILE  96  -5.653   5.328   0.718
  714    H    GLY  97           HN       GLY  97  -0.188   6.750   4.553
  715   1HA   GLY  97          HA2       GLY  97   1.855   7.340   2.510
  716   2HA   GLY  97          HA1       GLY  97   2.062   7.587   4.237
  717    H    ILE  98           HN       ILE  98   3.804   6.153   2.478
  718    HA   ILE  98           HA       ILE  98   3.460   3.388   3.347
  719    HB   ILE  98           HB       ILE  98   5.286   4.675   1.326
  720   1HG1  ILE  98          HG12      ILE  98   4.221   2.862  -0.116
  721   2HG1  ILE  98          HG11      ILE  98   3.102   2.601   1.224
  722   1HG2  ILE  98          HG21      ILE  98   6.277   2.463   0.933
  723   2HG2  ILE  98          HG22      ILE  98   5.408   1.840   2.335
  724   3HG2  ILE  98          HG23      ILE  98   6.642   3.083   2.543
  725   1HD1  ILE  98          HD11      ILE  98   2.319   4.893   1.018
  726   2HD1  ILE  98          HD12      ILE  98   2.138   4.017  -0.502
  727   3HD1  ILE  98          HD13      ILE  98   3.455   5.171  -0.301
  728    H    TYR  99           HN       TYR  99   4.351   2.760   5.157
  729    HA   TYR  99           HA       TYR  99   6.832   4.057   6.074
  730   1HB   TYR  99          HB2       TYR  99   4.903   2.927   8.064
  731   2HB   TYR  99          HB1       TYR  99   6.056   4.240   8.251
  732    HD1  TYR  99           HD1      TYR  99   5.488   6.499   7.408
  733    HD2  TYR  99           HD2      TYR  99   2.650   3.342   7.402
  734    HE1  TYR  99           HE1      TYR  99   3.680   8.136   7.160
  735    HE2  TYR  99           HE2      TYR  99   0.833   4.976   7.139
  736    HH   TYR  99           HH       TYR  99   0.360   7.285   7.462
  737    H    VAL 100           HN       VAL 100   8.455   2.617   6.570
  738    HA   VAL 100           HA       VAL 100   8.085  -0.173   6.220
  739    HB   VAL 100           HB       VAL 100  10.290   0.871   5.902
  740   1HG1  VAL 100          HG11      VAL 100  10.343   1.176   8.900
  741   2HG1  VAL 100          HG12      VAL 100  10.261   2.488   7.725
  742   3HG1  VAL 100          HG13      VAL 100  11.696   1.466   7.808
  743   1HG2  VAL 100          HG21      VAL 100  10.146  -1.517   6.309
  744   2HG2  VAL 100          HG22      VAL 100  10.244  -1.240   8.049
  745   3HG2  VAL 100          HG23      VAL 100  11.619  -0.852   7.016
  746    H    ASP 101           HN       ASP 101   7.126  -1.554   7.587
  747    HA   ASP 101           HA       ASP 101   6.282  -0.668  10.176
  748   1HB   ASP 101          HB2       ASP 101   4.965  -2.233   8.708
  749   2HB   ASP 101          HB1       ASP 101   6.152  -3.482   9.074
  750    H    GLY 102           HN       GLY 102   8.172  -0.199  11.228
  751   1HA   GLY 102          HA2       GLY 102   9.675  -0.966  12.929
  752   2HA   GLY 102          HA1       GLY 102   9.806  -2.495  12.064
  753    H    GLN 103           HN       GLN 103  10.831   0.821  12.230
  754    HA   GLN 103           HA       GLN 103  12.310   1.472  10.160
  755   1HB   GLN 103          HB2       GLN 103  14.133   2.215  11.789
  756   2HB   GLN 103          HB1       GLN 103  12.508   2.811  12.071
  757   1HG   GLN 103          HG2       GLN 103  12.169   1.127  13.793
  758   2HG   GLN 103          HG1       GLN 103  13.795   0.510  13.510
  759   1HE2  GLN 103          HE21      GLN 103  12.477   1.720  15.870
  760   2HE2  GLN 103          HE22      GLN 103  13.523   3.005  16.361
  761    H    GLN 104           HN       GLN 104  13.263   0.136   8.748
  762    HA   GLN 104           HA       GLN 104  14.951  -2.042   9.596
  763   1HB   GLN 104          HB2       GLN 104  13.500  -2.142   7.572
  764   2HB   GLN 104          HB1       GLN 104  14.511  -0.915   6.825
  765   1HG   GLN 104          HG2       GLN 104  15.114  -3.078   5.983
  766   2HG   GLN 104          HG1       GLN 104  16.433  -2.444   6.964
  767   1HE2  GLN 104          HE21      GLN 104  17.266  -4.501   7.295
  768   2HE2  GLN 104          HE22      GLN 104  16.517  -5.630   8.377
  769    H    THR 105           HN       THR 105  15.354   1.266   9.021
  770    HA   THR 105           HA       THR 105  17.128   2.663   8.965
  771    HB   THR 105           HB       THR 105  18.817   0.338   9.907
  772    HG1  THR 105           HG1      THR 105  17.816   0.461  11.793
  773   1HG2  THR 105          HG21      THR 105  20.040   2.407   9.379
  774   2HG2  THR 105          HG22      THR 105  20.042   2.096  11.114
  775   3HG2  THR 105          HG23      THR 105  18.961   3.315  10.440
  776    H    ASN 106           HN       ASN 106  16.480   0.873   6.662
  777    HA   ASN 106           HA       ASN 106  17.094   0.796   4.492
  778   1HB   ASN 106          HB2       ASN 106  17.666   3.167   4.913
  779   2HB   ASN 106          HB1       ASN 106  19.300   2.680   5.330
  780   1HD2  ASN 106          HD21      ASN 106  20.703   2.035   3.703
  781   2HD2  ASN 106          HD22      ASN 106  20.377   2.355   2.035
  782    H    THR 107           HN       THR 107  17.627  -1.387   4.598
  783    HA   THR 107           HA       THR 107  20.427  -2.136   4.861
  784    HB   THR 107           HB       THR 107  18.014  -3.823   4.115
  785    HG1  THR 107           HG1      THR 107  19.236  -3.212   6.614
  786   1HG2  THR 107          HG21      THR 107  20.752  -4.651   5.104
  787   2HG2  THR 107          HG22      THR 107  20.158  -4.836   3.454
  788   3HG2  THR 107          HG23      THR 107  19.398  -5.731   4.769
  789    HA   PRO 108           HA       PRO 108  22.098  -1.240   0.935
  790   1HB   PRO 108          HB2       PRO 108  22.159  -4.221   0.629
  791   2HB   PRO 108          HB1       PRO 108  23.405  -3.028   0.242
  792   1HG   PRO 108          HG2       PRO 108  23.273  -4.472   2.605
  793   2HG   PRO 108          HG1       PRO 108  24.161  -2.955   2.384
  794   1HD   PRO 108          HD2       PRO 108  21.908  -3.398   4.064
  795   2HD   PRO 108          HD1       PRO 108  22.684  -1.844   3.702
  796    HA   PRO 109           HA       PRO 109  18.271  -2.013  -1.390
  797   1HB   PRO 109          HB2       PRO 109  17.414   0.519  -1.457
  798   2HB   PRO 109          HB1       PRO 109  17.281  -0.463   0.005
  799   1HG   PRO 109          HG2       PRO 109  19.068   1.799  -0.573
  800   2HG   PRO 109          HG1       PRO 109  18.545   1.147   0.985
  801   1HD   PRO 109          HD2       PRO 109  21.008   0.647  -0.441
  802   2HD   PRO 109          HD1       PRO 109  20.521   0.092   1.174
  803    H    GLY 110           HN       GLY 110  17.341  -0.176  -3.136
  804   1HA   GLY 110          HA2       GLY 110  19.234   1.007  -4.858
  805   2HA   GLY 110          HA1       GLY 110  18.790  -0.581  -5.472
  806    H    ASN 111           HN       ASN 111  16.902  -0.825  -6.517
  807    HA   ASN 111           HA       ASN 111  15.064   1.478  -6.561
  808   1HB   ASN 111          HB2       ASN 111  15.498  -0.665  -8.660
  809   2HB   ASN 111          HB1       ASN 111  14.310   0.628  -8.765
  810   1HD2  ASN 111          HD21      ASN 111  14.996   2.733  -9.158
  811   2HD2  ASN 111          HD22      ASN 111  16.569   3.071  -9.790
  812    H    TYR 112           HN       TYR 112  13.344   1.100  -5.308
  813    HA   TYR 112           HA       TYR 112  12.509  -1.664  -4.876
  814   1HB   TYR 112          HB2       TYR 112  12.062   0.883  -3.364
  815   2HB   TYR 112          HB1       TYR 112  10.952  -0.467  -3.150
  816    HD1  TYR 112           HD1      TYR 112  11.468  -2.182  -1.687
  817    HD2  TYR 112           HD2      TYR 112  14.566   0.414  -2.979
  818    HE1  TYR 112           HE1      TYR 112  12.996  -3.225  -0.071
  819    HE2  TYR 112           HE2      TYR 112  16.103  -0.623  -1.377
  820    HH   TYR 112           HH       TYR 112  15.416  -3.510   0.260
  821    H    THR 113           HN       THR 113  10.736  -2.474  -5.661
  822    HA   THR 113           HA       THR 113   8.992  -0.692  -7.230
  823    HB   THR 113           HB       THR 113   9.646  -3.585  -7.754
  824    HG1  THR 113           HG1      THR 113  11.398  -1.997  -8.046
  825   1HG2  THR 113          HG21      THR 113   8.224  -1.524  -9.443
  826   2HG2  THR 113          HG22      THR 113   7.474  -2.905  -8.644
  827   3HG2  THR 113          HG23      THR 113   8.626  -3.164  -9.955
  828    H    LEU 114           HN       LEU 114   7.340  -0.413  -5.808
  829    HA   LEU 114           HA       LEU 114   5.984  -2.852  -4.892
  830   1HB   LEU 114          HB2       LEU 114   5.035  -1.327  -3.063
  831   2HB   LEU 114          HB1       LEU 114   6.687  -1.879  -2.902
  832    HG   LEU 114           HG       LEU 114   6.249   0.768  -4.190
  833   1HD1  LEU 114          HD11      LEU 114   4.734   0.809  -2.257
  834   2HD1  LEU 114          HD12      LEU 114   6.118   1.876  -2.027
  835   3HD1  LEU 114          HD13      LEU 114   6.064   0.312  -1.212
  836   1HD2  LEU 114          HD21      LEU 114   8.316   1.281  -2.973
  837   2HD2  LEU 114          HD22      LEU 114   8.494  -0.148  -3.993
  838   3HD2  LEU 114          HD23      LEU 114   8.283  -0.328  -2.251
  839    H    THR 115           HN       THR 115   4.431  -3.133  -6.368
  840    HA   THR 115           HA       THR 115   2.981  -0.843  -7.413
  841    HB   THR 115           HB       THR 115   2.596  -3.769  -8.069
  842    HG1  THR 115           HG1      THR 115   4.542  -3.515  -8.907
  843   1HG2  THR 115          HG21      THR 115   0.728  -2.336  -8.732
  844   2HG2  THR 115          HG22      THR 115   1.617  -2.889 -10.152
  845   3HG2  THR 115          HG23      THR 115   1.844  -1.245  -9.554
  846    H    LEU 116           HN       LEU 116   0.969  -0.269  -6.832
  847    HA   LEU 116           HA       LEU 116  -0.407  -1.974  -4.866
  848   1HB   LEU 116          HB2       LEU 116  -0.350   1.019  -5.166
  849   2HB   LEU 116          HB1       LEU 116  -1.456   0.183  -4.093
  850    HG   LEU 116           HG       LEU 116   1.559   0.138  -3.895
  851   1HD1  LEU 116          HD11      LEU 116  -0.507   1.525  -2.194
  852   2HD1  LEU 116          HD12      LEU 116   0.614   2.305  -3.310
  853   3HD1  LEU 116          HD13      LEU 116   1.227   1.474  -1.879
  854   1HD2  LEU 116          HD21      LEU 116   1.182  -0.996  -1.756
  855   2HD2  LEU 116          HD22      LEU 116   0.558  -1.942  -3.106
  856   3HD2  LEU 116          HD23      LEU 116  -0.553  -1.033  -2.082
  857    H    THR 117           HN       THR 117  -2.286  -2.767  -5.441
  858    HA   THR 117           HA       THR 117  -3.537  -1.875  -7.918
  859    HB   THR 117           HB       THR 117  -4.311  -4.189  -6.130
  860    HG1  THR 117           HG1      THR 117  -2.158  -3.891  -7.681
  861   1HG2  THR 117          HG21      THR 117  -6.082  -3.480  -7.651
  862   2HG2  THR 117          HG22      THR 117  -5.422  -5.036  -8.154
  863   3HG2  THR 117          HG23      THR 117  -4.965  -3.565  -9.013
  864    H    GLY 118           HN       GLY 118  -4.955  -0.249  -7.761
  865   1HA   GLY 118          HA2       GLY 118  -6.378   0.321  -5.328
  866   2HA   GLY 118          HA1       GLY 118  -6.567   1.148  -6.869
  867    H    GLY 119           HN       GLY 119  -8.219  -0.587  -4.682
  868   1HA   GLY 119          HA2       GLY 119 -10.365  -1.112  -6.481
  869   2HA   GLY 119          HA1       GLY 119  -9.549  -2.600  -6.028
  870    H    TYR 120           HN       TYR 120 -11.950  -2.799  -5.285
  871    HA   TYR 120           HA       TYR 120 -12.148  -1.727  -2.567
  872   1HB   TYR 120          HB2       TYR 120 -14.502  -2.133  -2.614
  873   2HB   TYR 120          HB1       TYR 120 -14.074  -1.288  -4.092
  874    HD1  TYR 120           HD1      TYR 120 -15.243  -4.460  -2.663
  875    HD2  TYR 120           HD2      TYR 120 -14.305  -2.361  -6.252
  876    HE1  TYR 120           HE1      TYR 120 -16.340  -6.224  -3.979
  877    HE2  TYR 120           HE2      TYR 120 -15.408  -4.117  -7.568
  878    HH   TYR 120           HH       TYR 120 -17.313  -6.602  -6.121
  879    H    TRP 121           HN       TRP 121 -13.550  -3.334  -1.199
  880    HA   TRP 121           HA       TRP 121 -12.591  -6.069  -1.438
  881   1HB   TRP 121          HB2       TRP 121 -10.754  -5.306  -0.209
  882   2HB   TRP 121          HB1       TRP 121 -11.691  -4.082   0.636
  883    HD1  TRP 121           HD1      TRP 121 -13.541  -5.199   2.426
  884    HE1  TRP 121           HE1      TRP 121 -13.160  -7.069   4.125
  885    HE3  TRP 121           HE3      TRP 121  -9.400  -7.321   0.343
  886    HZ2  TRP 121           HZ2      TRP 121 -11.356  -9.146   4.537
  887    HZ3  TRP 121           HZ3      TRP 121  -8.411  -9.266   1.501
  888    HH2  TRP 121           HH2      TRP 121  -9.378 -10.156   3.520
  889    H    ALA 122           HN       ALA 122 -13.919  -7.501  -0.249
  890    HA   ALA 122           HA       ALA 122 -16.148  -6.276   1.224
  891   1HB   ALA 122          HB1       ALA 122 -17.633  -8.022   0.378
  892   2HB   ALA 122          HB2       ALA 122 -16.310  -8.688  -0.582
  893   3HB   ALA 122          HB3       ALA 122 -16.939  -7.080  -0.943
  894    H    LYS 123           HN       LYS 123 -16.757  -7.255   3.094
  895    HA   LYS 123           HA       LYS 123 -16.894  -8.696   4.835
  896   1HB   LYS 123          HB2       LYS 123 -15.260 -10.603   3.161
  897   2HB   LYS 123          HB1       LYS 123 -16.119 -11.002   4.643
  898   1HG   LYS 123          HG2       LYS 123 -17.344 -10.141   2.029
  899   2HG   LYS 123          HG1       LYS 123 -17.402 -11.752   2.745
  900   1HD   LYS 123          HD2       LYS 123 -18.746 -10.944   4.574
  901   2HD   LYS 123          HD1       LYS 123 -18.570  -9.278   4.016
  902   1HE   LYS 123          HE2       LYS 123 -20.745 -10.148   3.384
  903   2HE   LYS 123          HE1       LYS 123 -19.760  -9.860   1.950
  904   1HZ   LYS 123          HZ1       LYS 123 -20.877 -11.950   1.740
  905   2HZ   LYS 123          HZ2       LYS 123 -20.293 -12.484   3.240
  906   3HZ   LYS 123          HZ3       LYS 123 -19.222 -12.254   1.946
  907    H    ASP 124           HN       ASP 124 -14.536 -10.589   5.444
  908    HA   ASP 124           HA       ASP 124 -12.447  -8.656   5.999
  909   1HB   ASP 124          HB2       ASP 124 -12.475  -8.954   8.413
  910   2HB   ASP 124          HB1       ASP 124 -14.014  -8.310   7.859
  911    H    ASN 125           HN       ASN 125 -10.600  -9.536   5.667
  912    HA   ASN 125           HA       ASN 125  -8.808 -10.891   5.700
  913   1HB   ASN 125          HB2       ASN 125  -9.215 -11.228   8.014
  914   2HB   ASN 125          HB1       ASN 125 -10.449 -12.437   7.685
  915   1HD2  ASN 125          HD21      ASN 125  -7.036 -11.744   7.683
  916   2HD2  ASN 125          HD22      ASN 125  -6.499 -13.389   7.609
  917    H    LYS 126           HN       LYS 126 -11.867 -12.432   5.025
  918    HA   LYS 126           HA       LYS 126 -10.886 -14.810   3.867
  919   1HB   LYS 126          HB2       LYS 126 -13.089 -15.093   2.952
  920   2HB   LYS 126          HB1       LYS 126 -13.247 -14.406   4.561
  921   1HG   LYS 126          HG2       LYS 126 -14.668 -12.985   3.582
  922   2HG   LYS 126          HG1       LYS 126 -13.213 -12.164   3.011
  923   1HD   LYS 126          HD2       LYS 126 -13.287 -13.472   0.944
  924   2HD   LYS 126          HD1       LYS 126 -14.740 -14.297   1.516
  925   1HE   LYS 126          HE2       LYS 126 -15.918 -12.143   1.580
  926   2HE   LYS 126          HE1       LYS 126 -14.465 -11.341   0.986
  927   1HZ   LYS 126          HZ1       LYS 126 -15.995 -13.435  -0.473
  928   2HZ   LYS 126          HZ2       LYS 126 -14.612 -12.643  -1.044
  929   3HZ   LYS 126          HZ3       LYS 126 -16.047 -11.773  -0.802
  930    H    GLN 127           HN       GLN 127 -10.360 -11.748   2.931
  931    HA   GLN 127           HA       GLN 127  -9.435 -10.749   1.157
  932   1HB   GLN 127          HB2       GLN 127  -8.050 -12.834   1.121
  933   2HB   GLN 127          HB1       GLN 127  -9.161 -13.484  -0.078
  934   1HG   GLN 127          HG2       GLN 127  -8.571 -11.786  -1.649
  935   2HG   GLN 127          HG1       GLN 127  -7.627 -10.920  -0.437
  936   1HE2  GLN 127          HE21      GLN 127  -6.822 -12.026  -3.037
  937   2HE2  GLN 127          HE22      GLN 127  -5.513 -13.101  -2.704
  938    H    GLY 128           HN       GLY 128 -11.796 -10.109   1.065
  939   1HA   GLY 128          HA2       GLY 128 -13.113 -11.056  -1.339
  940   2HA   GLY 128          HA1       GLY 128 -13.770  -9.906  -0.184
  941    H    PHE 129           HN       PHE 129 -10.788 -10.004  -2.115
  942    HA   PHE 129           HA       PHE 129 -11.010  -7.126  -2.418
  943   1HB   PHE 129          HB2       PHE 129  -8.718  -7.148  -2.892
  944   2HB   PHE 129          HB1       PHE 129  -8.883  -8.522  -1.814
  945    HD1  PHE 129           HD1      PHE 129  -9.252 -10.836  -3.010
  946    HD2  PHE 129           HD2      PHE 129  -7.601  -7.384  -4.875
  947    HE1  PHE 129           HE1      PHE 129  -8.203 -12.262  -4.717
  948    HE2  PHE 129           HE2      PHE 129  -6.550  -8.804  -6.585
  949    HZ   PHE 129           HZ       PHE 129  -6.851 -11.246  -6.507
  950    H    THR 130           HN       THR 130 -11.263  -6.052  -4.379
  951    HA   THR 130           HA       THR 130 -11.073  -7.546  -6.873
  952    HB   THR 130           HB       THR 130 -13.570  -5.980  -6.164
  953    HG1  THR 130           HG1      THR 130 -12.868  -8.588  -5.774
  954   1HG2  THR 130          HG21      THR 130 -12.911  -7.622  -8.617
  955   2HG2  THR 130          HG22      THR 130 -12.989  -5.862  -8.550
  956   3HG2  THR 130          HG23      THR 130 -14.447  -6.820  -8.289
  957    HA   PRO 131           HA       PRO 131  -9.037  -3.725  -8.002
  958   1HB   PRO 131          HB2       PRO 131  -9.678  -4.589 -10.766
  959   2HB   PRO 131          HB1       PRO 131  -8.116  -4.194 -10.043
  960   1HG   PRO 131          HG2       PRO 131  -8.776  -6.724 -10.572
  961   2HG   PRO 131          HG1       PRO 131  -7.863  -6.302  -9.111
  962   1HD   PRO 131          HD2       PRO 131 -10.766  -6.963  -9.408
  963   2HD   PRO 131          HD1       PRO 131  -9.627  -7.434  -8.128
  964    H    SER 132           HN       SER 132  -9.794  -1.711  -8.234
  965    HA   SER 132           HA       SER 132 -12.057  -1.115  -9.905
  966   1HB   SER 132          HB2       SER 132 -13.110  -1.924  -7.787
  967   2HB   SER 132          HB1       SER 132 -12.298  -0.611  -6.945
  968    HG   SER 132           HG       SER 132 -14.024  -0.194  -9.157
  969    H    GLY 133           HN       GLY 133 -10.797   0.349 -10.983
  970   1HA   GLY 133          HA2       GLY 133 -10.592   2.867 -10.795
  971   2HA   GLY 133          HA1       GLY 133  -9.629   2.525  -9.365
  972    H    THR 134           HN       THR 134  -7.491   2.081  -9.591
  973    HA   THR 134           HA       THR 134  -6.404   1.352 -12.184
  974    HB   THR 134           HB       THR 134  -5.426   3.879 -10.845
  975    HG1  THR 134           HG1      THR 134  -7.513   3.446 -12.613
  976   1HG2  THR 134          HG21      THR 134  -3.782   2.710 -12.254
  977   2HG2  THR 134          HG22      THR 134  -4.266   4.251 -12.965
  978   3HG2  THR 134          HG23      THR 134  -4.922   2.741 -13.600
  979    H    THR 135           HN       THR 135  -4.372   0.403 -12.041
  980    HA   THR 135           HA       THR 135  -3.325  -0.057  -9.340
  981    HB   THR 135           HB       THR 135  -2.580  -1.441 -11.930
  982    HG1  THR 135           HG1      THR 135  -4.642  -2.082 -11.572
  983   1HG2  THR 135          HG21      THR 135  -0.847  -1.649 -10.262
  984   2HG2  THR 135          HG22      THR 135  -1.698  -3.189 -10.398
  985   3HG2  THR 135          HG23      THR 135  -2.029  -2.114  -9.040
  986    H    GLY 136           HN       GLY 136  -1.449   0.917  -8.708
  987   1HA   GLY 136          HA2       GLY 136   0.233   2.127 -10.818
  988   2HA   GLY 136          HA1       GLY 136  -0.275   3.069  -9.423
  989    H    THR 137           HN       THR 137   2.417   2.094 -10.484
  990    HA   THR 137           HA       THR 137   3.329   0.501  -8.217
  991    HB   THR 137           HB       THR 137   4.860   1.446 -10.652
  992    HG1  THR 137           HG1      THR 137   3.955  -1.198 -10.085
  993   1HG2  THR 137          HG21      THR 137   6.528  -0.211  -9.984
  994   2HG2  THR 137          HG22      THR 137   5.578  -0.605  -8.553
  995   3HG2  THR 137          HG23      THR 137   6.303   0.995  -8.718
  996    H    THR 138           HN       THR 138   4.124   1.439  -6.468
  997    HA   THR 138           HA       THR 138   5.034   4.197  -6.528
  998    HB   THR 138           HB       THR 138   5.093   2.241  -4.217
  999    HG1  THR 138           HG1      THR 138   2.983   3.260  -5.446
 1000   1HG2  THR 138          HG21      THR 138   5.117   4.277  -2.839
 1001   2HG2  THR 138          HG22      THR 138   5.148   5.263  -4.301
 1002   3HG2  THR 138          HG23      THR 138   6.512   4.215  -3.917
 1003    H    LYS 139           HN       LYS 139   7.070   4.633  -7.132
 1004    HA   LYS 139           HA       LYS 139   9.032   2.454  -6.976
 1005   1HB   LYS 139          HB2       LYS 139   8.537   3.555  -9.192
 1006   2HB   LYS 139          HB1       LYS 139   9.257   5.022  -8.547
 1007   1HG   LYS 139          HG2       LYS 139  10.910   3.905  -9.850
 1008   2HG   LYS 139          HG1       LYS 139  11.363   3.748  -8.156
 1009   1HD   LYS 139          HD2       LYS 139  11.693   1.641  -9.324
 1010   2HD   LYS 139          HD1       LYS 139  10.408   1.482  -8.127
 1011   1HE   LYS 139          HE2       LYS 139   9.791   0.371 -10.197
 1012   2HE   LYS 139          HE1       LYS 139   8.734   1.747  -9.899
 1013   1HZ   LYS 139          HZ1       LYS 139  11.002   1.617 -11.811
 1014   2HZ   LYS 139          HZ2       LYS 139  10.152   3.039 -11.454
 1015   3HZ   LYS 139          HZ3       LYS 139   9.351   1.739 -12.189
 1016    H    LEU 140           HN       LEU 140  10.246   2.467  -5.300
 1017    HA   LEU 140           HA       LEU 140  10.978   5.026  -4.065
 1018   1HB   LEU 140          HB2       LEU 140   9.833   3.862  -2.436
 1019   2HB   LEU 140          HB1       LEU 140  10.399   2.301  -2.985
 1020    HG   LEU 140           HG       LEU 140  12.614   2.795  -2.021
 1021   1HD1  LEU 140          HD11      LEU 140  12.543   5.233  -2.120
 1022   2HD1  LEU 140          HD12      LEU 140  12.870   4.675  -0.480
 1023   3HD1  LEU 140          HD13      LEU 140  11.260   5.251  -0.910
 1024   1HD2  LEU 140          HD21      LEU 140  10.972   1.528  -0.768
 1025   2HD2  LEU 140          HD22      LEU 140  10.309   3.021  -0.102
 1026   3HD2  LEU 140          HD23      LEU 140  11.953   2.525   0.306
 1027    H    THR 141           HN       THR 141  12.850   5.593  -5.002
 1028    HA   THR 141           HA       THR 141  14.962   3.615  -5.424
 1029    HB   THR 141           HB       THR 141  14.953   6.562  -6.129
 1030    HG1  THR 141           HG1      THR 141  14.135   5.979  -8.091
 1031   1HG2  THR 141          HG21      THR 141  17.184   5.594  -6.082
 1032   2HG2  THR 141          HG22      THR 141  16.695   5.887  -7.751
 1033   3HG2  THR 141          HG23      THR 141  16.648   4.253  -7.094
 1034    H    VAL 142           HN       VAL 142  16.964   3.698  -4.356
 1035    HA   VAL 142           HA       VAL 142  16.919   4.860  -1.758
 1036    HB   VAL 142           HB       VAL 142  18.093   2.787  -2.112
 1037   1HG1  VAL 142          HG11      VAL 142  18.860   3.103  -4.389
 1038   2HG1  VAL 142          HG12      VAL 142  20.220   2.699  -3.341
 1039   3HG1  VAL 142          HG13      VAL 142  19.972   4.367  -3.862
 1040   1HG2  VAL 142          HG21      VAL 142  19.980   5.012  -1.354
 1041   2HG2  VAL 142          HG22      VAL 142  20.205   3.302  -0.977
 1042   3HG2  VAL 142          HG23      VAL 142  18.847   4.189  -0.278
 1043    H    THR 143           HN       THR 143  17.625   6.711  -1.020
 1044    HA   THR 143           HA       THR 143  19.863   8.080  -2.211
 1045    HB   THR 143           HB       THR 143  17.193   9.491  -1.937
 1046    HG1  THR 143           HG1      THR 143  18.213   8.089  -3.946
 1047   1HG2  THR 143          HG21      THR 143  19.060  10.948  -1.336
 1048   2HG2  THR 143          HG22      THR 143  18.370  11.430  -2.885
 1049   3HG2  THR 143          HG23      THR 143  19.884  10.527  -2.838
  Start of MODEL   14
    1    H    GLU   1           H        GLU   1 -23.106  -1.483  -5.023
    2    HA   GLU   1           HA       GLU   1 -22.181   0.572  -5.738
    3   1HB   GLU   1          HB2       GLU   1 -20.772  -0.464  -3.265
    4   2HB   GLU   1          HB1       GLU   1 -20.975   1.229  -3.688
    5   1HG   GLU   1          HG2       GLU   1 -23.155  -0.727  -3.005
    6   2HG   GLU   1          HG1       GLU   1 -22.572   0.601  -2.004
    7    H    GLU   2           HN       GLU   2 -20.896   0.850  -7.487
    8    HA   GLU   2           HA       GLU   2 -18.128  -0.092  -7.345
    9   1HB   GLU   2          HB2       GLU   2 -19.428  -0.609  -9.409
   10   2HB   GLU   2          HB1       GLU   2 -19.565   1.119  -9.715
   11   1HG   GLU   2          HG2       GLU   2 -17.092   1.256  -9.774
   12   2HG   GLU   2          HG1       GLU   2 -17.026  -0.495  -9.606
   13    H    CYS   3           HN       CYS   3 -16.447   1.220  -7.353
   14    HA   CYS   3           HA       CYS   3 -16.781   4.093  -7.542
   15   1HB   CYS   3          HB2       CYS   3 -17.261   3.591  -5.193
   16   2HB   CYS   3          HB1       CYS   3 -15.763   2.682  -5.067
   17    H    GLN   4           HN       GLN   4 -14.969   4.961  -8.465
   18    HA   GLN   4           HA       GLN   4 -12.923   3.043  -9.195
   19   1HB   GLN   4          HB2       GLN   4 -12.074   4.805 -10.693
   20   2HB   GLN   4          HB1       GLN   4 -13.777   4.471 -10.956
   21   1HG   GLN   4          HG2       GLN   4 -14.396   6.472  -9.777
   22   2HG   GLN   4          HG1       GLN   4 -12.706   6.786  -9.369
   23   1HE2  GLN   4          HE21      GLN   4 -15.083   6.737 -11.910
   24   2HE2  GLN   4          HE22      GLN   4 -14.169   7.663 -13.055
   25    H    VAL   5           HN       VAL   5 -11.088   2.803  -8.176
   26    HA   VAL   5           HA       VAL   5 -10.268   4.809  -6.219
   27    HB   VAL   5           HB       VAL   5  -9.178   2.029  -6.712
   28   1HG1  VAL   5          HG11      VAL   5  -8.046   2.307  -4.566
   29   2HG1  VAL   5          HG12      VAL   5  -8.648   3.961  -4.461
   30   3HG1  VAL   5          HG13      VAL   5  -7.511   3.517  -5.735
   31   1HG2  VAL   5          HG21      VAL   5 -11.011   3.048  -4.550
   32   2HG2  VAL   5          HG22      VAL   5 -10.332   1.425  -4.647
   33   3HG2  VAL   5          HG23      VAL   5 -11.466   1.980  -5.879
   34    H    ARG   6           HN       ARG   6  -9.015   6.353  -6.966
   35    HA   ARG   6           HA       ARG   6  -7.305   5.961  -9.250
   36   1HB   ARG   6          HB2       ARG   6  -8.037   8.282  -7.520
   37   2HB   ARG   6          HB1       ARG   6  -6.575   8.378  -8.488
   38   1HG   ARG   6          HG2       ARG   6  -9.362   7.901  -9.517
   39   2HG   ARG   6          HG1       ARG   6  -8.433   9.397  -9.649
   40   1HD   ARG   6          HD2       ARG   6  -7.836   6.739 -10.936
   41   2HD   ARG   6          HD1       ARG   6  -8.282   8.244 -11.739
   42    HE   ARG   6           HE       ARG   6  -5.954   8.777 -10.333
   43   1HH1  ARG   6          HH11      ARG   6  -6.982   6.694 -12.953
   44   2HH1  ARG   6          HH12      ARG   6  -5.394   6.576 -13.646
   45   1HH2  ARG   6          HH21      ARG   6  -3.848   8.616 -11.259
   46   2HH2  ARG   6          HH22      ARG   6  -3.621   7.646 -12.691
   47    H    VAL   7           HN       VAL   7  -5.802   4.457  -8.618
   48    HA   VAL   7           HA       VAL   7  -3.816   5.429  -6.675
   49    HB   VAL   7           HB       VAL   7  -3.974   2.666  -7.903
   50   1HG1  VAL   7          HG11      VAL   7  -1.740   3.349  -7.167
   51   2HG1  VAL   7          HG12      VAL   7  -2.384   2.056  -6.157
   52   3HG1  VAL   7          HG13      VAL   7  -2.382   3.718  -5.567
   53   1HG2  VAL   7          HG21      VAL   7  -5.923   2.999  -6.513
   54   2HG2  VAL   7          HG22      VAL   7  -4.920   3.622  -5.203
   55   3HG2  VAL   7          HG23      VAL   7  -4.789   1.929  -5.686
   56    H    GLY   8           HN       GLY   8  -2.190   6.497  -7.579
   57   1HA   GLY   8          HA2       GLY   8  -1.585   5.944 -10.408
   58   2HA   GLY   8          HA1       GLY   8  -1.321   7.488  -9.610
   59    H    ASP   9           HN       ASP   9   0.788   6.916 -10.820
   60    HA   ASP   9           HA       ASP   9   2.533   5.307  -9.094
   61   1HB   ASP   9          HB2       ASP   9   4.153   5.356 -10.905
   62   2HB   ASP   9          HB1       ASP   9   2.597   4.817 -11.528
   63    H    LEU  10           HN       LEU  10   4.378   6.172  -8.183
   64    HA   LEU  10           HA       LEU  10   5.020   8.961  -8.573
   65   1HB   LEU  10          HB2       LEU  10   4.808   9.617  -6.255
   66   2HB   LEU  10          HB1       LEU  10   3.254   9.079  -6.859
   67    HG   LEU  10           HG       LEU  10   5.036   7.252  -5.262
   68   1HD1  LEU  10          HD11      LEU  10   2.947   9.165  -4.224
   69   2HD1  LEU  10          HD12      LEU  10   4.682   9.241  -3.912
   70   3HD1  LEU  10          HD13      LEU  10   3.728   7.896  -3.283
   71   1HD2  LEU  10          HD21      LEU  10   2.061   7.318  -5.768
   72   2HD2  LEU  10          HD22      LEU  10   2.902   6.152  -4.748
   73   3HD2  LEU  10          HD23      LEU  10   3.215   6.193  -6.484
   74    H    THR  11           HN       THR  11   7.125   9.384  -8.141
   75    HA   THR  11           HA       THR  11   8.726   7.088  -7.231
   76    HB   THR  11           HB       THR  11   9.694   9.475  -8.819
   77    HG1  THR  11           HG1      THR  11   8.020   7.950  -9.804
   78   1HG2  THR  11          HG21      THR  11  10.877   6.743  -8.305
   79   2HG2  THR  11          HG22      THR  11  11.449   8.271  -7.635
   80   3HG2  THR  11          HG23      THR  11  11.570   7.967  -9.368
   81    H    VAL  12           HN       VAL  12   9.402   7.250  -5.209
   82    HA   VAL  12           HA       VAL  12  10.026   9.922  -4.146
   83    HB   VAL  12           HB       VAL  12   8.272   8.921  -2.842
   84   1HG1  VAL  12          HG11      VAL  12   8.501   6.776  -1.711
   85   2HG1  VAL  12          HG12      VAL  12  10.070   6.532  -2.478
   86   3HG1  VAL  12          HG13      VAL  12   8.607   6.590  -3.461
   87   1HG2  VAL  12          HG21      VAL  12   9.936  10.165  -1.587
   88   2HG2  VAL  12          HG22      VAL  12  10.900   8.703  -1.379
   89   3HG2  VAL  12          HG23      VAL  12   9.310   8.828  -0.624
   90    H    ALA  13           HN       ALA  13  12.057  10.370  -3.670
   91    HA   ALA  13           HA       ALA  13  14.023   8.193  -3.923
   92   1HB   ALA  13          HB1       ALA  13  14.203   9.994  -5.575
   93   2HB   ALA  13          HB2       ALA  13  15.621   9.927  -4.531
   94   3HB   ALA  13          HB3       ALA  13  14.395  11.169  -4.273
   95    H    LYS  14           HN       LYS  14  14.449   7.445  -1.922
   96    HA   LYS  14           HA       LYS  14  15.925   9.016  -0.116
   97   1HB   LYS  14          HB2       LYS  14  13.167   9.382   0.190
   98   2HB   LYS  14          HB1       LYS  14  13.614   8.258   1.468
   99   1HG   LYS  14          HG2       LYS  14  15.160   9.774   2.404
  100   2HG   LYS  14          HG1       LYS  14  15.108  10.818   0.984
  101   1HD   LYS  14          HD2       LYS  14  12.837  10.339   2.913
  102   2HD   LYS  14          HD1       LYS  14  13.851  11.783   2.846
  103   1HE   LYS  14          HE2       LYS  14  13.088  12.076   0.469
  104   2HE   LYS  14          HE1       LYS  14  11.925  10.784   0.758
  105   1HZ   LYS  14          HZ1       LYS  14  12.040  13.457   2.022
  106   2HZ   LYS  14          HZ2       LYS  14  11.133  12.190   2.689
  107   3HZ   LYS  14          HZ3       LYS  14  10.769  12.765   1.136
  108    H    THR  15           HN       THR  15  15.851   7.741   2.176
  109    HA   THR  15           HA       THR  15  16.456   4.973   1.402
  110    HB   THR  15           HB       THR  15  17.981   4.951   3.343
  111    HG1  THR  15           HG1      THR  15  18.263   7.491   3.908
  112   1HG2  THR  15          HG21      THR  15  18.858   5.607   1.156
  113   2HG2  THR  15          HG22      THR  15  19.670   6.490   2.450
  114   3HG2  THR  15          HG23      THR  15  18.431   7.288   1.481
  115    H    ARG  16           HN       ARG  16  16.118   3.312   3.101
  116    HA   ARG  16           HA       ARG  16  13.572   3.674   4.413
  117   1HB   ARG  16          HB2       ARG  16  15.441   1.299   4.602
  118   2HB   ARG  16          HB1       ARG  16  13.766   1.350   5.135
  119   1HG   ARG  16          HG2       ARG  16  13.614   0.222   3.127
  120   2HG   ARG  16          HG1       ARG  16  13.245   1.882   2.653
  121   1HD   ARG  16          HD2       ARG  16  14.883   1.771   1.160
  122   2HD   ARG  16          HD1       ARG  16  16.030   1.648   2.489
  123    HE   ARG  16           HE       ARG  16  15.315  -0.393   0.656
  124   1HH1  ARG  16          HH11      ARG  16  16.044  -0.002   4.084
  125   2HH1  ARG  16          HH12      ARG  16  16.808  -1.553   4.224
  126   1HH2  ARG  16          HH21      ARG  16  16.375  -2.431   0.878
  127   2HH2  ARG  16          HH22      ARG  16  17.008  -2.903   2.426
  128    H    GLY  17           HN       GLY  17  16.604   4.610   5.148
  129   1HA   GLY  17          HA2       GLY  17  16.644   3.997   7.964
  130   2HA   GLY  17          HA1       GLY  17  17.740   5.079   7.110
  131    H    GLN  18           HN       GLN  18  15.243   6.377   5.950
  132    HA   GLN  18           HA       GLN  18  14.821   8.386   7.947
  133   1HB   GLN  18          HB2       GLN  18  13.164   7.861   5.472
  134   2HB   GLN  18          HB1       GLN  18  13.289   9.368   6.363
  135   1HG   GLN  18          HG2       GLN  18  15.578   8.091   4.893
  136   2HG   GLN  18          HG1       GLN  18  14.516   9.319   4.205
  137   1HE2  GLN  18          HE21      GLN  18  17.039   8.664   6.507
  138   2HE2  GLN  18          HE22      GLN  18  17.458  10.312   6.832
  139    H    LEU  19           HN       LEU  19  13.486   5.381   7.128
  140    HA   LEU  19           HA       LEU  19  10.879   5.864   8.283
  141   1HB   LEU  19          HB2       LEU  19  12.111   3.354   7.143
  142   2HB   LEU  19          HB1       LEU  19  10.438   3.540   7.633
  143    HG   LEU  19           HG       LEU  19  11.699   5.163   5.429
  144   1HD1  LEU  19          HD11      LEU  19  11.734   2.793   4.834
  145   2HD1  LEU  19          HD12      LEU  19  10.532   3.668   3.884
  146   3HD1  LEU  19          HD13      LEU  19  10.023   2.662   5.241
  147   1HD2  LEU  19          HD21      LEU  19   9.737   6.151   6.500
  148   2HD2  LEU  19          HD22      LEU  19   8.832   4.663   6.208
  149   3HD2  LEU  19          HD23      LEU  19   9.385   5.641   4.848
  150    H    THR  20           HN       THR  20  11.202   6.143  10.458
  151    HA   THR  20           HA       THR  20  12.455   3.977  11.966
  152    HB   THR  20           HB       THR  20  11.486   6.643  13.032
  153    HG1  THR  20           HG1      THR  20  14.067   5.856  12.063
  154   1HG2  THR  20          HG21      THR  20  11.821   4.908  14.726
  155   2HG2  THR  20          HG22      THR  20  13.058   6.158  14.861
  156   3HG2  THR  20          HG23      THR  20  13.449   4.610  14.110
  157    H    ASP  21           HN       ASP  21  10.547   2.743  11.200
  158    HA   ASP  21           HA       ASP  21   8.625   1.621  11.577
  159   1HB   ASP  21          HB2       ASP  21   9.188   1.601  13.946
  160   2HB   ASP  21          HB1       ASP  21   8.489   3.203  14.150
  161    H    ALA  22           HN       ALA  22   8.009   4.933  12.784
  162    HA   ALA  22           HA       ALA  22   5.745   5.021  10.907
  163   1HB   ALA  22          HB1       ALA  22   4.656   6.589  12.413
  164   2HB   ALA  22          HB2       ALA  22   6.040   6.526  13.504
  165   3HB   ALA  22          HB3       ALA  22   5.046   5.090  13.256
  166    H    ALA  23           HN       ALA  23   6.676   5.946   9.150
  167    HA   ALA  23           HA       ALA  23   7.258   8.770   9.356
  168   1HB   ALA  23          HB1       ALA  23   9.349   6.905   8.236
  169   2HB   ALA  23          HB2       ALA  23   9.457   7.762   9.774
  170   3HB   ALA  23          HB3       ALA  23   9.424   8.667   8.262
  171    HA   PRO  24           HA       PRO  24   4.896   7.831   5.518
  172   1HB   PRO  24          HB2       PRO  24   3.759  10.333   5.474
  173   2HB   PRO  24          HB1       PRO  24   3.069   8.943   6.320
  174   1HG   PRO  24          HG2       PRO  24   4.723  11.190   7.404
  175   2HG   PRO  24          HG1       PRO  24   3.287  10.418   8.103
  176   1HD   PRO  24          HD2       PRO  24   5.754   9.823   8.972
  177   2HD   PRO  24          HD1       PRO  24   4.489   8.586   8.861
  178    H    ILE  25           HN       ILE  25   7.076   7.840   4.617
  179    HA   ILE  25           HA       ILE  25   8.319  10.258   3.807
  180    HB   ILE  25           HB       ILE  25   9.535   8.689   2.165
  181   1HG1  ILE  25          HG12      ILE  25   9.260   6.341   3.620
  182   2HG1  ILE  25          HG11      ILE  25   7.608   6.878   3.359
  183   1HG2  ILE  25          HG21      ILE  25  10.512   9.568   4.210
  184   2HG2  ILE  25          HG22      ILE  25  10.993   7.890   3.961
  185   3HG2  ILE  25          HG23      ILE  25   9.743   8.283   5.142
  186   1HD1  ILE  25          HD11      ILE  25   7.993   6.944   0.966
  187   2HD1  ILE  25          HD12      ILE  25   8.384   5.350   1.612
  188   3HD1  ILE  25          HD13      ILE  25   9.677   6.479   1.206
  189    H    GLY  26           HN       GLY  26   6.446   7.869   1.901
  190   1HA   GLY  26          HA2       GLY  26   6.032  10.031  -0.066
  191   2HA   GLY  26          HA1       GLY  26   6.359   8.376  -0.552
  192    HA   PRO  27           HA       PRO  27   1.794   8.470   1.501
  193   1HB   PRO  27          HB2       PRO  27   0.979  11.160   1.215
  194   2HB   PRO  27          HB1       PRO  27   1.259  10.295   2.729
  195   1HG   PRO  27          HG2       PRO  27   3.084  12.108   1.214
  196   2HG   PRO  27          HG1       PRO  27   2.903  11.901   2.968
  197   1HD   PRO  27          HD2       PRO  27   5.003  10.837   1.730
  198   2HD   PRO  27          HD1       PRO  27   4.138   9.916   2.979
  199    H    VAL  28           HN       VAL  28   1.002   7.487  -0.246
  200    HA   VAL  28           HA       VAL  28   0.850   8.837  -2.801
  201    HB   VAL  28           HB       VAL  28   1.392   6.476  -2.843
  202   1HG1  VAL  28          HG11      VAL  28  -0.232   4.763  -2.135
  203   2HG1  VAL  28          HG12      VAL  28  -1.251   6.036  -1.462
  204   3HG1  VAL  28          HG13      VAL  28   0.354   5.745  -0.792
  205   1HG2  VAL  28          HG21      VAL  28   0.131   7.313  -4.734
  206   2HG2  VAL  28          HG22      VAL  28  -1.387   6.980  -3.901
  207   3HG2  VAL  28          HG23      VAL  28  -0.337   5.647  -4.383
  208    H    THR  29           HN       THR  29  -0.926   9.739  -3.670
  209    HA   THR  29           HA       THR  29  -3.159  10.134  -1.873
  210    HB   THR  29           HB       THR  29  -2.267  12.130  -2.885
  211    HG1  THR  29           HG1      THR  29  -4.688  11.700  -2.702
  212   1HG2  THR  29          HG21      THR  29  -2.920  10.884  -5.557
  213   2HG2  THR  29          HG22      THR  29  -1.308  11.207  -4.921
  214   3HG2  THR  29          HG23      THR  29  -2.388  12.548  -5.307
  215    H    VAL  30           HN       VAL  30  -4.503   8.467  -1.874
  216    HA   VAL  30           HA       VAL  30  -5.407   7.320  -4.406
  217    HB   VAL  30           HB       VAL  30  -5.862   6.511  -1.535
  218   1HG1  VAL  30          HG11      VAL  30  -7.952   6.185  -2.785
  219   2HG1  VAL  30          HG12      VAL  30  -7.206   4.646  -2.350
  220   3HG1  VAL  30          HG13      VAL  30  -7.077   5.252  -4.001
  221   1HG2  VAL  30          HG21      VAL  30  -4.747   4.436  -2.289
  222   2HG2  VAL  30          HG22      VAL  30  -3.723   5.857  -2.500
  223   3HG2  VAL  30          HG23      VAL  30  -4.541   5.145  -3.891
  224    H    GLN  31           HN       GLN  31  -7.047   8.200  -5.366
  225    HA   GLN  31           HA       GLN  31  -8.995   9.765  -3.837
  226   1HB   GLN  31          HB2       GLN  31  -7.909  10.979  -5.615
  227   2HB   GLN  31          HB1       GLN  31  -8.280   9.712  -6.772
  228   1HG   GLN  31          HG2       GLN  31 -10.665  10.222  -6.550
  229   2HG   GLN  31          HG1       GLN  31 -10.268  11.518  -5.419
  230   1HE2  GLN  31          HE21      GLN  31  -9.298  13.394  -6.184
  231   2HE2  GLN  31          HE22      GLN  31  -9.247  13.782  -7.866
  232    H    ALA  32           HN       ALA  32 -10.978   8.983  -3.525
  233    HA   ALA  32           HA       ALA  32 -11.848   6.677  -5.140
  234   1HB   ALA  32          HB1       ALA  32 -12.615   7.387  -2.306
  235   2HB   ALA  32          HB2       ALA  32 -11.471   6.131  -2.780
  236   3HB   ALA  32          HB3       ALA  32 -13.175   5.981  -3.211
  237    H    LEU  33           HN       LEU  33 -13.384   7.200  -6.553
  238    HA   LEU  33           HA       LEU  33 -15.027   9.570  -5.998
  239   1HB   LEU  33          HB2       LEU  33 -14.188   8.244  -8.558
  240   2HB   LEU  33          HB1       LEU  33 -15.452   9.451  -8.510
  241    HG   LEU  33           HG       LEU  33 -12.573   9.860  -7.701
  242   1HD1  LEU  33          HD11      LEU  33 -12.516  11.359  -9.651
  243   2HD1  LEU  33          HD12      LEU  33 -14.150  10.845 -10.071
  244   3HD1  LEU  33          HD13      LEU  33 -12.824   9.681 -10.096
  245   1HD2  LEU  33          HD21      LEU  33 -14.862  11.822  -7.788
  246   2HD2  LEU  33          HD22      LEU  33 -13.175  12.217  -7.457
  247   3HD2  LEU  33          HD23      LEU  33 -14.082  11.203  -6.333
  248    H    GLY  34           HN       GLY  34 -16.915   9.084  -5.155
  249   1HA   GLY  34          HA2       GLY  34 -19.106   8.396  -5.152
  250   2HA   GLY  34          HA1       GLY  34 -18.840   7.702  -6.741
  251    H    CYS  35           HN       CYS  35 -17.606   7.019  -3.451
  252    HA   CYS  35           HA       CYS  35 -17.888   4.176  -3.987
  253   1HB   CYS  35          HB2       CYS  35 -16.820   5.672  -1.595
  254   2HB   CYS  35          HB1       CYS  35 -16.929   3.928  -1.682
  255    H    ASN  36           HN       ASN  36 -19.098   6.516  -1.605
  256    HA   ASN  36           HA       ASN  36 -21.083   6.743  -0.542
  257   1HB   ASN  36          HB2       ASN  36 -22.198   6.251  -2.631
  258   2HB   ASN  36          HB1       ASN  36 -21.968   4.524  -2.394
  259   1HD2  ASN  36          HD21      ASN  36 -24.076   3.965  -2.435
  260   2HD2  ASN  36          HD22      ASN  36 -25.224   4.445  -1.229
  261    H    ALA  37           HN       ALA  37 -20.713   3.241  -1.029
  262    HA   ALA  37           HA       ALA  37 -20.620   2.833   1.853
  263   1HB   ALA  37          HB1       ALA  37 -22.417   1.156   1.810
  264   2HB   ALA  37          HB2       ALA  37 -22.737   1.550   0.120
  265   3HB   ALA  37          HB3       ALA  37 -23.012   2.758   1.376
  266    H    ARG  38           HN       ARG  38 -18.456   2.366   1.057
  267    HA   ARG  38           HA       ARG  38 -18.153  -0.339   0.004
  268   1HB   ARG  38          HB2       ARG  38 -18.342   1.228  -1.912
  269   2HB   ARG  38          HB1       ARG  38 -16.984   2.135  -1.269
  270   1HG   ARG  38          HG2       ARG  38 -15.538   0.179  -1.614
  271   2HG   ARG  38          HG1       ARG  38 -16.914  -0.677  -2.325
  272   1HD   ARG  38          HD2       ARG  38 -17.124   0.993  -4.046
  273   2HD   ARG  38          HD1       ARG  38 -15.858   1.964  -3.308
  274    HE   ARG  38           HE       ARG  38 -15.420  -0.641  -4.608
  275   1HH1  ARG  38          HH11      ARG  38 -14.301   2.500  -3.576
  276   2HH1  ARG  38          HH12      ARG  38 -12.852   2.443  -4.517
  277   1HH2  ARG  38          HH21      ARG  38 -13.497  -0.726  -5.884
  278   2HH2  ARG  38          HH22      ARG  38 -12.402   0.617  -5.844
  279    H    GLN  39           HN       GLN  39 -16.445  -1.349   0.926
  280    HA   GLN  39           HA       GLN  39 -14.692   0.108   2.689
  281   1HB   GLN  39          HB2       GLN  39 -14.600  -2.818   1.915
  282   2HB   GLN  39          HB1       GLN  39 -13.860  -2.070   3.325
  283   1HG   GLN  39          HG2       GLN  39 -15.972  -1.659   4.328
  284   2HG   GLN  39          HG1       GLN  39 -16.829  -2.091   2.853
  285   1HE2  GLN  39          HE21      GLN  39 -14.110  -3.879   4.143
  286   2HE2  GLN  39          HE22      GLN  39 -15.005  -5.294   4.569
  287    H    VAL  40           HN       VAL  40 -13.341   1.368   1.506
  288    HA   VAL  40           HA       VAL  40 -12.075   0.505  -0.906
  289    HB   VAL  40           HB       VAL  40 -11.362   2.860   0.849
  290   1HG1  VAL  40          HG11      VAL  40 -10.762   2.314  -2.056
  291   2HG1  VAL  40          HG12      VAL  40  -9.602   2.288  -0.730
  292   3HG1  VAL  40          HG13      VAL  40 -10.382   3.801  -1.188
  293   1HG2  VAL  40          HG21      VAL  40 -12.767   4.192  -0.640
  294   2HG2  VAL  40          HG22      VAL  40 -13.707   2.939   0.170
  295   3HG2  VAL  40          HG23      VAL  40 -13.230   2.733  -1.516
  296    H    ALA  41           HN       ALA  41 -10.391  -0.817  -1.031
  297    HA   ALA  41           HA       ALA  41  -8.593  -1.024   1.279
  298   1HB   ALA  41          HB1       ALA  41 -10.139  -2.996   0.862
  299   2HB   ALA  41          HB2       ALA  41  -8.416  -3.356   0.961
  300   3HB   ALA  41          HB3       ALA  41  -9.212  -3.280  -0.610
  301    H    LEU  42           HN       LEU  42  -6.421  -1.265   0.874
  302    HA   LEU  42           HA       LEU  42  -5.548  -0.683  -1.865
  303   1HB   LEU  42          HB2       LEU  42  -3.898  -0.636   0.658
  304   2HB   LEU  42          HB1       LEU  42  -3.481   0.056  -0.898
  305    HG   LEU  42           HG       LEU  42  -5.717   1.018   0.875
  306   1HD1  LEU  42          HD11      LEU  42  -3.533   1.445   1.867
  307   2HD1  LEU  42          HD12      LEU  42  -4.286   2.943   1.320
  308   3HD1  LEU  42          HD13      LEU  42  -2.994   2.207   0.370
  309   1HD2  LEU  42          HD21      LEU  42  -4.552   2.201  -1.645
  310   2HD2  LEU  42          HD22      LEU  42  -5.816   2.923  -0.649
  311   3HD2  LEU  42          HD23      LEU  42  -6.124   1.413  -1.506
  312    H    LYS  43           HN       LYS  43  -5.004  -2.397  -3.023
  313    HA   LYS  43           HA       LYS  43  -4.026  -4.792  -1.629
  314   1HB   LYS  43          HB2       LYS  43  -5.112  -4.553  -4.445
  315   2HB   LYS  43          HB1       LYS  43  -4.617  -6.039  -3.656
  316   1HG   LYS  43          HG2       LYS  43  -6.971  -5.996  -3.598
  317   2HG   LYS  43          HG1       LYS  43  -6.422  -5.612  -1.962
  318   1HD   LYS  43          HD2       LYS  43  -6.840  -3.269  -2.317
  319   2HD   LYS  43          HD1       LYS  43  -7.194  -3.546  -4.021
  320   1HE   LYS  43          HE2       LYS  43  -8.789  -4.737  -1.770
  321   2HE   LYS  43          HE1       LYS  43  -9.191  -3.207  -2.553
  322   1HZ   LYS  43          HZ1       LYS  43  -9.349  -4.395  -4.661
  323   2HZ   LYS  43          HZ2       LYS  43 -10.443  -5.001  -3.520
  324   3HZ   LYS  43          HZ3       LYS  43  -9.023  -5.857  -3.874
  325    H    ALA  44           HN       ALA  44  -1.939  -5.268  -1.809
  326    HA   ALA  44           HA       ALA  44  -0.267  -3.831  -3.645
  327   1HB   ALA  44          HB1       ALA  44   0.399  -6.205  -1.919
  328   2HB   ALA  44          HB2       ALA  44   0.529  -4.519  -1.422
  329   3HB   ALA  44          HB3       ALA  44   1.546  -5.138  -2.725
  330    H    ASP  45           HN       ASP  45   0.700  -4.607  -5.489
  331    HA   ASP  45           HA       ASP  45  -0.694  -6.739  -6.831
  332   1HB   ASP  45          HB2       ASP  45   0.143  -4.716  -8.031
  333   2HB   ASP  45          HB1       ASP  45   1.791  -5.251  -7.714
  334    H    THR  46           HN       THR  46   0.268  -8.710  -7.569
  335    HA   THR  46           HA       THR  46   1.528 -10.071  -5.500
  336    HB   THR  46           HB       THR  46   0.155 -11.229  -7.119
  337    HG1  THR  46           HG1      THR  46   2.711 -12.012  -6.470
  338   1HG2  THR  46          HG21      THR  46   0.967 -11.718  -9.379
  339   2HG2  THR  46          HG22      THR  46   2.384 -10.711  -9.092
  340   3HG2  THR  46          HG23      THR  46   0.779  -9.982  -9.131
  341    H    ASP  47           HN       ASP  47   2.997  -8.133  -7.924
  342    HA   ASP  47           HA       ASP  47   5.556  -9.303  -8.037
  343   1HB   ASP  47          HB2       ASP  47   4.733  -7.486  -9.539
  344   2HB   ASP  47          HB1       ASP  47   4.864  -6.359  -8.194
  345    H    ASN  48           HN       ASN  48   3.989  -7.280  -5.675
  346    HA   ASN  48           HA       ASN  48   6.310  -7.568  -3.890
  347   1HB   ASN  48          HB2       ASN  48   5.764  -5.325  -2.941
  348   2HB   ASN  48          HB1       ASN  48   6.280  -5.233  -4.621
  349   1HD2  ASN  48          HD21      ASN  48   3.762  -4.672  -2.378
  350   2HD2  ASN  48          HD22      ASN  48   2.636  -3.968  -3.483
  351    H    PHE  49           HN       PHE  49   3.788  -9.043  -4.329
  352    HA   PHE  49           HA       PHE  49   2.710  -8.933  -1.591
  353   1HB   PHE  49          HB2       PHE  49   1.121  -7.812  -3.111
  354   2HB   PHE  49          HB1       PHE  49   1.119  -9.219  -4.155
  355    HD1  PHE  49           HD1      PHE  49  -0.553  -7.539  -1.557
  356    HD2  PHE  49           HD2      PHE  49   0.265 -11.442  -3.049
  357    HE1  PHE  49           HE1      PHE  49  -2.538  -8.398  -0.397
  358    HE2  PHE  49           HE2      PHE  49  -1.724 -12.305  -1.888
  359    HZ   PHE  49           HZ       PHE  49  -3.135 -10.776  -0.563
  360    H    GLU  50           HN       GLU  50   3.446 -10.820  -0.771
  361    HA   GLU  50           HA       GLU  50   3.065 -13.230  -2.416
  362   1HB   GLU  50          HB2       GLU  50   4.886 -14.280  -1.084
  363   2HB   GLU  50          HB1       GLU  50   5.420 -12.918  -2.055
  364   1HG   GLU  50          HG2       GLU  50   5.387 -11.495  -0.063
  365   2HG   GLU  50          HG1       GLU  50   4.866 -12.874   0.904
  366    H    GLN  51           HN       GLN  51   1.440 -14.397  -1.801
  367    HA   GLN  51           HA       GLN  51   0.011 -15.639  -0.554
  368   1HB   GLN  51          HB2       GLN  51   1.787 -14.920   1.784
  369   2HB   GLN  51          HB1       GLN  51   0.484 -16.100   1.830
  370   1HG   GLN  51          HG2       GLN  51   1.681 -17.383   0.065
  371   2HG   GLN  51          HG1       GLN  51   3.023 -16.251   0.227
  372   1HE2  GLN  51          HE21      GLN  51   2.901 -19.124   0.707
  373   2HE2  GLN  51          HE22      GLN  51   3.408 -19.360   2.347
  374    H    GLY  52           HN       GLY  52   0.944 -12.701   1.183
  375   1HA   GLY  52          HA2       GLY  52  -1.458 -11.358   1.040
  376   2HA   GLY  52          HA1       GLY  52  -1.579 -12.378   2.474
  377    H    LYS  53           HN       LYS  53   1.410 -11.086   1.302
  378    HA   LYS  53           HA       LYS  53   1.468  -9.075   3.445
  379   1HB   LYS  53          HB2       LYS  53   3.484 -11.169   2.764
  380   2HB   LYS  53          HB1       LYS  53   4.042  -9.629   3.352
  381   1HG   LYS  53          HG2       LYS  53   3.942 -11.183   5.170
  382   2HG   LYS  53          HG1       LYS  53   2.724  -9.928   5.400
  383   1HD   LYS  53          HD2       LYS  53   1.000 -11.414   4.615
  384   2HD   LYS  53          HD1       LYS  53   2.196 -12.659   4.253
  385   1HE   LYS  53          HE2       LYS  53   2.726 -12.915   6.573
  386   2HE   LYS  53          HE1       LYS  53   1.732 -11.525   7.001
  387   1HZ   LYS  53          HZ1       LYS  53  -0.204 -12.697   6.706
  388   2HZ   LYS  53          HZ2       LYS  53   0.815 -13.911   7.308
  389   3HZ   LYS  53          HZ3       LYS  53   0.491 -13.822   5.646
  390    H    PHE  54           HN       PHE  54   2.331  -7.129   2.828
  391    HA   PHE  54           HA       PHE  54   3.499  -7.068   0.152
  392   1HB   PHE  54          HB2       PHE  54   2.604  -4.718  -0.033
  393   2HB   PHE  54          HB1       PHE  54   1.454  -6.040  -0.130
  394    HD1  PHE  54           HD1      PHE  54  -0.459  -4.782   0.323
  395    HD2  PHE  54           HD2      PHE  54   2.785  -4.729   3.074
  396    HE1  PHE  54           HE1      PHE  54  -1.903  -3.688   1.985
  397    HE2  PHE  54           HE2      PHE  54   1.348  -3.634   4.745
  398    HZ   PHE  54           HZ       PHE  54  -0.997  -3.112   4.201
  399    H    PHE  55           HN       PHE  55   5.095  -5.565  -0.291
  400    HA   PHE  55           HA       PHE  55   6.537  -4.365   1.901
  401   1HB   PHE  55          HB2       PHE  55   8.556  -5.867   1.394
  402   2HB   PHE  55          HB1       PHE  55   7.245  -6.597   2.319
  403    HD1  PHE  55           HD1      PHE  55   8.803  -6.405  -1.023
  404    HD2  PHE  55           HD2      PHE  55   6.013  -8.428   1.475
  405    HE1  PHE  55           HE1      PHE  55   8.613  -8.207  -2.691
  406    HE2  PHE  55           HE2      PHE  55   5.824 -10.226  -0.185
  407    HZ   PHE  55           HZ       PHE  55   7.123 -10.117  -2.271
  408    H    LEU  56           HN       LEU  56   8.725  -3.622   1.098
  409    HA   LEU  56           HA       LEU  56   8.583  -2.512  -1.573
  410   1HB   LEU  56          HB2       LEU  56  11.028  -2.489   0.170
  411   2HB   LEU  56          HB1       LEU  56  10.496  -1.287  -0.988
  412    HG   LEU  56           HG       LEU  56   9.093  -1.786   1.636
  413   1HD1  LEU  56          HD11      LEU  56  11.392  -1.083   2.049
  414   2HD1  LEU  56          HD12      LEU  56  10.249   0.195   2.465
  415   3HD1  LEU  56          HD13      LEU  56  11.172   0.291   0.966
  416   1HD2  LEU  56          HD21      LEU  56   8.146   0.436   1.223
  417   2HD2  LEU  56          HD22      LEU  56   7.725  -0.699  -0.058
  418   3HD2  LEU  56          HD23      LEU  56   8.985   0.503  -0.326
  419    H    ILE  57           HN       ILE  57   9.073  -3.904  -3.259
  420    HA   ILE  57           HA       ILE  57  11.160  -5.899  -2.716
  421    HB   ILE  57           HB       ILE  57   9.053  -6.898  -3.469
  422   1HG1  ILE  57          HG12      ILE  57   9.958  -8.248  -5.331
  423   2HG1  ILE  57          HG11      ILE  57  11.259  -7.081  -5.533
  424   1HG2  ILE  57          HG21      ILE  57   8.147  -5.109  -4.798
  425   2HG2  ILE  57          HG22      ILE  57   8.267  -6.571  -5.778
  426   3HG2  ILE  57          HG23      ILE  57   9.451  -5.278  -5.973
  427   1HD1  ILE  57          HD11      ILE  57  12.038  -9.020  -4.326
  428   2HD1  ILE  57          HD12      ILE  57  10.774  -8.804  -3.114
  429   3HD1  ILE  57          HD13      ILE  57  12.057  -7.604  -3.275
  430    H    SER  58           HN       SER  58  13.036  -5.737  -3.611
  431    HA   SER  58           HA       SER  58  13.654  -3.435  -5.188
  432   1HB   SER  58          HB2       SER  58  15.171  -4.284  -3.432
  433   2HB   SER  58          HB1       SER  58  15.406  -5.764  -4.358
  434    HG   SER  58           HG       SER  58  16.001  -3.174  -5.346
  435    H    ASP  59           HN       ASP  59  13.936  -3.298  -7.315
  436    HA   ASP  59           HA       ASP  59  13.333  -5.319  -9.160
  437   1HB   ASP  59          HB2       ASP  59  13.537  -2.780  -9.527
  438   2HB   ASP  59          HB1       ASP  59  15.269  -3.049  -9.657
  439    H    ASN  60           HN       ASN  60  16.270  -4.362  -7.556
  440    HA   ASN  60           HA       ASN  60  18.107  -5.970  -8.997
  441   1HB   ASN  60          HB2       ASN  60  18.346  -5.000  -6.140
  442   2HB   ASN  60          HB1       ASN  60  19.661  -5.452  -7.218
  443   1HD2  ASN  60          HD21      ASN  60  20.368  -4.013  -8.758
  444   2HD2  ASN  60          HD22      ASN  60  19.853  -2.357  -8.806
  445    H    ASN  61           HN       ASN  61  15.841  -6.590  -6.487
  446    HA   ASN  61           HA       ASN  61  15.220  -8.408  -5.294
  447   1HB   ASN  61          HB2       ASN  61  15.253  -9.513  -7.526
  448   2HB   ASN  61          HB1       ASN  61  16.920  -9.997  -7.229
  449   1HD2  ASN  61          HD21      ASN  61  17.349 -11.638  -5.771
  450   2HD2  ASN  61          HD22      ASN  61  16.113 -12.674  -5.139
  451    H    ARG  62           HN       ARG  62  16.110  -8.048  -3.352
  452    HA   ARG  62           HA       ARG  62  18.227  -9.722  -2.470
  453   1HB   ARG  62          HB2       ARG  62  19.686  -7.809  -1.639
  454   2HB   ARG  62          HB1       ARG  62  19.755  -8.155  -3.359
  455   1HG   ARG  62          HG2       ARG  62  18.576  -6.221  -3.920
  456   2HG   ARG  62          HG1       ARG  62  17.946  -6.018  -2.285
  457   1HD   ARG  62          HD2       ARG  62  20.848  -5.754  -3.059
  458   2HD   ARG  62          HD1       ARG  62  19.734  -4.402  -2.847
  459    HE   ARG  62           HE       ARG  62  19.525  -5.760  -0.501
  460   1HH1  ARG  62          HH11      ARG  62  22.232  -4.406  -2.277
  461   2HH1  ARG  62          HH12      ARG  62  23.205  -4.187  -0.860
  462   1HH2  ARG  62          HH21      ARG  62  20.773  -5.449   1.334
  463   2HH2  ARG  62          HH22      ARG  62  22.378  -4.787   1.207
  464    H    ASP  63           HN       ASP  63  16.333  -6.813  -1.812
  465    HA   ASP  63           HA       ASP  63  15.899  -7.773   0.932
  466   1HB   ASP  63          HB2       ASP  63  16.391  -4.959  -0.047
  467   2HB   ASP  63          HB1       ASP  63  15.591  -5.278   1.484
  468    H    LYS  64           HN       LYS  64  13.804  -7.825   1.597
  469    HA   LYS  64           HA       LYS  64  11.908  -6.139   0.161
  470   1HB   LYS  64          HB2       LYS  64  10.193  -7.872   0.123
  471   2HB   LYS  64          HB1       LYS  64  11.605  -8.366  -0.790
  472   1HG   LYS  64          HG2       LYS  64  11.366 -10.301   0.288
  473   2HG   LYS  64          HG1       LYS  64  12.115  -9.467   1.649
  474   1HD   LYS  64          HD2       LYS  64   9.991  -8.975   2.620
  475   2HD   LYS  64          HD1       LYS  64   9.132  -9.514   1.178
  476   1HE   LYS  64          HE2       LYS  64  10.797 -11.265   2.989
  477   2HE   LYS  64          HE1       LYS  64   9.036 -11.167   2.992
  478   1HZ   LYS  64          HZ1       LYS  64  10.670 -12.026   0.659
  479   2HZ   LYS  64          HZ2       LYS  64   8.975 -12.049   0.774
  480   3HZ   LYS  64          HZ3       LYS  64   9.908 -13.080   1.745
  481    H    LEU  65           HN       LEU  65  11.346  -4.719   1.582
  482    HA   LEU  65           HA       LEU  65  11.016  -5.559   4.370
  483   1HB   LEU  65          HB2       LEU  65  12.631  -3.981   4.465
  484   2HB   LEU  65          HB1       LEU  65  12.006  -3.057   3.117
  485    HG   LEU  65           HG       LEU  65  10.106  -2.398   4.700
  486   1HD1  LEU  65          HD11      LEU  65  10.653  -2.482   7.081
  487   2HD1  LEU  65          HD12      LEU  65  12.098  -3.425   6.718
  488   3HD1  LEU  65          HD13      LEU  65  10.500  -4.099   6.395
  489   1HD2  LEU  65          HD21      LEU  65  11.822  -0.856   3.979
  490   2HD2  LEU  65          HD22      LEU  65  12.936  -1.482   5.193
  491   3HD2  LEU  65          HD23      LEU  65  11.485  -0.611   5.691
  492    H    TYR  66           HN       TYR  66   9.145  -5.467   5.274
  493    HA   TYR  66           HA       TYR  66   6.828  -4.947   3.705
  494   1HB   TYR  66          HB2       TYR  66   6.868  -5.391   6.670
  495   2HB   TYR  66          HB1       TYR  66   5.644  -5.891   5.507
  496    HD1  TYR  66           HD1      TYR  66   8.822  -6.762   7.099
  497    HD2  TYR  66           HD2      TYR  66   6.036  -7.839   4.065
  498    HE1  TYR  66           HE1      TYR  66   9.871  -8.973   6.925
  499    HE2  TYR  66           HE2      TYR  66   7.079 -10.054   3.887
  500    HH   TYR  66           HH       TYR  66   9.080 -11.195   4.381
  501    H    VAL  67           HN       VAL  67   5.353  -3.287   3.895
  502    HA   VAL  67           HA       VAL  67   5.928  -1.152   5.818
  503    HB   VAL  67           HB       VAL  67   5.481   0.556   4.038
  504   1HG1  VAL  67          HG11      VAL  67   7.737   0.499   3.110
  505   2HG1  VAL  67          HG12      VAL  67   7.906  -1.184   3.610
  506   3HG1  VAL  67          HG13      VAL  67   7.747   0.084   4.825
  507   1HG2  VAL  67          HG21      VAL  67   4.383  -0.904   2.418
  508   2HG2  VAL  67          HG22      VAL  67   5.887  -1.795   2.187
  509   3HG2  VAL  67          HG23      VAL  67   5.778  -0.105   1.695
  510    H    ASN  68           HN       ASN  68   4.162  -0.030   6.530
  511    HA   ASN  68           HA       ASN  68   1.581  -1.203   5.758
  512   1HB   ASN  68          HB2       ASN  68   2.266   0.404   8.238
  513   2HB   ASN  68          HB1       ASN  68   0.732  -0.394   7.909
  514   1HD2  ASN  68          HD21      ASN  68   3.938  -0.742   9.065
  515   2HD2  ASN  68          HD22      ASN  68   3.842  -2.420   9.495
  516    H    ILE  69           HN       ILE  69   0.313  -0.058   4.515
  517    HA   ILE  69           HA       ILE  69   0.886   2.717   3.967
  518    HB   ILE  69           HB       ILE  69  -1.593   1.510   2.882
  519   1HG1  ILE  69          HG12      ILE  69   1.132   0.535   1.995
  520   2HG1  ILE  69          HG11      ILE  69  -0.011  -0.419   2.928
  521   1HG2  ILE  69          HG21      ILE  69   0.735   2.949   1.610
  522   2HG2  ILE  69          HG22      ILE  69  -0.753   3.701   2.177
  523   3HG2  ILE  69          HG23      ILE  69  -0.800   2.564   0.832
  524   1HD1  ILE  69          HD11      ILE  69  -1.597  -0.327   1.087
  525   2HD1  ILE  69          HD12      ILE  69  -0.057  -1.016   0.576
  526   3HD1  ILE  69          HD13      ILE  69  -0.463   0.649   0.153
  527    H    ARG  70           HN       ARG  70   0.377   3.786   5.896
  528    HA   ARG  70           HA       ARG  70  -2.281   3.364   7.029
  529   1HB   ARG  70          HB2       ARG  70  -0.488   3.281   8.638
  530   2HB   ARG  70          HB1       ARG  70   0.137   4.830   8.090
  531   1HG   ARG  70          HG2       ARG  70  -1.909   5.926   8.892
  532   2HG   ARG  70          HG1       ARG  70  -2.496   4.370   9.484
  533   1HD   ARG  70          HD2       ARG  70  -0.667   4.220  11.041
  534   2HD   ARG  70          HD1       ARG  70   0.077   5.672  10.369
  535    HE   ARG  70           HE       ARG  70  -2.337   6.576  11.151
  536   1HH1  ARG  70          HH11      ARG  70   0.117   4.698  12.817
  537   2HH1  ARG  70          HH12      ARG  70  -0.315   5.308  14.387
  538   1HH2  ARG  70          HH21      ARG  70  -2.868   7.401  13.195
  539   2HH2  ARG  70          HH22      ARG  70  -1.985   6.879  14.598
  540    HA   PRO  71           HA       PRO  71  -4.033   6.955   5.062
  541   1HB   PRO  71          HB2       PRO  71  -5.811   7.332   7.223
  542   2HB   PRO  71          HB1       PRO  71  -6.147   6.497   5.707
  543   1HG   PRO  71          HG2       PRO  71  -5.440   5.389   8.360
  544   2HG   PRO  71          HG1       PRO  71  -6.413   4.680   7.059
  545   1HD   PRO  71          HD2       PRO  71  -3.914   3.836   7.603
  546   2HD   PRO  71          HD1       PRO  71  -4.566   3.862   5.950
  547    H    MET  72           HN       MET  72  -3.624   9.056   5.202
  548    HA   MET  72           HA       MET  72  -1.941  10.061   7.258
  549   1HB   MET  72          HB2       MET  72  -1.914  10.745   4.841
  550   2HB   MET  72          HB1       MET  72  -3.419  11.608   5.128
  551   1HG   MET  72          HG2       MET  72  -2.312  13.073   6.712
  552   2HG   MET  72          HG1       MET  72  -0.803  12.183   6.501
  553   1HE   MET  72          HE1       MET  72   0.457  14.462   5.966
  554   2HE   MET  72          HE2       MET  72  -1.049  15.356   6.164
  555   3HE   MET  72          HE3       MET  72  -0.063  15.600   4.722
  556    H    ASP  73           HN       ASP  73  -3.737   9.329   8.874
  557    HA   ASP  73           HA       ASP  73  -5.003   9.951  10.645
  558   1HB   ASP  73          HB2       ASP  73  -3.303  11.854  10.598
  559   2HB   ASP  73          HB1       ASP  73  -4.568  12.828   9.858
  560    H    ASN  74           HN       ASN  74  -6.160   9.915   7.770
  561    HA   ASN  74           HA       ASN  74  -8.325  11.796   7.914
  562   1HB   ASN  74          HB2       ASN  74  -7.778   9.562   5.963
  563   2HB   ASN  74          HB1       ASN  74  -9.149  10.656   5.838
  564   1HD2  ASN  74          HD21      ASN  74  -5.767  10.260   5.366
  565   2HD2  ASN  74          HD22      ASN  74  -5.463  11.803   4.658
  566    H    SER  75           HN       SER  75  -7.943   8.358   8.539
  567    HA   SER  75           HA       SER  75 -10.161   8.332  10.286
  568   1HB   SER  75          HB2       SER  75 -11.599   6.731   9.043
  569   2HB   SER  75          HB1       SER  75 -11.500   8.301   8.248
  570    HG   SER  75           HG       SER  75 -11.031   5.989   7.176
  571    H    ALA  76           HN       ALA  76 -10.679   5.959  10.930
  572    HA   ALA  76           HA       ALA  76  -8.126   4.623  11.315
  573   1HB   ALA  76          HB1       ALA  76  -9.562   4.933  13.258
  574   2HB   ALA  76          HB2       ALA  76  -9.357   3.216  12.909
  575   3HB   ALA  76          HB3       ALA  76 -10.855   4.033  12.463
  576    H    TRP  77           HN       TRP  77  -7.526   2.843  10.274
  577    HA   TRP  77           HA       TRP  77  -9.506   1.513   8.545
  578   1HB   TRP  77          HB2       TRP  77  -6.579   2.091   8.094
  579   2HB   TRP  77          HB1       TRP  77  -7.457   0.902   7.141
  580    HD1  TRP  77           HD1      TRP  77  -8.944   4.343   8.093
  581    HE1  TRP  77           HE1      TRP  77  -9.346   5.668   5.913
  582    HE3  TRP  77           HE3      TRP  77  -6.747   1.138   4.780
  583    HZ2  TRP  77           HZ2      TRP  77  -8.786   5.378   3.172
  584    HZ3  TRP  77           HZ3      TRP  77  -6.722   1.740   2.399
  585    HH2  TRP  77           HH2      TRP  77  -7.715   3.819   1.617
  586    H    THR  78           HN       THR  78  -9.251  -0.751   8.232
  587    HA   THR  78           HA       THR  78  -8.030  -2.139  10.481
  588    HB   THR  78           HB       THR  78  -9.655  -3.235   8.171
  589    HG1  THR  78           HG1      THR  78 -10.315  -2.199  10.717
  590   1HG2  THR  78          HG21      THR  78  -9.920  -5.219   9.565
  591   2HG2  THR  78          HG22      THR  78  -8.922  -4.491  10.823
  592   3HG2  THR  78          HG23      THR  78  -8.210  -4.911   9.265
  593    H    THR  79           HN       THR  79  -5.982  -2.742  10.341
  594    HA   THR  79           HA       THR  79  -4.695  -2.647   7.749
  595    HB   THR  79           HB       THR  79  -3.604  -1.397   9.476
  596    HG1  THR  79           HG1      THR  79  -2.397  -3.291   8.088
  597   1HG2  THR  79          HG21      THR  79  -2.663  -2.432  11.486
  598   2HG2  THR  79          HG22      THR  79  -3.393  -3.972  11.034
  599   3HG2  THR  79          HG23      THR  79  -4.418  -2.594  11.439
  600    H    ASP  80           HN       ASP  80  -4.354  -4.329   6.579
  601    HA   ASP  80           HA       ASP  80  -3.445  -6.805   7.872
  602   1HB   ASP  80          HB2       ASP  80  -5.675  -7.253   6.984
  603   2HB   ASP  80          HB1       ASP  80  -5.240  -6.536   5.438
  604    H    ASN  81           HN       ASN  81  -1.921  -8.015   6.373
  605    HA   ASN  81           HA       ASN  81  -0.221  -6.043   5.094
  606   1HB   ASN  81          HB2       ASN  81   0.182  -8.947   5.768
  607   2HB   ASN  81          HB1       ASN  81   1.319  -8.065   4.752
  608   1HD2  ASN  81          HD21      ASN  81   2.520  -6.348   5.658
  609   2HD2  ASN  81          HD22      ASN  81   2.712  -6.190   7.373
  610    H    GLY  82           HN       GLY  82  -2.764  -7.915   4.099
  611   1HA   GLY  82          HA2       GLY  82  -1.700  -8.061   1.360
  612   2HA   GLY  82          HA1       GLY  82  -3.107  -8.938   1.951
  613    H    VAL  83           HN       VAL  83  -4.289  -6.732   3.314
  614    HA   VAL  83           HA       VAL  83  -4.868  -4.847   1.147
  615    HB   VAL  83           HB       VAL  83  -7.287  -4.970   1.641
  616   1HG1  VAL  83          HG11      VAL  83  -6.081  -7.593   0.766
  617   2HG1  VAL  83          HG12      VAL  83  -6.391  -6.196  -0.266
  618   3HG1  VAL  83          HG13      VAL  83  -7.738  -7.070   0.466
  619   1HG2  VAL  83          HG21      VAL  83  -8.174  -6.889   2.896
  620   2HG2  VAL  83          HG22      VAL  83  -7.170  -5.846   3.905
  621   3HG2  VAL  83          HG23      VAL  83  -6.527  -7.373   3.302
  622    H    PHE  84           HN       PHE  84  -5.870  -2.882   1.888
  623    HA   PHE  84           HA       PHE  84  -5.747  -2.450   4.785
  624   1HB   PHE  84          HB2       PHE  84  -3.703  -1.603   3.184
  625   2HB   PHE  84          HB1       PHE  84  -4.770  -0.207   3.108
  626    HD1  PHE  84           HD1      PHE  84  -5.665   0.608   5.468
  627    HD2  PHE  84           HD2      PHE  84  -2.149  -1.708   4.851
  628    HE1  PHE  84           HE1      PHE  84  -4.774   1.395   7.622
  629    HE2  PHE  84           HE2      PHE  84  -1.254  -0.926   7.004
  630    HZ   PHE  84           HZ       PHE  84  -2.567   0.629   8.393
  631    H    TYR  85           HN       TYR  85  -7.837  -1.972   5.223
  632    HA   TYR  85           HA       TYR  85  -9.179  -0.030   3.492
  633   1HB   TYR  85          HB2       TYR  85 -11.221  -1.369   3.391
  634   2HB   TYR  85          HB1       TYR  85  -9.872  -2.212   2.650
  635    HD1  TYR  85           HD1      TYR  85 -12.612  -2.523   4.808
  636    HD2  TYR  85           HD2      TYR  85  -8.617  -3.912   4.268
  637    HE1  TYR  85           HE1      TYR  85 -13.113  -4.506   6.187
  638    HE2  TYR  85           HE2      TYR  85  -9.116  -5.893   5.638
  639    HH   TYR  85           HH       TYR  85 -10.596  -6.765   7.146
  640    H    LYS  86           HN       LYS  86 -10.768   1.188   4.458
  641    HA   LYS  86           HA       LYS  86 -10.543   1.387   7.309
  642   1HB   LYS  86          HB2       LYS  86 -12.146   3.269   7.076
  643   2HB   LYS  86          HB1       LYS  86 -10.703   3.443   6.092
  644   1HG   LYS  86          HG2       LYS  86 -11.897   2.921   4.108
  645   2HG   LYS  86          HG1       LYS  86 -13.319   2.416   5.025
  646   1HD   LYS  86          HD2       LYS  86 -13.644   4.682   5.824
  647   2HD   LYS  86          HD1       LYS  86 -12.174   5.207   5.009
  648   1HE   LYS  86          HE2       LYS  86 -13.149   4.835   2.861
  649   2HE   LYS  86          HE1       LYS  86 -14.554   4.037   3.568
  650   1HZ   LYS  86          HZ1       LYS  86 -14.845   6.434   2.864
  651   2HZ   LYS  86          HZ2       LYS  86 -13.868   6.864   4.178
  652   3HZ   LYS  86          HZ3       LYS  86 -15.340   6.061   4.436
  653    H    ASN  87           HN       ASN  87 -12.334   1.406   8.755
  654    HA   ASN  87           HA       ASN  87 -14.159  -0.789   8.248
  655   1HB   ASN  87          HB2       ASN  87 -14.768  -0.538  10.616
  656   2HB   ASN  87          HB1       ASN  87 -13.021  -0.622  10.426
  657   1HD2  ASN  87          HD21      ASN  87 -14.663   0.488  12.575
  658   2HD2  ASN  87          HD22      ASN  87 -14.172   2.140  12.741
  659    H    ASP  88           HN       ASP  88 -14.194   2.242   7.300
  660    HA   ASP  88           HA       ASP  88 -17.054   2.700   7.799
  661   1HB   ASP  88          HB2       ASP  88 -15.024   4.630   6.639
  662   2HB   ASP  88          HB1       ASP  88 -16.679   5.001   7.100
  663    H    VAL  89           HN       VAL  89 -18.454   2.351   6.143
  664    HA   VAL  89           HA       VAL  89 -17.300   1.704   3.552
  665    HB   VAL  89           HB       VAL  89 -19.613   1.017   2.905
  666   1HG1  VAL  89          HG11      VAL  89 -19.609  -1.022   4.265
  667   2HG1  VAL  89          HG12      VAL  89 -18.479  -0.269   5.390
  668   3HG1  VAL  89          HG13      VAL  89 -17.984  -0.595   3.729
  669   1HG2  VAL  89          HG21      VAL  89 -21.292   0.729   4.677
  670   2HG2  VAL  89          HG22      VAL  89 -20.888   2.429   4.444
  671   3HG2  VAL  89          HG23      VAL  89 -20.227   1.547   5.820
  672    H    GLY  90           HN       GLY  90 -16.836   3.367   2.323
  673   1HA   GLY  90          HA2       GLY  90 -18.688   4.887   0.974
  674   2HA   GLY  90          HA1       GLY  90 -18.259   5.847   2.385
  675    H    SER  91           HN       SER  91 -17.413   7.381   0.789
  676    HA   SER  91           HA       SER  91 -15.089   6.549  -0.715
  677   1HB   SER  91          HB2       SER  91 -16.386   9.274  -0.421
  678   2HB   SER  91          HB1       SER  91 -15.113   8.860  -1.572
  679    HG   SER  91           HG       SER  91 -17.685   8.647  -1.957
  680    H    TRP  92           HN       TRP  92 -13.010   7.341  -0.396
  681    HA   TRP  92           HA       TRP  92 -12.506   8.502   2.266
  682   1HB   TRP  92          HB2       TRP  92 -11.851   6.087   2.028
  683   2HB   TRP  92          HB1       TRP  92 -10.678   6.601   0.813
  684    HD1  TRP  92           HD1      TRP  92 -11.438   7.042   4.575
  685    HE1  TRP  92           HE1      TRP  92  -9.242   7.686   5.756
  686    HE3  TRP  92           HE3      TRP  92  -8.471   7.518   0.474
  687    HZ2  TRP  92           HZ2      TRP  92  -6.578   8.310   5.009
  688    HZ3  TRP  92           HZ3      TRP  92  -6.133   8.147   0.778
  689    HH2  TRP  92           HH2      TRP  92  -5.197   8.533   2.996
  690    H    GLY  93           HN       GLY  93 -10.920   7.926  -0.824
  691   1HA   GLY  93          HA2       GLY  93  -9.361   9.187  -1.984
  692   2HA   GLY  93          HA1       GLY  93 -10.712  10.287  -2.000
  693    H    GLY  94           HN       GLY  94  -7.614   9.552  -0.633
  694   1HA   GLY  94          HA2       GLY  94  -7.170  12.339  -0.075
  695   2HA   GLY  94          HA1       GLY  94  -7.249  11.349   1.377
  696    H    THR  95           HN       THR  95  -5.268  10.931   2.100
  697    HA   THR  95           HA       THR  95  -3.272   9.954   0.188
  698    HB   THR  95           HB       THR  95  -1.581  11.221   1.772
  699    HG1  THR  95           HG1      THR  95  -2.441  12.766   2.947
  700   1HG2  THR  95          HG21      THR  95  -1.780  11.567  -0.644
  701   2HG2  THR  95          HG22      THR  95  -1.569  13.100   0.201
  702   3HG2  THR  95          HG23      THR  95  -3.164  12.627  -0.382
  703    H    ILE  96           HN       ILE  96  -2.266   8.170   0.826
  704    HA   ILE  96           HA       ILE  96  -2.277   7.485   3.692
  705    HB   ILE  96           HB       ILE  96  -1.871   5.081   2.785
  706   1HG1  ILE  96          HG12      ILE  96  -1.821   6.082   0.385
  707   2HG1  ILE  96          HG11      ILE  96  -2.605   4.530   0.665
  708   1HG2  ILE  96          HG21      ILE  96  -4.322   4.666   2.709
  709   2HG2  ILE  96          HG22      ILE  96  -4.566   6.412   2.766
  710   3HG2  ILE  96          HG23      ILE  96  -3.775   5.583   4.109
  711   1HD1  ILE  96          HD11      ILE  96  -3.905   5.960  -0.816
  712   2HD1  ILE  96          HD12      ILE  96  -4.003   7.186   0.447
  713   3HD1  ILE  96          HD13      ILE  96  -4.777   5.618   0.676
  714    H    GLY  97           HN       GLY  97  -0.319   6.965   4.602
  715   1HA   GLY  97          HA2       GLY  97   1.981   7.584   2.883
  716   2HA   GLY  97          HA1       GLY  97   1.944   7.727   4.630
  717    H    ILE  98           HN       ILE  98   3.960   6.407   3.124
  718    HA   ILE  98           HA       ILE  98   3.474   3.597   3.735
  719    HB   ILE  98           HB       ILE  98   5.675   4.994   2.228
  720   1HG1  ILE  98          HG12      ILE  98   4.956   3.190   0.529
  721   2HG1  ILE  98          HG11      ILE  98   3.546   2.981   1.570
  722   1HG2  ILE  98          HG21      ILE  98   5.645   2.107   3.089
  723   2HG2  ILE  98          HG22      ILE  98   6.785   3.347   3.612
  724   3HG2  ILE  98          HG23      ILE  98   6.770   2.814   1.931
  725   1HD1  ILE  98          HD11      ILE  98   4.353   5.528   0.187
  726   2HD1  ILE  98          HD12      ILE  98   2.949   5.320   1.232
  727   3HD1  ILE  98          HD13      ILE  98   3.048   4.444  -0.297
  728    H    TYR  99           HN       TYR  99   3.823   2.994   5.722
  729    HA   TYR  99           HA       TYR  99   6.017   4.243   7.243
  730   1HB   TYR  99          HB2       TYR  99   3.585   2.749   8.290
  731   2HB   TYR  99          HB1       TYR  99   4.823   3.517   9.272
  732    HD1  TYR  99           HD1      TYR  99   4.209   5.533  10.244
  733    HD2  TYR  99           HD2      TYR  99   2.514   4.488   6.491
  734    HE1  TYR  99           HE1      TYR  99   2.908   7.616  10.255
  735    HE2  TYR  99           HE2      TYR  99   1.206   6.563   6.494
  736    HH   TYR  99           HH       TYR  99   1.807   9.106   8.693
  737    H    VAL 100           HN       VAL 100   7.747   2.972   7.518
  738    HA   VAL 100           HA       VAL 100   7.959   0.350   6.574
  739    HB   VAL 100           HB       VAL 100   9.888   1.856   6.938
  740   1HG1  VAL 100          HG11      VAL 100   9.473   1.216   9.851
  741   2HG1  VAL 100          HG12      VAL 100   9.231   2.787   9.086
  742   3HG1  VAL 100          HG13      VAL 100  10.847   2.086   9.167
  743   1HG2  VAL 100          HG21      VAL 100  10.085  -0.773   8.392
  744   2HG2  VAL 100          HG22      VAL 100  11.441   0.164   7.763
  745   3HG2  VAL 100          HG23      VAL 100  10.256  -0.529   6.654
  746    H    ASP 101           HN       ASP 101   7.622  -1.641   7.500
  747    HA   ASP 101           HA       ASP 101   6.468  -1.712  10.162
  748   1HB   ASP 101          HB2       ASP 101   5.707  -3.164   8.192
  749   2HB   ASP 101          HB1       ASP 101   7.177  -4.097   8.450
  750    H    GLY 102           HN       GLY 102   8.247  -0.964  11.360
  751   1HA   GLY 102          HA2       GLY 102  10.100  -1.290  12.703
  752   2HA   GLY 102          HA1       GLY 102  10.228  -2.926  12.068
  753    H    GLN 103           HN       GLN 103  11.569   0.171  12.050
  754    HA   GLN 103           HA       GLN 103  12.702   0.662   9.667
  755   1HB   GLN 103          HB2       GLN 103  14.863   1.166  11.164
  756   2HB   GLN 103          HB1       GLN 103  13.438   2.191  11.157
  757   1HG   GLN 103          HG2       GLN 103  14.042   1.913  13.411
  758   2HG   GLN 103          HG1       GLN 103  12.628   0.898  13.156
  759   1HE2  GLN 103          HE21      GLN 103  16.044   0.960  13.755
  760   2HE2  GLN 103          HE22      GLN 103  16.208  -0.710  14.185
  761    H    GLN 104           HN       GLN 104  13.935  -0.309   8.226
  762    HA   GLN 104           HA       GLN 104  15.070  -2.910   8.879
  763   1HB   GLN 104          HB2       GLN 104  13.572  -2.457   6.879
  764   2HB   GLN 104          HB1       GLN 104  14.914  -1.572   6.175
  765   1HG   GLN 104          HG2       GLN 104  14.789  -3.819   5.279
  766   2HG   GLN 104          HG1       GLN 104  16.271  -3.606   6.209
  767   1HE2  GLN 104          HE21      GLN 104  13.174  -4.020   7.754
  768   2HE2  GLN 104          HE22      GLN 104  13.473  -5.604   8.377
  769    H    THR 105           HN       THR 105  16.226  -0.198   9.595
  770    HA   THR 105           HA       THR 105  18.306   0.568  10.072
  771    HB   THR 105           HB       THR 105  19.463  -1.843   8.677
  772    HG1  THR 105           HG1      THR 105  19.004  -3.038  10.435
  773   1HG2  THR 105          HG21      THR 105  21.240  -1.583  10.342
  774   2HG2  THR 105          HG22      THR 105  20.404  -0.183  11.019
  775   3HG2  THR 105          HG23      THR 105  21.051  -0.117   9.380
  776    H    ASN 106           HN       ASN 106  17.265   0.063   6.929
  777    HA   ASN 106           HA       ASN 106  17.731   0.977   4.914
  778   1HB   ASN 106          HB2       ASN 106  17.887   3.130   5.921
  779   2HB   ASN 106          HB1       ASN 106  19.464   2.775   6.600
  780   1HD2  ASN 106          HD21      ASN 106  18.657   1.927   3.292
  781   2HD2  ASN 106          HD22      ASN 106  19.682   3.107   2.556
  782    H    THR 107           HN       THR 107  18.542  -0.963   4.242
  783    HA   THR 107           HA       THR 107  21.415  -1.330   4.143
  784    HB   THR 107           HB       THR 107  20.474  -3.272   2.552
  785    HG1  THR 107           HG1      THR 107  18.433  -3.975   3.329
  786   1HG2  THR 107          HG21      THR 107  21.777  -3.646   4.563
  787   2HG2  THR 107          HG22      THR 107  20.400  -4.746   4.509
  788   3HG2  THR 107          HG23      THR 107  20.358  -3.332   5.562
  789    HA   PRO 108           HA       PRO 108  22.411   0.793   0.447
  790   1HB   PRO 108          HB2       PRO 108  23.208  -1.928  -0.536
  791   2HB   PRO 108          HB1       PRO 108  24.065  -0.388  -0.686
  792   1HG   PRO 108          HG2       PRO 108  24.758  -2.165   1.181
  793   2HG   PRO 108          HG1       PRO 108  24.790  -0.424   1.513
  794   1HD   PRO 108          HD2       PRO 108  22.925  -2.491   2.502
  795   2HD   PRO 108          HD1       PRO 108  23.347  -0.920   3.208
  796    HA   PRO 109           HA       PRO 109  18.468  -0.561  -1.274
  797   1HB   PRO 109          HB2       PRO 109  17.928   2.242  -1.813
  798   2HB   PRO 109          HB1       PRO 109  17.143   1.166  -0.656
  799   1HG   PRO 109          HG2       PRO 109  18.746   3.256   0.067
  800   2HG   PRO 109          HG1       PRO 109  18.508   1.810   1.060
  801   1HD   PRO 109          HD2       PRO 109  20.797   2.526  -0.729
  802   2HD   PRO 109          HD1       PRO 109  20.805   1.712   0.862
  803    H    GLY 110           HN       GLY 110  17.213   0.220  -3.268
  804   1HA   GLY 110          HA2       GLY 110  18.807   1.261  -5.447
  805   2HA   GLY 110          HA1       GLY 110  18.308  -0.420  -5.611
  806    H    ASN 111           HN       ASN 111  16.664  -0.521  -6.951
  807    HA   ASN 111           HA       ASN 111  14.521   1.461  -6.756
  808   1HB   ASN 111          HB2       ASN 111  15.416   0.786  -9.005
  809   2HB   ASN 111          HB1       ASN 111  14.820  -0.841  -8.705
  810   1HD2  ASN 111          HD21      ASN 111  14.153   1.030 -10.804
  811   2HD2  ASN 111          HD22      ASN 111  12.443   1.280 -10.712
  812    H    TYR 112           HN       TYR 112  13.182   1.005  -5.092
  813    HA   TYR 112           HA       TYR 112  12.304  -1.776  -4.774
  814   1HB   TYR 112          HB2       TYR 112  12.128   0.589  -2.894
  815   2HB   TYR 112          HB1       TYR 112  11.255  -0.919  -2.622
  816    HD1  TYR 112           HD1      TYR 112  12.695  -3.095  -2.566
  817    HD2  TYR 112           HD2      TYR 112  14.299   0.818  -2.130
  818    HE1  TYR 112           HE1      TYR 112  14.662  -4.034  -1.445
  819    HE2  TYR 112           HE2      TYR 112  16.276  -0.115  -1.012
  820    HH   TYR 112           HH       TYR 112  16.843  -2.169   0.295
  821    H    THR 113           HN       THR 113  10.663  -2.251  -5.963
  822    HA   THR 113           HA       THR 113   8.743  -0.176  -6.718
  823    HB   THR 113           HB       THR 113   9.111  -2.964  -7.831
  824    HG1  THR 113           HG1      THR 113  10.621  -0.772  -8.128
  825   1HG2  THR 113          HG21      THR 113   7.814  -2.122  -9.730
  826   2HG2  THR 113          HG22      THR 113   7.625  -0.568  -8.916
  827   3HG2  THR 113          HG23      THR 113   6.885  -2.014  -8.234
  828    H    LEU 114           HN       LEU 114   6.792  -0.128  -5.797
  829    HA   LEU 114           HA       LEU 114   5.619  -2.649  -4.882
  830   1HB   LEU 114          HB2       LEU 114   4.555  -1.095  -3.019
  831   2HB   LEU 114          HB1       LEU 114   6.082  -1.919  -2.780
  832    HG   LEU 114           HG       LEU 114   6.133   0.849  -3.875
  833   1HD1  LEU 114          HD11      LEU 114   4.576   1.013  -1.999
  834   2HD1  LEU 114          HD12      LEU 114   6.120   1.766  -1.600
  835   3HD1  LEU 114          HD13      LEU 114   5.725   0.169  -0.962
  836   1HD2  LEU 114          HD21      LEU 114   7.896  -0.679  -1.976
  837   2HD2  LEU 114          HD22      LEU 114   8.205   0.941  -2.602
  838   3HD2  LEU 114          HD23      LEU 114   8.186  -0.440  -3.699
  839    H    THR 115           HN       THR 115   3.971  -2.957  -6.155
  840    HA   THR 115           HA       THR 115   2.577  -0.667  -7.322
  841    HB   THR 115           HB       THR 115   2.238  -3.595  -7.997
  842    HG1  THR 115           HG1      THR 115   4.456  -2.742  -8.238
  843   1HG2  THR 115          HG21      THR 115   1.709  -1.084  -9.590
  844   2HG2  THR 115          HG22      THR 115   0.481  -2.083  -8.812
  845   3HG2  THR 115          HG23      THR 115   1.442  -2.740 -10.138
  846    H    LEU 116           HN       LEU 116   0.414  -0.282  -7.013
  847    HA   LEU 116           HA       LEU 116  -0.977  -2.014  -5.078
  848   1HB   LEU 116          HB2       LEU 116  -0.963   0.997  -5.226
  849   2HB   LEU 116          HB1       LEU 116  -2.056   0.070  -4.215
  850    HG   LEU 116           HG       LEU 116   0.955   0.098  -3.969
  851   1HD1  LEU 116          HD11      LEU 116  -1.179   1.388  -2.275
  852   2HD1  LEU 116          HD12      LEU 116  -0.005   2.218  -3.296
  853   3HD1  LEU 116          HD13      LEU 116   0.537   1.318  -1.879
  854   1HD2  LEU 116          HD21      LEU 116   0.560  -1.119  -1.876
  855   2HD2  LEU 116          HD22      LEU 116   0.012  -2.030  -3.282
  856   3HD2  LEU 116          HD23      LEU 116  -1.160  -1.202  -2.257
  857    H    THR 117           HN       THR 117  -2.869  -2.744  -5.758
  858    HA   THR 117           HA       THR 117  -4.036  -1.568  -8.184
  859    HB   THR 117           HB       THR 117  -4.724  -4.218  -6.902
  860    HG1  THR 117           HG1      THR 117  -2.467  -3.515  -8.128
  861   1HG2  THR 117          HG21      THR 117  -5.135  -3.171  -9.708
  862   2HG2  THR 117          HG22      THR 117  -6.390  -3.324  -8.477
  863   3HG2  THR 117          HG23      THR 117  -5.599  -4.766  -9.117
  864    H    GLY 118           HN       GLY 118  -5.686  -0.221  -7.902
  865   1HA   GLY 118          HA2       GLY 118  -6.966   0.132  -5.393
  866   2HA   GLY 118          HA1       GLY 118  -7.439   0.883  -6.910
  867    H    GLY 119           HN       GLY 119  -9.038  -0.331  -4.716
  868   1HA   GLY 119          HA2       GLY 119 -11.161  -1.264  -6.175
  869   2HA   GLY 119          HA1       GLY 119 -10.222  -2.703  -5.793
  870    H    TYR 120           HN       TYR 120 -12.596  -2.870  -4.806
  871    HA   TYR 120           HA       TYR 120 -12.434  -1.879  -2.055
  872   1HB   TYR 120          HB2       TYR 120 -14.813  -2.524  -1.842
  873   2HB   TYR 120          HB1       TYR 120 -14.535  -1.316  -3.084
  874    HD1  TYR 120           HD1      TYR 120 -15.523  -4.797  -2.435
  875    HD2  TYR 120           HD2      TYR 120 -14.940  -1.816  -5.414
  876    HE1  TYR 120           HE1      TYR 120 -16.799  -6.157  -4.043
  877    HE2  TYR 120           HE2      TYR 120 -16.206  -3.167  -7.026
  878    HH   TYR 120           HH       TYR 120 -17.993  -5.966  -6.077
  879    H    TRP 121           HN       TRP 121 -13.500  -3.466  -0.480
  880    HA   TRP 121           HA       TRP 121 -12.576  -6.194  -1.011
  881   1HB   TRP 121          HB2       TRP 121 -10.804  -5.470   0.297
  882   2HB   TRP 121          HB1       TRP 121 -11.789  -4.310   1.176
  883    HD1  TRP 121           HD1      TRP 121 -13.563  -5.498   2.970
  884    HE1  TRP 121           HE1      TRP 121 -13.116  -7.435   4.588
  885    HE3  TRP 121           HE3      TRP 121  -9.480  -7.521   0.682
  886    HZ2  TRP 121           HZ2      TRP 121 -11.275  -9.519   4.869
  887    HZ3  TRP 121           HZ3      TRP 121  -8.431  -9.502   1.722
  888    HH2  TRP 121           HH2      TRP 121  -9.317 -10.470   3.758
  889    H    ALA 122           HN       ALA 122 -13.794  -7.791  -0.008
  890    HA   ALA 122           HA       ALA 122 -16.253  -6.861   1.293
  891   1HB   ALA 122          HB1       ALA 122 -15.901  -9.290  -0.457
  892   2HB   ALA 122          HB2       ALA 122 -16.663  -7.774  -0.939
  893   3HB   ALA 122          HB3       ALA 122 -17.399  -8.771   0.315
  894    H    LYS 123           HN       LYS 123 -16.902  -7.826   3.078
  895    HA   LYS 123           HA       LYS 123 -17.064  -9.132   4.895
  896   1HB   LYS 123          HB2       LYS 123 -16.515 -10.953   3.010
  897   2HB   LYS 123          HB1       LYS 123 -15.079 -11.132   4.014
  898   1HG   LYS 123          HG2       LYS 123 -16.796 -12.710   4.696
  899   2HG   LYS 123          HG1       LYS 123 -16.501 -11.526   5.974
  900   1HD   LYS 123          HD2       LYS 123 -18.461 -10.227   5.058
  901   2HD   LYS 123          HD1       LYS 123 -18.811 -11.622   4.040
  902   1HE   LYS 123          HE2       LYS 123 -18.724 -11.583   7.054
  903   2HE   LYS 123          HE1       LYS 123 -20.174 -11.650   6.055
  904   1HZ   LYS 123          HZ1       LYS 123 -19.761 -13.832   6.743
  905   2HZ   LYS 123          HZ2       LYS 123 -18.103 -13.733   6.421
  906   3HZ   LYS 123          HZ3       LYS 123 -19.212 -13.785   5.138
  907    H    ASP 124           HN       ASP 124 -14.710 -10.850   5.777
  908    HA   ASP 124           HA       ASP 124 -12.760  -8.811   6.443
  909   1HB   ASP 124          HB2       ASP 124 -14.244  -8.445   8.244
  910   2HB   ASP 124          HB1       ASP 124 -14.557 -10.164   8.443
  911    H    ASN 125           HN       ASN 125 -10.847  -9.587   6.288
  912    HA   ASN 125           HA       ASN 125  -9.047 -10.882   6.079
  913   1HB   ASN 125          HB2       ASN 125  -8.351 -11.752   8.003
  914   2HB   ASN 125          HB1       ASN 125  -9.821 -11.022   8.614
  915   1HD2  ASN 125          HD21      ASN 125  -8.192 -13.308   9.513
  916   2HD2  ASN 125          HD22      ASN 125  -9.290 -14.642   9.642
  917    H    LYS 126           HN       LYS 126 -11.920 -12.332   5.301
  918    HA   LYS 126           HA       LYS 126 -10.898 -14.935   4.663
  919   1HB   LYS 126          HB2       LYS 126 -13.047 -15.303   3.595
  920   2HB   LYS 126          HB1       LYS 126 -13.279 -14.541   5.161
  921   1HG   LYS 126          HG2       LYS 126 -14.630 -13.147   4.079
  922   2HG   LYS 126          HG1       LYS 126 -13.146 -12.387   3.496
  923   1HD   LYS 126          HD2       LYS 126 -13.212 -13.954   1.544
  924   2HD   LYS 126          HD1       LYS 126 -14.804 -14.480   2.098
  925   1HE   LYS 126          HE2       LYS 126 -15.502 -12.062   2.004
  926   2HE   LYS 126          HE1       LYS 126 -13.974 -11.739   1.188
  927   1HZ   LYS 126          HZ1       LYS 126 -16.117 -13.556   0.213
  928   2HZ   LYS 126          HZ2       LYS 126 -14.613 -13.344  -0.535
  929   3HZ   LYS 126          HZ3       LYS 126 -15.703 -12.049  -0.443
  930    H    GLN 127           HN       GLN 127 -10.326 -11.994   3.442
  931    HA   GLN 127           HA       GLN 127  -9.306 -11.172   1.618
  932   1HB   GLN 127          HB2       GLN 127  -7.987 -13.320   1.775
  933   2HB   GLN 127          HB1       GLN 127  -9.085 -13.995   0.578
  934   1HG   GLN 127          HG2       GLN 127  -8.404 -12.336  -1.036
  935   2HG   GLN 127          HG1       GLN 127  -7.374 -11.554   0.162
  936   1HE2  GLN 127          HE21      GLN 127  -5.450 -12.550   0.777
  937   2HE2  GLN 127          HE22      GLN 127  -4.739 -13.820  -0.155
  938    H    GLY 128           HN       GLY 128 -11.570 -10.377   1.337
  939   1HA   GLY 128          HA2       GLY 128 -12.785 -11.489  -1.098
  940   2HA   GLY 128          HA1       GLY 128 -13.608 -10.473   0.083
  941    H    PHE 129           HN       PHE 129 -10.466 -10.027  -1.535
  942    HA   PHE 129           HA       PHE 129 -11.103  -7.263  -1.895
  943   1HB   PHE 129          HB2       PHE 129  -8.845  -7.007  -2.581
  944   2HB   PHE 129          HB1       PHE 129  -8.823  -8.168  -1.271
  945    HD1  PHE 129           HD1      PHE 129  -8.654 -10.634  -1.876
  946    HD2  PHE 129           HD2      PHE 129  -7.888  -7.495  -4.644
  947    HE1  PHE 129           HE1      PHE 129  -7.382 -12.194  -3.289
  948    HE2  PHE 129           HE2      PHE 129  -6.617  -9.051  -6.064
  949    HZ   PHE 129           HZ       PHE 129  -6.362 -11.405  -5.386
  950    H    THR 130           HN       THR 130 -11.909  -6.324  -3.667
  951    HA   THR 130           HA       THR 130 -11.873  -7.834  -6.200
  952    HB   THR 130           HB       THR 130 -13.964  -5.816  -5.364
  953    HG1  THR 130           HG1      THR 130 -14.538  -8.555  -5.491
  954   1HG2  THR 130          HG21      THR 130 -13.964  -7.893  -7.557
  955   2HG2  THR 130          HG22      THR 130 -13.689  -6.167  -7.791
  956   3HG2  THR 130          HG23      THR 130 -15.252  -6.742  -7.209
  957    HA   PRO 131           HA       PRO 131  -9.416  -4.286  -7.544
  958   1HB   PRO 131          HB2       PRO 131  -9.741  -5.581 -10.178
  959   2HB   PRO 131          HB1       PRO 131  -8.263  -5.154  -9.310
  960   1HG   PRO 131          HG2       PRO 131  -9.038  -7.700  -9.553
  961   2HG   PRO 131          HG1       PRO 131  -8.269  -7.107  -8.070
  962   1HD   PRO 131          HD2       PRO 131 -11.168  -7.624  -8.626
  963   2HD   PRO 131          HD1       PRO 131 -10.218  -7.994  -7.170
  964    H    SER 132           HN       SER 132 -10.284  -2.374  -7.936
  965    HA   SER 132           HA       SER 132 -12.055  -1.944 -10.160
  966   1HB   SER 132          HB2       SER 132 -13.598  -0.637  -8.355
  967   2HB   SER 132          HB1       SER 132 -13.928  -2.281  -8.903
  968    HG   SER 132           HG       SER 132 -12.769  -3.038  -7.081
  969    H    GLY 133           HN       GLY 133 -10.576  -0.543 -10.968
  970   1HA   GLY 133          HA2       GLY 133 -10.473   2.062 -10.693
  971   2HA   GLY 133          HA1       GLY 133  -9.548   1.605  -9.266
  972    H    THR 134           HN       THR 134  -7.596   2.471  -9.971
  973    HA   THR 134           HA       THR 134  -6.483   1.231 -12.395
  974    HB   THR 134           HB       THR 134  -4.812   3.099 -12.334
  975    HG1  THR 134           HG1      THR 134  -4.798   4.249 -10.562
  976   1HG2  THR 134          HG21      THR 134  -6.729   3.185 -13.833
  977   2HG2  THR 134          HG22      THR 134  -6.372   4.795 -13.207
  978   3HG2  THR 134          HG23      THR 134  -7.723   3.873 -12.549
  979    H    THR 135           HN       THR 135  -4.252   0.609 -12.371
  980    HA   THR 135           HA       THR 135  -3.364  -0.325  -9.746
  981    HB   THR 135           HB       THR 135  -2.202  -1.067 -12.439
  982    HG1  THR 135           HG1      THR 135  -3.589  -2.957 -12.206
  983   1HG2  THR 135          HG21      THR 135  -1.421  -3.051 -11.248
  984   2HG2  THR 135          HG22      THR 135  -2.189  -2.482  -9.766
  985   3HG2  THR 135          HG23      THR 135  -0.835  -1.588 -10.457
  986    H    GLY 136           HN       GLY 136  -2.255   1.309  -8.792
  987   1HA   GLY 136          HA2       GLY 136  -0.437   2.945 -10.403
  988   2HA   GLY 136          HA1       GLY 136  -0.954   3.281  -8.755
  989    H    THR 137           HN       THR 137   1.722   3.434  -9.526
  990    HA   THR 137           HA       THR 137   2.842   1.106  -8.124
  991    HB   THR 137           HB       THR 137   4.187   2.538 -10.423
  992    HG1  THR 137           HG1      THR 137   2.177   0.956 -10.630
  993   1HG2  THR 137          HG21      THR 137   5.734   1.492  -8.840
  994   2HG2  THR 137          HG22      THR 137   5.717   0.616 -10.371
  995   3HG2  THR 137          HG23      THR 137   4.854  -0.031  -8.975
  996    H    THR 138           HN       THR 138   3.440   1.867  -6.193
  997    HA   THR 138           HA       THR 138   4.628   4.486  -5.892
  998    HB   THR 138           HB       THR 138   4.629   2.322  -3.785
  999    HG1  THR 138           HG1      THR 138   2.481   3.963  -4.671
 1000   1HG2  THR 138          HG21      THR 138   5.872   4.385  -3.322
 1001   2HG2  THR 138          HG22      THR 138   4.467   4.230  -2.265
 1002   3HG2  THR 138          HG23      THR 138   4.418   5.331  -3.642
 1003    H    LYS 139           HN       LYS 139   6.710   4.825  -6.382
 1004    HA   LYS 139           HA       LYS 139   8.516   2.499  -6.282
 1005   1HB   LYS 139          HB2       LYS 139   8.080   3.502  -8.541
 1006   2HB   LYS 139          HB1       LYS 139   8.817   4.988  -7.965
 1007   1HG   LYS 139          HG2       LYS 139  10.928   3.831  -7.614
 1008   2HG   LYS 139          HG1       LYS 139  10.195   2.314  -8.140
 1009   1HD   LYS 139          HD2       LYS 139  10.464   4.803  -9.827
 1010   2HD   LYS 139          HD1       LYS 139  11.516   3.389  -9.918
 1011   1HE   LYS 139          HE2       LYS 139   9.668   2.003 -10.611
 1012   2HE   LYS 139          HE1       LYS 139   8.538   3.336 -10.389
 1013   1HZ   LYS 139          HZ1       LYS 139   9.132   3.014 -12.719
 1014   2HZ   LYS 139          HZ2       LYS 139  10.765   3.290 -12.355
 1015   3HZ   LYS 139          HZ3       LYS 139   9.630   4.536 -12.159
 1016    H    LEU 140           HN       LEU 140   9.597   2.540  -4.504
 1017    HA   LEU 140           HA       LEU 140  10.634   5.068  -3.481
 1018   1HB   LEU 140          HB2       LEU 140   9.651   3.859  -1.744
 1019   2HB   LEU 140          HB1       LEU 140  10.266   2.323  -2.321
 1020    HG   LEU 140           HG       LEU 140  12.541   3.030  -1.652
 1021   1HD1  LEU 140          HD11      LEU 140  12.243   5.445  -1.780
 1022   2HD1  LEU 140          HD12      LEU 140  12.816   4.967  -0.183
 1023   3HD1  LEU 140          HD13      LEU 140  11.120   5.391  -0.421
 1024   1HD2  LEU 140          HD21      LEU 140  10.477   3.100   0.545
 1025   2HD2  LEU 140          HD22      LEU 140  12.195   2.767   0.756
 1026   3HD2  LEU 140          HD23      LEU 140  11.190   1.654  -0.170
 1027    H    THR 141           HN       THR 141  12.499   5.669  -4.282
 1028    HA   THR 141           HA       THR 141  14.430   3.592  -5.099
 1029    HB   THR 141           HB       THR 141  14.098   6.279  -6.431
 1030    HG1  THR 141           HG1      THR 141  12.339   4.378  -6.484
 1031   1HG2  THR 141          HG21      THR 141  15.288   5.186  -8.282
 1032   2HG2  THR 141          HG22      THR 141  15.400   3.702  -7.336
 1033   3HG2  THR 141          HG23      THR 141  16.243   5.156  -6.800
 1034    H    VAL 142           HN       VAL 142  16.574   3.950  -4.606
 1035    HA   VAL 142           HA       VAL 142  17.179   6.114  -2.782
 1036    HB   VAL 142           HB       VAL 142  18.162   3.853  -2.454
 1037   1HG1  VAL 142          HG11      VAL 142  20.007   3.108  -3.858
 1038   2HG1  VAL 142          HG12      VAL 142  19.784   4.505  -4.911
 1039   3HG1  VAL 142          HG13      VAL 142  18.526   3.274  -4.803
 1040   1HG2  VAL 142          HG21      VAL 142  20.186   6.039  -2.924
 1041   2HG2  VAL 142          HG22      VAL 142  20.416   4.610  -1.914
 1042   3HG2  VAL 142          HG23      VAL 142  19.215   5.824  -1.469
 1043    H    THR 143           HN       THR 143  18.451   7.877  -3.229
 1044    HA   THR 143           HA       THR 143  19.614   8.154  -5.882
 1045    HB   THR 143           HB       THR 143  17.678  10.193  -4.750
 1046    HG1  THR 143           HG1      THR 143  17.291   7.996  -6.251
 1047   1HG2  THR 143          HG21      THR 143  19.225  10.145  -7.346
 1048   2HG2  THR 143          HG22      THR 143  19.472  11.262  -6.003
 1049   3HG2  THR 143          HG23      THR 143  17.975  11.315  -6.934
  Start of MODEL   15
    1    H    GLU   1           H        GLU   1 -18.472   6.680  -9.958
    2    HA   GLU   1           HA       GLU   1 -20.610   4.714 -10.506
    3   1HB   GLU   1          HB2       GLU   1 -17.967   5.278 -11.866
    4   2HB   GLU   1          HB1       GLU   1 -18.917   3.829 -12.152
    5   1HG   GLU   1          HG2       GLU   1 -19.273   5.428 -13.920
    6   2HG   GLU   1          HG1       GLU   1 -20.756   5.213 -12.994
    7    H    GLU   2           HN       GLU   2 -20.562   3.098  -9.145
    8    HA   GLU   2           HA       GLU   2 -19.891   1.598  -7.584
    9   1HB   GLU   2          HB2       GLU   2 -18.270   0.039  -8.369
   10   2HB   GLU   2          HB1       GLU   2 -19.203   0.618  -9.740
   11   1HG   GLU   2          HG2       GLU   2 -17.349   2.193 -10.244
   12   2HG   GLU   2          HG1       GLU   2 -16.432   1.413  -8.958
   13    H    CYS   3           HN       CYS   3 -17.153   0.743  -7.010
   14    HA   CYS   3           HA       CYS   3 -16.236   3.089  -5.488
   15   1HB   CYS   3          HB2       CYS   3 -16.914   1.155  -4.101
   16   2HB   CYS   3          HB1       CYS   3 -15.735   0.151  -4.938
   17    H    GLN   4           HN       GLN   4 -14.994   3.955  -7.167
   18    HA   GLN   4           HA       GLN   4 -12.851   2.248  -8.217
   19   1HB   GLN   4          HB2       GLN   4 -14.265   3.269  -9.917
   20   2HB   GLN   4          HB1       GLN   4 -13.954   4.867  -9.249
   21   1HG   GLN   4          HG2       GLN   4 -11.620   4.686  -9.832
   22   2HG   GLN   4          HG1       GLN   4 -11.876   3.049 -10.427
   23   1HE2  GLN   4          HE21      GLN   4 -14.178   5.614 -10.951
   24   2HE2  GLN   4          HE22      GLN   4 -13.916   5.759 -12.654
   25    H    VAL   5           HN       VAL   5 -10.984   2.422  -7.193
   26    HA   VAL   5           HA       VAL   5 -10.333   4.967  -5.862
   27    HB   VAL   5           HB       VAL   5  -9.182   2.229  -5.289
   28   1HG1  VAL   5          HG11      VAL   5  -9.002   4.823  -3.755
   29   2HG1  VAL   5          HG12      VAL   5  -7.699   4.069  -4.672
   30   3HG1  VAL   5          HG13      VAL   5  -8.344   3.271  -3.237
   31   1HG2  VAL   5          HG21      VAL   5 -11.552   2.265  -4.753
   32   2HG2  VAL   5          HG22      VAL   5 -11.338   3.753  -3.832
   33   3HG2  VAL   5          HG23      VAL   5 -10.589   2.256  -3.274
   34    H    ARG   6           HN       ARG   6  -8.705   6.138  -6.660
   35    HA   ARG   6           HA       ARG   6  -7.005   4.930  -8.701
   36   1HB   ARG   6          HB2       ARG   6  -6.330   7.141  -9.305
   37   2HB   ARG   6          HB1       ARG   6  -8.074   7.159  -9.099
   38   1HG   ARG   6          HG2       ARG   6  -7.901   8.289  -7.022
   39   2HG   ARG   6          HG1       ARG   6  -6.154   8.049  -6.966
   40   1HD   ARG   6          HD2       ARG   6  -6.633  10.323  -7.613
   41   2HD   ARG   6          HD1       ARG   6  -5.926   9.458  -8.978
   42    HE   ARG   6           HE       ARG   6  -8.844   9.726  -8.794
   43   1HH1  ARG   6          HH11      ARG   6  -5.841  10.500 -10.412
   44   2HH1  ARG   6          HH12      ARG   6  -6.624  11.174 -11.814
   45   1HH2  ARG   6          HH21      ARG   6  -9.873  10.611 -10.623
   46   2HH2  ARG   6          HH22      ARG   6  -8.915  11.219 -11.942
   47    H    VAL   7           HN       VAL   7  -4.842   4.682  -8.538
   48    HA   VAL   7           HA       VAL   7  -3.543   5.519  -6.034
   49    HB   VAL   7           HB       VAL   7  -2.798   3.127  -7.740
   50   1HG1  VAL   7          HG11      VAL   7  -1.744   4.029  -5.060
   51   2HG1  VAL   7          HG12      VAL   7  -0.897   4.167  -6.602
   52   3HG1  VAL   7          HG13      VAL   7  -1.258   2.575  -5.934
   53   1HG2  VAL   7          HG21      VAL   7  -3.592   1.759  -5.860
   54   2HG2  VAL   7          HG22      VAL   7  -4.892   2.710  -6.578
   55   3HG2  VAL   7          HG23      VAL   7  -4.168   3.216  -5.051
   56    H    GLY   8           HN       GLY   8  -2.192   7.152  -6.431
   57   1HA   GLY   8          HA2       GLY   8  -1.436   7.862  -9.087
   58   2HA   GLY   8          HA1       GLY   8  -0.902   8.649  -7.610
   59    H    ASP   9           HN       ASP   9   0.227   7.180 -10.236
   60    HA   ASP   9           HA       ASP   9   2.245   5.474  -9.203
   61   1HB   ASP   9          HB2       ASP   9   2.142   7.037 -11.787
   62   2HB   ASP   9          HB1       ASP   9   3.362   5.832 -11.407
   63    H    LEU  10           HN       LEU  10   3.586   6.220  -7.718
   64    HA   LEU  10           HA       LEU  10   4.646   8.946  -7.984
   65   1HB   LEU  10          HB2       LEU  10   4.607   7.136  -5.568
   66   2HB   LEU  10          HB1       LEU  10   5.209   8.781  -5.599
   67    HG   LEU  10           HG       LEU  10   2.345   7.896  -5.937
   68   1HD1  LEU  10          HD11      LEU  10   2.019   9.170  -3.862
   69   2HD1  LEU  10          HD12      LEU  10   3.758   9.450  -3.776
   70   3HD1  LEU  10          HD13      LEU  10   3.120   7.811  -3.650
   71   1HD2  LEU  10          HD21      LEU  10   1.812  10.295  -6.008
   72   2HD2  LEU  10          HD22      LEU  10   2.788   9.796  -7.389
   73   3HD2  LEU  10          HD23      LEU  10   3.536  10.668  -6.051
   74    H    THR  11           HN       THR  11   6.862   9.335  -7.743
   75    HA   THR  11           HA       THR  11   8.591   6.968  -7.488
   76    HB   THR  11           HB       THR  11   9.219   9.291  -9.326
   77    HG1  THR  11           HG1      THR  11   7.476   7.357  -9.731
   78   1HG2  THR  11          HG21      THR  11  11.168   8.086  -8.464
   79   2HG2  THR  11          HG22      THR  11  10.949   7.766 -10.185
   80   3HG2  THR  11          HG23      THR  11  10.468   6.557  -8.994
   81    H    VAL  12           HN       VAL  12   9.718   7.204  -5.670
   82    HA   VAL  12           HA       VAL  12  10.332   9.944  -4.756
   83    HB   VAL  12           HB       VAL  12   9.820   7.525  -3.007
   84   1HG1  VAL  12          HG11      VAL  12   9.773   9.128  -1.170
   85   2HG1  VAL  12          HG12      VAL  12  10.141  10.437  -2.291
   86   3HG1  VAL  12          HG13      VAL  12  11.327   9.163  -2.005
   87   1HG2  VAL  12          HG21      VAL  12   7.704   8.598  -2.407
   88   2HG2  VAL  12          HG22      VAL  12   7.767   8.212  -4.127
   89   3HG2  VAL  12          HG23      VAL  12   8.014   9.872  -3.587
   90    H    ALA  13           HN       ALA  13  12.381  10.362  -4.071
   91    HA   ALA  13           HA       ALA  13  14.304   8.135  -4.207
   92   1HB   ALA  13          HB1       ALA  13  14.684   9.846  -5.912
   93   2HB   ALA  13          HB2       ALA  13  16.008   9.797  -4.748
   94   3HB   ALA  13          HB3       ALA  13  14.801  11.079  -4.655
   95    H    LYS  14           HN       LYS  14  14.533   7.449  -2.158
   96    HA   LYS  14           HA       LYS  14  15.831   9.126  -0.251
   97   1HB   LYS  14          HB2       LYS  14  13.116   9.417  -0.156
   98   2HB   LYS  14          HB1       LYS  14  13.346   8.065   0.953
   99   1HG   LYS  14          HG2       LYS  14  14.328   9.325   2.517
  100   2HG   LYS  14          HG1       LYS  14  15.165  10.336   1.337
  101   1HD   LYS  14          HD2       LYS  14  12.211  10.515   1.921
  102   2HD   LYS  14          HD1       LYS  14  13.433  11.534   2.683
  103   1HE   LYS  14          HE2       LYS  14  14.140  12.211   0.348
  104   2HE   LYS  14          HE1       LYS  14  12.683  11.404  -0.232
  105   1HZ   LYS  14          HZ1       LYS  14  11.335  12.892   1.056
  106   2HZ   LYS  14          HZ2       LYS  14  12.399  13.818   0.110
  107   3HZ   LYS  14          HZ3       LYS  14  12.706  13.603   1.763
  108    H    THR  15           HN       THR  15  15.929   7.813   1.936
  109    HA   THR  15           HA       THR  15  16.704   5.097   1.181
  110    HB   THR  15           HB       THR  15  17.829   5.126   3.441
  111    HG1  THR  15           HG1      THR  15  17.941   7.089   4.533
  112   1HG2  THR  15          HG21      THR  15  19.644   6.640   2.747
  113   2HG2  THR  15          HG22      THR  15  18.595   7.310   1.499
  114   3HG2  THR  15          HG23      THR  15  19.093   5.621   1.417
  115    H    ARG  16           HN       ARG  16  16.265   3.325   2.794
  116    HA   ARG  16           HA       ARG  16  13.509   3.542   3.743
  117   1HB   ARG  16          HB2       ARG  16  15.309   1.109   3.927
  118   2HB   ARG  16          HB1       ARG  16  13.565   1.160   4.197
  119   1HG   ARG  16          HG2       ARG  16  13.679   0.271   2.084
  120   2HG   ARG  16          HG1       ARG  16  13.493   1.992   1.727
  121   1HD   ARG  16          HD2       ARG  16  16.016   2.106   1.590
  122   2HD   ARG  16          HD1       ARG  16  16.016   0.349   1.640
  123    HE   ARG  16           HE       ARG  16  15.195   0.306  -0.514
  124   1HH1  ARG  16          HH11      ARG  16  15.243   3.558   0.724
  125   2HH1  ARG  16          HH12      ARG  16  15.012   4.318  -0.815
  126   1HH2  ARG  16          HH21      ARG  16  14.869   1.291  -2.586
  127   2HH2  ARG  16          HH22      ARG  16  14.776   3.013  -2.701
  128    H    GLY  17           HN       GLY  17  16.527   4.207   4.854
  129   1HA   GLY  17          HA2       GLY  17  16.119   3.559   7.631
  130   2HA   GLY  17          HA1       GLY  17  17.387   4.584   6.968
  131    H    GLN  18           HN       GLN  18  15.493   6.248   5.490
  132    HA   GLN  18           HA       GLN  18  14.794   8.197   7.380
  133   1HB   GLN  18          HB2       GLN  18  15.053   8.610   4.933
  134   2HB   GLN  18          HB1       GLN  18  13.548   7.743   4.663
  135   1HG   GLN  18          HG2       GLN  18  13.148  10.112   4.601
  136   2HG   GLN  18          HG1       GLN  18  12.363   9.414   6.014
  137   1HE2  GLN  18          HE21      GLN  18  14.917  11.462   4.869
  138   2HE2  GLN  18          HE22      GLN  18  15.315  12.170   6.396
  139    H    LEU  19           HN       LEU  19  13.000   5.590   5.865
  140    HA   LEU  19           HA       LEU  19  10.563   5.893   7.241
  141   1HB   LEU  19          HB2       LEU  19  11.930   3.410   6.191
  142   2HB   LEU  19          HB1       LEU  19  10.269   3.470   6.746
  143    HG   LEU  19           HG       LEU  19  11.261   5.137   4.439
  144   1HD1  LEU  19          HD11      LEU  19   9.975   2.408   4.383
  145   2HD1  LEU  19          HD12      LEU  19  11.632   2.787   3.909
  146   3HD1  LEU  19          HD13      LEU  19  10.280   3.431   2.978
  147   1HD2  LEU  19          HD21      LEU  19   8.879   5.224   3.892
  148   2HD2  LEU  19          HD22      LEU  19   9.183   5.866   5.507
  149   3HD2  LEU  19          HD23      LEU  19   8.512   4.246   5.314
  150    H    THR  20           HN       THR  20  10.362   5.911   9.407
  151    HA   THR  20           HA       THR  20  11.893   3.936  10.957
  152    HB   THR  20           HB       THR  20  11.338   6.758  11.897
  153    HG1  THR  20           HG1      THR  20  13.034   6.174  10.098
  154   1HG2  THR  20          HG21      THR  20  13.085   4.565  13.026
  155   2HG2  THR  20          HG22      THR  20  11.552   5.116  13.701
  156   3HG2  THR  20          HG23      THR  20  12.942   6.200  13.673
  157    H    ASP  21           HN       ASP  21  10.047   2.623  10.953
  158    HA   ASP  21           HA       ASP  21   8.145   1.710  11.747
  159   1HB   ASP  21          HB2       ASP  21   8.543   3.809  13.870
  160   2HB   ASP  21          HB1       ASP  21   7.200   2.670  13.907
  161    H    ALA  22           HN       ALA  22   7.452   5.102  12.553
  162    HA   ALA  22           HA       ALA  22   5.216   4.977  10.646
  163   1HB   ALA  22          HB1       ALA  22   3.890   6.356  12.138
  164   2HB   ALA  22          HB2       ALA  22   5.211   6.395  13.305
  165   3HB   ALA  22          HB3       ALA  22   4.394   4.873  12.951
  166    H    ALA  23           HN       ALA  23   6.673   5.878   9.121
  167    HA   ALA  23           HA       ALA  23   6.632   8.787   9.218
  168   1HB   ALA  23          HB1       ALA  23   8.942   9.004   8.480
  169   2HB   ALA  23          HB2       ALA  23   9.149   7.253   8.559
  170   3HB   ALA  23          HB3       ALA  23   8.873   8.175  10.036
  171    HA   PRO  24           HA       PRO  24   5.072   7.270   5.256
  172   1HB   PRO  24          HB2       PRO  24   3.607   9.468   4.665
  173   2HB   PRO  24          HB1       PRO  24   3.057   8.235   5.807
  174   1HG   PRO  24          HG2       PRO  24   4.340  10.883   6.354
  175   2HG   PRO  24          HG1       PRO  24   2.958  10.121   7.165
  176   1HD   PRO  24          HD2       PRO  24   5.472  10.085   8.197
  177   2HD   PRO  24          HD1       PRO  24   4.304   8.778   8.462
  178    H    ILE  25           HN       ILE  25   6.817   7.255   3.919
  179    HA   ILE  25           HA       ILE  25   7.890   9.804   2.962
  180    HB   ILE  25           HB       ILE  25   8.821   6.979   2.448
  181   1HG1  ILE  25          HG12      ILE  25   9.129   7.663   4.757
  182   2HG1  ILE  25          HG11      ILE  25  10.678   7.615   3.928
  183   1HG2  ILE  25          HG21      ILE  25  10.128   9.595   1.702
  184   2HG2  ILE  25          HG22      ILE  25   9.408   8.437   0.583
  185   3HG2  ILE  25          HG23      ILE  25  10.840   7.993   1.510
  186   1HD1  ILE  25          HD11      ILE  25  10.532   9.553   5.372
  187   2HD1  ILE  25          HD12      ILE  25   9.082  10.090   4.522
  188   3HD1  ILE  25          HD13      ILE  25  10.631  10.042   3.680
  189    H    GLY  26           HN       GLY  26   5.929   7.118   1.925
  190   1HA   GLY  26          HA2       GLY  26   5.646   8.483  -0.673
  191   2HA   GLY  26          HA1       GLY  26   5.481   6.747  -0.482
  192    HA   PRO  27           HA       PRO  27   1.365   8.566   1.468
  193   1HB   PRO  27          HB2       PRO  27   1.216  11.323   1.137
  194   2HB   PRO  27          HB1       PRO  27   1.537  10.492   2.665
  195   1HG   PRO  27          HG2       PRO  27   3.457  11.731   0.731
  196   2HG   PRO  27          HG1       PRO  27   3.486  11.742   2.506
  197   1HD   PRO  27          HD2       PRO  27   5.102  10.109   1.138
  198   2HD   PRO  27          HD1       PRO  27   4.308   9.564   2.629
  199    H    VAL  28           HN       VAL  28   0.145   7.866  -0.149
  200    HA   VAL  28           HA       VAL  28   0.447   8.922  -2.840
  201    HB   VAL  28           HB       VAL  28  -1.421   6.765  -1.829
  202   1HG1  VAL  28          HG11      VAL  28  -2.143   7.723  -3.945
  203   2HG1  VAL  28          HG12      VAL  28  -1.540   6.084  -4.183
  204   3HG1  VAL  28          HG13      VAL  28  -0.536   7.464  -4.627
  205   1HG2  VAL  28          HG21      VAL  28   1.315   6.522  -3.079
  206   2HG2  VAL  28          HG22      VAL  28   0.221   5.177  -2.761
  207   3HG2  VAL  28          HG23      VAL  28   0.877   6.114  -1.420
  208    H    THR  29           HN       THR  29  -0.952  10.276  -3.838
  209    HA   THR  29           HA       THR  29  -3.046  11.516  -2.342
  210    HB   THR  29           HB       THR  29  -3.528  12.377  -4.843
  211    HG1  THR  29           HG1      THR  29  -1.685  12.330  -6.069
  212   1HG2  THR  29          HG21      THR  29  -1.214  13.295  -3.133
  213   2HG2  THR  29          HG22      THR  29  -2.898  13.770  -2.918
  214   3HG2  THR  29          HG23      THR  29  -2.025  14.247  -4.374
  215    H    VAL  30           HN       VAL  30  -4.740  10.367  -1.858
  216    HA   VAL  30           HA       VAL  30  -5.675   8.281  -3.663
  217    HB   VAL  30           HB       VAL  30  -6.705   8.857  -0.889
  218   1HG1  VAL  30          HG11      VAL  30  -8.061   7.337  -2.208
  219   2HG1  VAL  30          HG12      VAL  30  -7.234   6.439  -0.936
  220   3HG1  VAL  30          HG13      VAL  30  -6.648   6.357  -2.597
  221   1HG2  VAL  30          HG21      VAL  30  -5.090   7.186  -0.073
  222   2HG2  VAL  30          HG22      VAL  30  -4.295   8.619  -0.725
  223   3HG2  VAL  30          HG23      VAL  30  -4.349   7.132  -1.673
  224    H    GLN  31           HN       GLN  31  -7.622   8.174  -4.494
  225    HA   GLN  31           HA       GLN  31  -9.721  10.036  -3.755
  226   1HB   GLN  31          HB2       GLN  31  -8.582  11.192  -5.609
  227   2HB   GLN  31          HB1       GLN  31  -8.752   9.758  -6.614
  228   1HG   GLN  31          HG2       GLN  31 -11.257  10.009  -6.286
  229   2HG   GLN  31          HG1       GLN  31 -10.902  11.605  -5.628
  230   1HE2  GLN  31          HE21      GLN  31 -10.111  13.213  -6.991
  231   2HE2  GLN  31          HE22      GLN  31 -10.215  13.081  -8.715
  232    H    ALA  32           HN       ALA  32 -11.412   8.781  -3.385
  233    HA   ALA  32           HA       ALA  32 -11.707   6.312  -4.957
  234   1HB   ALA  32          HB1       ALA  32 -11.405   5.924  -2.556
  235   2HB   ALA  32          HB2       ALA  32 -13.009   5.424  -3.091
  236   3HB   ALA  32          HB3       ALA  32 -12.804   6.942  -2.215
  237    H    LEU  33           HN       LEU  33 -13.039   6.724  -6.591
  238    HA   LEU  33           HA       LEU  33 -15.171   8.649  -6.382
  239   1HB   LEU  33          HB2       LEU  33 -13.930   8.298  -8.484
  240   2HB   LEU  33          HB1       LEU  33 -14.540   6.655  -8.561
  241    HG   LEU  33           HG       LEU  33 -16.850   7.568  -8.729
  242   1HD1  LEU  33          HD11      LEU  33 -15.417  10.211  -8.966
  243   2HD1  LEU  33          HD12      LEU  33 -16.496   9.718  -7.661
  244   3HD1  LEU  33          HD13      LEU  33 -17.130   9.940  -9.292
  245   1HD2  LEU  33          HD21      LEU  33 -15.645   6.893 -10.719
  246   2HD2  LEU  33          HD22      LEU  33 -14.887   8.481 -10.827
  247   3HD2  LEU  33          HD23      LEU  33 -16.629   8.317 -11.057
  248    H    GLY  34           HN       GLY  34 -16.970   8.181  -5.324
  249   1HA   GLY  34          HA2       GLY  34 -18.985   7.039  -4.975
  250   2HA   GLY  34          HA1       GLY  34 -18.318   5.652  -5.823
  251    H    CYS  35           HN       CYS  35 -18.109   3.963  -4.572
  252    HA   CYS  35           HA       CYS  35 -17.587   2.603  -2.827
  253   1HB   CYS  35          HB2       CYS  35 -16.055   4.996  -1.789
  254   2HB   CYS  35          HB1       CYS  35 -15.893   3.343  -1.211
  255    H    ASN  36           HN       ASN  36 -19.788   4.794  -2.697
  256    HA   ASN  36           HA       ASN  36 -20.037   5.643  -0.031
  257   1HB   ASN  36          HB2       ASN  36 -22.063   5.438  -2.251
  258   2HB   ASN  36          HB1       ASN  36 -22.431   6.133  -0.673
  259   1HD2  ASN  36          HD21      ASN  36 -21.435   8.059  -0.053
  260   2HD2  ASN  36          HD22      ASN  36 -20.681   9.108  -1.210
  261    H    ALA  37           HN       ALA  37 -20.607   2.599  -1.365
  262    HA   ALA  37           HA       ALA  37 -21.571   1.712   1.260
  263   1HB   ALA  37          HB1       ALA  37 -23.241   0.220   0.243
  264   2HB   ALA  37          HB2       ALA  37 -22.893   0.902  -1.347
  265   3HB   ALA  37          HB3       ALA  37 -23.609   1.912  -0.089
  266    H    ARG  38           HN       ARG  38 -19.110   1.446   0.853
  267    HA   ARG  38           HA       ARG  38 -18.602  -1.335   0.623
  268   1HB   ARG  38          HB2       ARG  38 -18.692  -0.303  -1.824
  269   2HB   ARG  38          HB1       ARG  38 -17.074   0.242  -1.406
  270   1HG   ARG  38          HG2       ARG  38 -16.861  -1.807  -2.573
  271   2HG   ARG  38          HG1       ARG  38 -16.498  -2.130  -0.876
  272   1HD   ARG  38          HD2       ARG  38 -17.920  -3.871  -1.878
  273   2HD   ARG  38          HD1       ARG  38 -18.723  -3.036  -0.547
  274    HE   ARG  38           HE       ARG  38 -19.897  -1.721  -2.303
  275   1HH1  ARG  38          HH11      ARG  38 -18.650  -4.910  -3.026
  276   2HH1  ARG  38          HH12      ARG  38 -19.740  -5.176  -4.346
  277   1HH2  ARG  38          HH21      ARG  38 -21.331  -2.065  -4.034
  278   2HH2  ARG  38          HH22      ARG  38 -21.280  -3.571  -4.906
  279    H    GLN  39           HN       GLN  39 -16.364  -1.822   1.176
  280    HA   GLN  39           HA       GLN  39 -15.036   0.367   2.578
  281   1HB   GLN  39          HB2       GLN  39 -14.394  -2.594   2.499
  282   2HB   GLN  39          HB1       GLN  39 -13.528  -1.400   3.448
  283   1HG   GLN  39          HG2       GLN  39 -14.954  -2.497   4.942
  284   2HG   GLN  39          HG1       GLN  39 -15.699  -0.933   4.630
  285   1HE2  GLN  39          HE21      GLN  39 -15.810  -3.587   2.351
  286   2HE2  GLN  39          HE22      GLN  39 -17.511  -3.887   2.501
  287    H    VAL  40           HN       VAL  40 -12.970   1.073   2.028
  288    HA   VAL  40           HA       VAL  40 -12.081   0.379  -0.677
  289    HB   VAL  40           HB       VAL  40 -11.350   2.703   1.122
  290   1HG1  VAL  40          HG11      VAL  40  -9.415   2.064  -0.196
  291   2HG1  VAL  40          HG12      VAL  40 -10.091   3.575  -0.806
  292   3HG1  VAL  40          HG13      VAL  40 -10.388   2.065  -1.666
  293   1HG2  VAL  40          HG21      VAL  40 -12.886   2.604  -1.473
  294   2HG2  VAL  40          HG22      VAL  40 -12.483   4.062  -0.565
  295   3HG2  VAL  40          HG23      VAL  40 -13.575   2.864   0.130
  296    H    ALA  41           HN       ALA  41 -10.355  -0.909  -0.921
  297    HA   ALA  41           HA       ALA  41  -8.603  -1.321   1.396
  298   1HB   ALA  41          HB1       ALA  41 -10.161  -3.214   1.018
  299   2HB   ALA  41          HB2       ALA  41  -8.463  -3.660   0.864
  300   3HB   ALA  41          HB3       ALA  41  -9.450  -3.431  -0.581
  301    H    LEU  42           HN       LEU  42  -6.461  -1.414   1.025
  302    HA   LEU  42           HA       LEU  42  -5.550  -0.941  -1.724
  303   1HB   LEU  42          HB2       LEU  42  -3.946  -0.739   0.821
  304   2HB   LEU  42          HB1       LEU  42  -3.533  -0.085  -0.753
  305    HG   LEU  42           HG       LEU  42  -5.811   0.866   0.979
  306   1HD1  LEU  42          HD11      LEU  42  -4.437   2.837   1.354
  307   2HD1  LEU  42          HD12      LEU  42  -3.130   2.115   0.412
  308   3HD1  LEU  42          HD13      LEU  42  -3.630   1.382   1.936
  309   1HD2  LEU  42          HD21      LEU  42  -4.683   1.967  -1.597
  310   2HD2  LEU  42          HD22      LEU  42  -5.932   2.728  -0.611
  311   3HD2  LEU  42          HD23      LEU  42  -6.252   1.184  -1.399
  312    H    LYS  43           HN       LYS  43  -4.563  -2.533  -2.802
  313    HA   LYS  43           HA       LYS  43  -3.540  -4.815  -1.244
  314   1HB   LYS  43          HB2       LYS  43  -4.576  -4.957  -4.079
  315   2HB   LYS  43          HB1       LYS  43  -4.117  -6.301  -3.045
  316   1HG   LYS  43          HG2       LYS  43  -6.394  -6.402  -2.924
  317   2HG   LYS  43          HG1       LYS  43  -6.030  -5.395  -1.520
  318   1HD   LYS  43          HD2       LYS  43  -6.441  -3.387  -2.909
  319   2HD   LYS  43          HD1       LYS  43  -6.899  -4.443  -4.247
  320   1HE   LYS  43          HE2       LYS  43  -8.703  -5.372  -2.869
  321   2HE   LYS  43          HE1       LYS  43  -8.257  -4.266  -1.566
  322   1HZ   LYS  43          HZ1       LYS  43 -10.131  -3.473  -2.934
  323   2HZ   LYS  43          HZ2       LYS  43  -9.099  -3.401  -4.275
  324   3HZ   LYS  43          HZ3       LYS  43  -8.811  -2.408  -2.932
  325    H    ALA  44           HN       ALA  44  -1.633  -5.772  -1.989
  326    HA   ALA  44           HA       ALA  44  -0.045  -4.076  -3.752
  327   1HB   ALA  44          HB1       ALA  44   1.029  -4.660  -1.698
  328   2HB   ALA  44          HB2       ALA  44   1.843  -5.514  -3.010
  329   3HB   ALA  44          HB3       ALA  44   0.713  -6.374  -1.963
  330    H    ASP  45           HN       ASP  45   1.083  -4.980  -5.524
  331    HA   ASP  45           HA       ASP  45  -0.424  -7.026  -6.924
  332   1HB   ASP  45          HB2       ASP  45   0.380  -5.016  -8.113
  333   2HB   ASP  45          HB1       ASP  45   2.041  -5.446  -7.723
  334    H    THR  46           HN       THR  46   0.856  -8.875  -7.985
  335    HA   THR  46           HA       THR  46   2.104 -10.436  -6.034
  336    HB   THR  46           HB       THR  46   1.102 -11.390  -8.077
  337    HG1  THR  46           HG1      THR  46   2.800 -12.510  -6.836
  338   1HG2  THR  46          HG21      THR  46   3.562 -10.333  -9.473
  339   2HG2  THR  46          HG22      THR  46   1.913  -9.750  -9.704
  340   3HG2  THR  46          HG23      THR  46   2.344 -11.392 -10.182
  341    H    ASP  47           HN       ASP  47   3.338  -7.930  -7.984
  342    HA   ASP  47           HA       ASP  47   6.077  -8.365  -8.016
  343   1HB   ASP  47          HB2       ASP  47   5.214  -6.554  -9.243
  344   2HB   ASP  47          HB1       ASP  47   4.340  -5.922  -7.859
  345    H    ASN  48           HN       ASN  48   4.009  -7.161  -5.398
  346    HA   ASN  48           HA       ASN  48   6.280  -7.428  -3.564
  347   1HB   ASN  48          HB2       ASN  48   5.787  -5.278  -2.499
  348   2HB   ASN  48          HB1       ASN  48   6.210  -5.054  -4.193
  349   1HD2  ASN  48          HD21      ASN  48   4.680  -3.390  -2.314
  350   2HD2  ASN  48          HD22      ASN  48   3.161  -3.102  -3.089
  351    H    PHE  49           HN       PHE  49   3.678  -8.856  -4.131
  352    HA   PHE  49           HA       PHE  49   2.590  -8.787  -1.384
  353   1HB   PHE  49          HB2       PHE  49   1.027  -7.900  -3.131
  354   2HB   PHE  49          HB1       PHE  49   1.103  -9.453  -3.936
  355    HD1  PHE  49           HD1      PHE  49  -0.214  -7.607  -1.068
  356    HD2  PHE  49           HD2      PHE  49  -0.122 -11.369  -3.071
  357    HE1  PHE  49           HE1      PHE  49  -2.080  -8.402   0.327
  358    HE2  PHE  49           HE2      PHE  49  -1.979 -12.151  -1.688
  359    HZ   PHE  49           HZ       PHE  49  -3.162 -10.586  -0.212
  360    H    GLU  50           HN       GLU  50   3.581 -10.501  -0.475
  361    HA   GLU  50           HA       GLU  50   3.725 -13.013  -1.993
  362   1HB   GLU  50          HB2       GLU  50   5.244 -12.011   0.412
  363   2HB   GLU  50          HB1       GLU  50   5.307 -13.688  -0.113
  364   1HG   GLU  50          HG2       GLU  50   5.987 -11.406  -1.936
  365   2HG   GLU  50          HG1       GLU  50   7.177 -12.169  -0.884
  366    H    GLN  51           HN       GLN  51   1.976 -14.185  -1.702
  367    HA   GLN  51           HA       GLN  51   0.338 -15.426  -0.758
  368   1HB   GLN  51          HB2       GLN  51   1.987 -15.029   1.735
  369   2HB   GLN  51          HB1       GLN  51   0.539 -16.028   1.685
  370   1HG   GLN  51          HG2       GLN  51   3.058 -16.442   0.093
  371   2HG   GLN  51          HG1       GLN  51   2.511 -17.398   1.470
  372   1HE2  GLN  51          HE21      GLN  51   0.732 -18.776   1.219
  373   2HE2  GLN  51          HE22      GLN  51   0.186 -19.282  -0.345
  374    H    GLY  52           HN       GLY  52   1.118 -12.815   1.515
  375   1HA   GLY  52          HA2       GLY  52  -1.326 -11.450   1.147
  376   2HA   GLY  52          HA1       GLY  52  -1.431 -12.468   2.583
  377    H    LYS  53           HN       LYS  53   1.474 -10.944   1.388
  378    HA   LYS  53           HA       LYS  53   1.394  -8.974   3.567
  379   1HB   LYS  53          HB2       LYS  53   3.857 -10.549   2.804
  380   2HB   LYS  53          HB1       LYS  53   3.721  -9.371   4.096
  381   1HG   LYS  53          HG2       LYS  53   2.299 -12.025   4.031
  382   2HG   LYS  53          HG1       LYS  53   3.788 -11.686   4.915
  383   1HD   LYS  53          HD2       LYS  53   2.563  -9.908   6.159
  384   2HD   LYS  53          HD1       LYS  53   1.080 -10.436   5.362
  385   1HE   LYS  53          HE2       LYS  53   1.167 -11.457   7.524
  386   2HE   LYS  53          HE1       LYS  53   1.457 -12.708   6.314
  387   1HZ   LYS  53          HZ1       LYS  53   3.534 -11.332   7.937
  388   2HZ   LYS  53          HZ2       LYS  53   3.843 -12.500   6.748
  389   3HZ   LYS  53          HZ3       LYS  53   2.995 -12.928   8.149
  390    H    PHE  54           HN       PHE  54   2.038  -6.966   2.880
  391    HA   PHE  54           HA       PHE  54   3.321  -6.879   0.256
  392   1HB   PHE  54          HB2       PHE  54   2.491  -4.450   0.223
  393   2HB   PHE  54          HB1       PHE  54   1.356  -5.754  -0.062
  394    HD1  PHE  54           HD1      PHE  54  -0.670  -4.870   0.515
  395    HD2  PHE  54           HD2      PHE  54   2.597  -4.449   3.208
  396    HE1  PHE  54           HE1      PHE  54  -2.196  -3.946   2.207
  397    HE2  PHE  54           HE2      PHE  54   1.075  -3.528   4.910
  398    HZ   PHE  54           HZ       PHE  54  -1.325  -3.274   4.409
  399    H    PHE  55           HN       PHE  55   5.045  -5.631  -0.157
  400    HA   PHE  55           HA       PHE  55   6.382  -4.209   1.991
  401   1HB   PHE  55          HB2       PHE  55   8.450  -5.583   1.752
  402   2HB   PHE  55          HB1       PHE  55   7.112  -6.498   2.430
  403    HD1  PHE  55           HD1      PHE  55   9.399  -6.127  -0.341
  404    HD2  PHE  55           HD2      PHE  55   5.957  -8.193   1.066
  405    HE1  PHE  55           HE1      PHE  55   9.692  -7.824  -2.105
  406    HE2  PHE  55           HE2      PHE  55   6.245  -9.890  -0.689
  407    HZ   PHE  55           HZ       PHE  55   8.118  -9.706  -2.279
  408    H    LEU  56           HN       LEU  56   8.719  -3.615   1.041
  409    HA   LEU  56           HA       LEU  56   8.335  -2.674  -1.716
  410   1HB   LEU  56          HB2       LEU  56  10.698  -2.019   0.026
  411   2HB   LEU  56          HB1       LEU  56  10.060  -1.119  -1.334
  412    HG   LEU  56           HG       LEU  56   8.773  -1.346   1.384
  413   1HD1  LEU  56          HD11      LEU  56  10.792   0.024   1.382
  414   2HD1  LEU  56          HD12      LEU  56   9.346   1.009   1.603
  415   3HD1  LEU  56          HD13      LEU  56  10.155   0.967   0.036
  416   1HD2  LEU  56          HD21      LEU  56   7.225   0.359   0.548
  417   2HD2  LEU  56          HD22      LEU  56   7.104  -1.145  -0.363
  418   3HD2  LEU  56          HD23      LEU  56   7.962   0.233  -1.049
  419    H    ILE  57           HN       ILE  57   9.319  -3.780  -3.360
  420    HA   ILE  57           HA       ILE  57  11.365  -5.727  -2.540
  421    HB   ILE  57           HB       ILE  57   9.382  -6.753  -3.575
  422   1HG1  ILE  57          HG12      ILE  57  10.556  -8.084  -5.303
  423   2HG1  ILE  57          HG11      ILE  57  11.865  -6.908  -5.303
  424   1HG2  ILE  57          HG21      ILE  57   8.924  -6.434  -5.967
  425   2HG2  ILE  57          HG22      ILE  57  10.113  -5.129  -6.001
  426   3HG2  ILE  57          HG23      ILE  57   8.656  -4.973  -5.018
  427   1HD1  ILE  57          HD11      ILE  57  11.043  -8.657  -2.995
  428   2HD1  ILE  57          HD12      ILE  57  12.329  -7.450  -2.958
  429   3HD1  ILE  57          HD13      ILE  57  12.469  -8.856  -4.013
  430    H    SER  58           HN       SER  58  13.380  -5.335  -3.065
  431    HA   SER  58           HA       SER  58  14.193  -3.355  -4.930
  432   1HB   SER  58          HB2       SER  58  15.618  -4.126  -3.035
  433   2HB   SER  58          HB1       SER  58  15.764  -5.702  -3.808
  434    HG   SER  58           HG       SER  58  17.354  -3.717  -4.142
  435    H    ASP  59           HN       ASP  59  14.341  -3.520  -7.088
  436    HA   ASP  59           HA       ASP  59  13.095  -5.612  -8.444
  437   1HB   ASP  59          HB2       ASP  59  13.268  -3.345  -9.336
  438   2HB   ASP  59          HB1       ASP  59  15.006  -3.538  -9.525
  439    H    ASN  60           HN       ASN  60  16.421  -5.265  -7.517
  440    HA   ASN  60           HA       ASN  60  17.358  -7.304  -9.346
  441   1HB   ASN  60          HB2       ASN  60  18.752  -5.858  -7.087
  442   2HB   ASN  60          HB1       ASN  60  19.533  -7.023  -8.151
  443   1HD2  ASN  60          HD21      ASN  60  18.027  -6.134 -10.500
  444   2HD2  ASN  60          HD22      ASN  60  18.705  -4.606 -10.956
  445    H    ASN  61           HN       ASN  61  15.604  -7.414  -6.602
  446    HA   ASN  61           HA       ASN  61  15.096  -8.965  -5.034
  447   1HB   ASN  61          HB2       ASN  61  14.798 -10.391  -7.042
  448   2HB   ASN  61          HB1       ASN  61  16.478 -10.905  -6.903
  449   1HD2  ASN  61          HD21      ASN  61  13.276 -11.165  -5.596
  450   2HD2  ASN  61          HD22      ASN  61  13.594 -12.507  -4.544
  451    H    ARG  62           HN       ARG  62  16.383  -8.141  -3.392
  452    HA   ARG  62           HA       ARG  62  18.443  -9.949  -2.522
  453   1HB   ARG  62          HB2       ARG  62  20.190  -8.265  -2.218
  454   2HB   ARG  62          HB1       ARG  62  19.773  -8.449  -3.914
  455   1HG   ARG  62          HG2       ARG  62  18.531  -6.395  -3.893
  456   2HG   ARG  62          HG1       ARG  62  18.746  -6.238  -2.147
  457   1HD   ARG  62          HD2       ARG  62  20.906  -6.149  -4.250
  458   2HD   ARG  62          HD1       ARG  62  20.314  -4.794  -3.286
  459    HE   ARG  62           HE       ARG  62  21.133  -6.312  -1.331
  460   1HH1  ARG  62          HH11      ARG  62  22.704  -5.777  -4.414
  461   2HH1  ARG  62          HH12      ARG  62  24.286  -6.197  -3.825
  462   1HH2  ARG  62          HH21      ARG  62  23.187  -6.834  -0.549
  463   2HH2  ARG  62          HH22      ARG  62  24.562  -6.793  -1.609
  464    H    ASP  63           HN       ASP  63  16.622  -6.987  -1.967
  465    HA   ASP  63           HA       ASP  63  16.407  -7.722   0.853
  466   1HB   ASP  63          HB2       ASP  63  18.187  -6.024   0.724
  467   2HB   ASP  63          HB1       ASP  63  17.090  -4.934  -0.119
  468    H    LYS  64           HN       LYS  64  14.482  -7.179   1.807
  469    HA   LYS  64           HA       LYS  64  12.613  -5.501   0.367
  470   1HB   LYS  64          HB2       LYS  64  10.785  -7.168   0.511
  471   2HB   LYS  64          HB1       LYS  64  12.072  -7.648  -0.581
  472   1HG   LYS  64          HG2       LYS  64  11.601  -9.613   0.510
  473   2HG   LYS  64          HG1       LYS  64  12.952  -8.992   1.454
  474   1HD   LYS  64          HD2       LYS  64  11.420  -8.137   3.136
  475   2HD   LYS  64          HD1       LYS  64  10.036  -8.669   2.174
  476   1HE   LYS  64          HE2       LYS  64  10.555 -10.224   4.010
  477   2HE   LYS  64          HE1       LYS  64  10.720 -10.982   2.429
  478   1HZ   LYS  64          HZ1       LYS  64  13.080 -10.804   2.557
  479   2HZ   LYS  64          HZ2       LYS  64  12.542 -11.508   4.004
  480   3HZ   LYS  64          HZ3       LYS  64  13.002  -9.878   3.979
  481    H    LEU  65           HN       LEU  65  11.046  -4.583   1.672
  482    HA   LEU  65           HA       LEU  65  11.129  -5.260   4.515
  483   1HB   LEU  65          HB2       LEU  65  11.283  -2.920   5.165
  484   2HB   LEU  65          HB1       LEU  65  12.683  -3.423   4.239
  485    HG   LEU  65           HG       LEU  65  10.448  -2.059   2.811
  486   1HD1  LEU  65          HD11      LEU  65  10.865  -0.683   4.798
  487   2HD1  LEU  65          HD12      LEU  65  11.401   0.112   3.319
  488   3HD1  LEU  65          HD13      LEU  65  12.580  -0.637   4.395
  489   1HD2  LEU  65          HD21      LEU  65  12.300  -1.236   1.445
  490   2HD2  LEU  65          HD22      LEU  65  12.317  -2.997   1.550
  491   3HD2  LEU  65          HD23      LEU  65  13.449  -2.045   2.512
  492    H    TYR  66           HN       TYR  66   9.199  -5.205   5.491
  493    HA   TYR  66           HA       TYR  66   6.903  -4.891   3.796
  494   1HB   TYR  66          HB2       TYR  66   7.078  -5.512   6.755
  495   2HB   TYR  66          HB1       TYR  66   5.616  -5.612   5.778
  496    HD1  TYR  66           HD1      TYR  66   8.909  -7.120   6.413
  497    HD2  TYR  66           HD2      TYR  66   5.236  -7.464   4.300
  498    HE1  TYR  66           HE1      TYR  66   9.484  -9.429   5.802
  499    HE2  TYR  66           HE2      TYR  66   5.798  -9.776   3.684
  500    HH   TYR  66           HH       TYR  66   8.467 -11.459   5.088
  501    H    VAL  67           HN       VAL  67   5.620  -3.200   3.607
  502    HA   VAL  67           HA       VAL  67   5.997  -0.966   5.486
  503    HB   VAL  67           HB       VAL  67   5.338   0.540   3.609
  504   1HG1  VAL  67          HG11      VAL  67   7.551   0.522   2.561
  505   2HG1  VAL  67          HG12      VAL  67   7.851  -1.084   3.227
  506   3HG1  VAL  67          HG13      VAL  67   7.658   0.298   4.306
  507   1HG2  VAL  67          HG21      VAL  67   5.562  -0.295   1.318
  508   2HG2  VAL  67          HG22      VAL  67   4.257  -1.113   2.178
  509   3HG2  VAL  67          HG23      VAL  67   5.801  -1.929   1.937
  510    H    ASN  68           HN       ASN  68   4.268  -0.056   6.352
  511    HA   ASN  68           HA       ASN  68   1.697  -1.321   5.761
  512   1HB   ASN  68          HB2       ASN  68   2.663   0.376   8.071
  513   2HB   ASN  68          HB1       ASN  68   0.974  -0.062   7.858
  514   1HD2  ASN  68          HD21      ASN  68   3.556  -2.253   7.020
  515   2HD2  ASN  68          HD22      ASN  68   3.295  -3.360   8.324
  516    H    ILE  69           HN       ILE  69   0.632  -0.337   4.194
  517    HA   ILE  69           HA       ILE  69   0.802   2.507   3.769
  518    HB   ILE  69           HB       ILE  69  -1.445   1.514   2.386
  519   1HG1  ILE  69          HG12      ILE  69   0.917  -0.355   2.110
  520   2HG1  ILE  69          HG11      ILE  69  -0.583  -0.761   2.944
  521   1HG2  ILE  69          HG21      ILE  69  -0.022   1.889   0.408
  522   2HG2  ILE  69          HG22      ILE  69   1.377   2.046   1.469
  523   3HG2  ILE  69          HG23      ILE  69   0.060   3.214   1.569
  524   1HD1  ILE  69          HD11      ILE  69  -0.324  -0.069   0.024
  525   2HD1  ILE  69          HD12      ILE  69  -1.812  -0.514   0.861
  526   3HD1  ILE  69          HD13      ILE  69  -0.510  -1.691   0.694
  527    H    ARG  70           HN       ARG  70  -0.107   3.749   5.282
  528    HA   ARG  70           HA       ARG  70  -2.733   2.911   6.341
  529   1HB   ARG  70          HB2       ARG  70  -0.590   4.327   7.932
  530   2HB   ARG  70          HB1       ARG  70  -2.160   3.802   8.514
  531   1HG   ARG  70          HG2       ARG  70  -1.491   1.469   8.176
  532   2HG   ARG  70          HG1       ARG  70   0.100   2.018   7.634
  533   1HD   ARG  70          HD2       ARG  70   0.413   3.135   9.820
  534   2HD   ARG  70          HD1       ARG  70  -1.133   2.475  10.351
  535    HE   ARG  70           HE       ARG  70   0.719   0.483   9.431
  536   1HH1  ARG  70          HH11      ARG  70  -0.337   2.369  12.190
  537   2HH1  ARG  70          HH12      ARG  70   0.313   1.249  13.351
  538   1HH2  ARG  70          HH21      ARG  70   1.570  -0.982  10.954
  539   2HH2  ARG  70          HH22      ARG  70   1.401  -0.653  12.655
  540    HA   PRO  71           HA       PRO  71  -4.318   6.830   5.075
  541   1HB   PRO  71          HB2       PRO  71  -5.820   7.150   7.451
  542   2HB   PRO  71          HB1       PRO  71  -6.393   6.548   5.900
  543   1HG   PRO  71          HG2       PRO  71  -5.612   5.058   8.324
  544   2HG   PRO  71          HG1       PRO  71  -6.730   4.607   7.022
  545   1HD   PRO  71          HD2       PRO  71  -4.287   3.489   7.291
  546   2HD   PRO  71          HD1       PRO  71  -5.056   3.740   5.711
  547    H    MET  72           HN       MET  72  -3.532   8.842   5.298
  548    HA   MET  72           HA       MET  72  -1.476   9.354   7.155
  549   1HB   MET  72          HB2       MET  72  -1.610  10.435   4.943
  550   2HB   MET  72          HB1       MET  72  -3.033  11.325   5.470
  551   1HG   MET  72          HG2       MET  72  -1.726  12.506   7.123
  552   2HG   MET  72          HG1       MET  72  -0.301  11.553   6.712
  553   1HE   MET  72          HE1       MET  72   0.718  15.031   5.321
  554   2HE   MET  72          HE2       MET  72   1.224  13.635   6.274
  555   3HE   MET  72          HE3       MET  72  -0.114  14.643   6.827
  556    H    ASP  73           HN       ASP  73  -4.778  10.678   6.936
  557    HA   ASP  73           HA       ASP  73  -5.309  10.357   9.674
  558   1HB   ASP  73          HB2       ASP  73  -3.725  12.197  10.004
  559   2HB   ASP  73          HB1       ASP  73  -4.634  13.200   8.877
  560    H    ASN  74           HN       ASN  74  -7.365   9.771   9.342
  561    HA   ASN  74           HA       ASN  74  -9.288  11.684   8.393
  562   1HB   ASN  74          HB2       ASN  74  -8.194   9.760   6.520
  563   2HB   ASN  74          HB1       ASN  74  -9.927   9.546   6.715
  564   1HD2  ASN  74          HD21      ASN  74  -7.409  11.555   5.488
  565   2HD2  ASN  74          HD22      ASN  74  -8.433  12.696   4.678
  566    H    SER  75           HN       SER  75  -8.945   8.130   8.608
  567    HA   SER  75           HA       SER  75 -10.931   7.999  10.694
  568   1HB   SER  75          HB2       SER  75 -12.238   8.153   8.509
  569   2HB   SER  75          HB1       SER  75 -11.540   6.591   8.082
  570    HG   SER  75           HG       SER  75 -13.114   5.755   9.199
  571    H    ALA  76           HN       ALA  76 -11.264   5.712  11.393
  572    HA   ALA  76           HA       ALA  76  -8.712   4.411  11.538
  573   1HB   ALA  76          HB1       ALA  76 -10.171   4.535  13.489
  574   2HB   ALA  76          HB2       ALA  76  -9.814   2.861  13.068
  575   3HB   ALA  76          HB3       ALA  76 -11.381   3.559  12.655
  576    H    TRP  77           HN       TRP  77  -7.980   2.803  10.362
  577    HA   TRP  77           HA       TRP  77  -9.837   1.354   8.597
  578   1HB   TRP  77          HB2       TRP  77  -6.935   2.106   8.253
  579   2HB   TRP  77          HB1       TRP  77  -7.688   0.852   7.279
  580    HD1  TRP  77           HD1      TRP  77  -9.231   4.315   8.161
  581    HE1  TRP  77           HE1      TRP  77  -9.719   5.544   5.938
  582    HE3  TRP  77           HE3      TRP  77  -7.202   0.943   4.902
  583    HZ2  TRP  77           HZ2      TRP  77  -9.282   5.129   3.191
  584    HZ3  TRP  77           HZ3      TRP  77  -7.278   1.439   2.494
  585    HH2  TRP  77           HH2      TRP  77  -8.291   3.492   1.670
  586    H    THR  78           HN       THR  78  -9.587  -0.892   8.374
  587    HA   THR  78           HA       THR  78  -8.404  -2.252  10.639
  588    HB   THR  78           HB       THR  78  -9.721  -3.455   8.191
  589    HG1  THR  78           HG1      THR  78 -10.886  -2.741  10.709
  590   1HG2  THR  78          HG21      THR  78  -8.402  -5.030   9.526
  591   2HG2  THR  78          HG22      THR  78 -10.126  -5.374   9.659
  592   3HG2  THR  78          HG23      THR  78  -9.288  -4.551  10.974
  593    H    THR  79           HN       THR  79  -6.429  -3.182  10.643
  594    HA   THR  79           HA       THR  79  -4.888  -2.817   8.177
  595    HB   THR  79           HB       THR  79  -4.004  -1.558  10.024
  596    HG1  THR  79           HG1      THR  79  -2.593  -3.090   8.580
  597   1HG2  THR  79          HG21      THR  79  -4.902  -2.834  11.892
  598   2HG2  THR  79          HG22      THR  79  -3.157  -2.637  12.067
  599   3HG2  THR  79          HG23      THR  79  -3.821  -4.177  11.518
  600    H    ASP  80           HN       ASP  80  -4.461  -4.494   6.995
  601    HA   ASP  80           HA       ASP  80  -3.330  -6.840   8.349
  602   1HB   ASP  80          HB2       ASP  80  -5.662  -7.308   7.370
  603   2HB   ASP  80          HB1       ASP  80  -4.934  -7.055   5.787
  604    H    ASN  81           HN       ASN  81  -1.695  -7.932   6.915
  605    HA   ASN  81           HA       ASN  81  -0.245  -5.909   5.440
  606   1HB   ASN  81          HB2       ASN  81   0.392  -8.744   6.195
  607   2HB   ASN  81          HB1       ASN  81   1.393  -7.858   5.055
  608   1HD2  ASN  81          HD21      ASN  81   2.704  -6.196   5.784
  609   2HD2  ASN  81          HD22      ASN  81   2.989  -5.906   7.466
  610    H    GLY  82           HN       GLY  82  -2.673  -8.026   4.670
  611   1HA   GLY  82          HA2       GLY  82  -1.741  -8.322   1.918
  612   2HA   GLY  82          HA1       GLY  82  -3.121  -9.152   2.624
  613    H    VAL  83           HN       VAL  83  -4.372  -6.934   3.800
  614    HA   VAL  83           HA       VAL  83  -4.964  -5.164   1.545
  615    HB   VAL  83           HB       VAL  83  -7.396  -5.356   1.989
  616   1HG1  VAL  83          HG11      VAL  83  -6.438  -6.592   0.137
  617   2HG1  VAL  83          HG12      VAL  83  -7.740  -7.519   0.883
  618   3HG1  VAL  83          HG13      VAL  83  -6.058  -7.942   1.205
  619   1HG2  VAL  83          HG21      VAL  83  -8.265  -7.245   3.272
  620   2HG2  VAL  83          HG22      VAL  83  -7.282  -6.186   4.285
  621   3HG2  VAL  83          HG23      VAL  83  -6.620  -7.715   3.705
  622    H    PHE  84           HN       PHE  84  -6.024  -3.187   2.190
  623    HA   PHE  84           HA       PHE  84  -6.006  -2.664   5.073
  624   1HB   PHE  84          HB2       PHE  84  -3.902  -1.854   3.513
  625   2HB   PHE  84          HB1       PHE  84  -4.958  -0.451   3.419
  626    HD1  PHE  84           HD1      PHE  84  -5.911   0.369   5.731
  627    HD2  PHE  84           HD2      PHE  84  -2.418  -2.000   5.230
  628    HE1  PHE  84           HE1      PHE  84  -5.090   1.128   7.920
  629    HE2  PHE  84           HE2      PHE  84  -1.586  -1.250   7.416
  630    HZ   PHE  84           HZ       PHE  84  -2.925   0.316   8.768
  631    H    TYR  85           HN       TYR  85  -8.037  -2.045   5.485
  632    HA   TYR  85           HA       TYR  85  -9.400  -0.320   3.558
  633   1HB   TYR  85          HB2       TYR  85 -11.387  -1.753   3.539
  634   2HB   TYR  85          HB1       TYR  85  -9.984  -2.597   2.905
  635    HD1  TYR  85           HD1      TYR  85 -12.711  -2.768   5.134
  636    HD2  TYR  85           HD2      TYR  85  -8.708  -4.131   4.622
  637    HE1  TYR  85           HE1      TYR  85 -13.149  -4.625   6.687
  638    HE2  TYR  85           HE2      TYR  85  -9.139  -5.991   6.170
  639    HH   TYR  85           HH       TYR  85 -10.735  -6.478   8.068
  640    H    LYS  86           HN       LYS  86 -10.952   1.014   4.420
  641    HA   LYS  86           HA       LYS  86 -10.890   1.279   7.275
  642   1HB   LYS  86          HB2       LYS  86 -12.104   3.275   7.047
  643   2HB   LYS  86          HB1       LYS  86 -11.026   3.236   5.669
  644   1HG   LYS  86          HG2       LYS  86 -13.887   2.362   5.470
  645   2HG   LYS  86          HG1       LYS  86 -13.406   4.050   5.309
  646   1HD   LYS  86          HD2       LYS  86 -11.757   3.168   3.528
  647   2HD   LYS  86          HD1       LYS  86 -12.777   1.725   3.527
  648   1HE   LYS  86          HE2       LYS  86 -13.705   4.552   3.010
  649   2HE   LYS  86          HE1       LYS  86 -13.459   3.314   1.782
  650   1HZ   LYS  86          HZ1       LYS  86 -15.264   2.072   2.608
  651   2HZ   LYS  86          HZ2       LYS  86 -15.801   3.674   2.521
  652   3HZ   LYS  86          HZ3       LYS  86 -15.377   3.002   4.020
  653    H    ASN  87           HN       ASN  87 -12.413   0.758   8.716
  654    HA   ASN  87           HA       ASN  87 -14.181  -1.350   8.123
  655   1HB   ASN  87          HB2       ASN  87 -13.178  -0.976  10.348
  656   2HB   ASN  87          HB1       ASN  87 -14.129   0.494  10.526
  657   1HD2  ASN  87          HD21      ASN  87 -16.261   0.363  11.083
  658   2HD2  ASN  87          HD22      ASN  87 -17.030  -1.128  11.540
  659    H    ASP  88           HN       ASP  88 -14.500   2.071   8.035
  660    HA   ASP  88           HA       ASP  88 -17.350   2.214   8.111
  661   1HB   ASP  88          HB2       ASP  88 -15.531   4.237   6.807
  662   2HB   ASP  88          HB1       ASP  88 -17.101   4.511   7.552
  663    H    VAL  89           HN       VAL  89 -18.802   2.342   6.411
  664    HA   VAL  89           HA       VAL  89 -17.753   1.766   3.730
  665    HB   VAL  89           HB       VAL  89 -20.377   1.431   5.007
  666   1HG1  VAL  89          HG11      VAL  89 -20.251   2.396   2.208
  667   2HG1  VAL  89          HG12      VAL  89 -21.145   3.093   3.555
  668   3HG1  VAL  89          HG13      VAL  89 -21.624   1.530   2.893
  669   1HG2  VAL  89          HG21      VAL  89 -19.042  -0.469   4.413
  670   2HG2  VAL  89          HG22      VAL  89 -18.998   0.071   2.735
  671   3HG2  VAL  89          HG23      VAL  89 -20.522  -0.454   3.452
  672    H    GLY  90           HN       GLY  90 -18.015   3.213   2.026
  673   1HA   GLY  90          HA2       GLY  90 -19.186   5.367   1.378
  674   2HA   GLY  90          HA1       GLY  90 -18.548   5.979   2.897
  675    H    SER  91           HN       SER  91 -17.766   7.530   1.105
  676    HA   SER  91           HA       SER  91 -15.526   6.711  -0.457
  677   1HB   SER  91          HB2       SER  91 -16.320   9.515   0.378
  678   2HB   SER  91          HB1       SER  91 -15.331   9.057  -1.009
  679    HG   SER  91           HG       SER  91 -17.305   7.828  -1.679
  680    H    TRP  92           HN       TRP  92 -13.470   8.298  -0.119
  681    HA   TRP  92           HA       TRP  92 -12.819   8.759   2.642
  682   1HB   TRP  92          HB2       TRP  92 -12.378   6.267   2.292
  683   2HB   TRP  92          HB1       TRP  92 -11.060   6.764   1.226
  684    HD1  TRP  92           HD1      TRP  92 -12.170   7.136   4.911
  685    HE1  TRP  92           HE1      TRP  92 -10.077   7.619   6.330
  686    HE3  TRP  92           HE3      TRP  92  -8.725   7.423   1.181
  687    HZ2  TRP  92           HZ2      TRP  92  -7.318   8.089   5.892
  688    HZ3  TRP  92           HZ3      TRP  92  -6.408   7.910   1.730
  689    HH2  TRP  92           HH2      TRP  92  -5.701   8.230   4.050
  690    H    GLY  93           HN       GLY  93 -11.721   8.554  -0.703
  691   1HA   GLY  93          HA2       GLY  93 -10.086   9.700  -1.869
  692   2HA   GLY  93          HA1       GLY  93 -10.645  11.085  -0.942
  693    H    GLY  94           HN       GLY  94  -8.870  12.091  -0.118
  694   1HA   GLY  94          HA2       GLY  94  -7.488  12.400   1.697
  695   2HA   GLY  94          HA1       GLY  94  -7.730  10.716   2.115
  696    H    THR  95           HN       THR  95  -5.597  10.473   2.647
  697    HA   THR  95           HA       THR  95  -3.830   9.944   0.404
  698    HB   THR  95           HB       THR  95  -1.977  11.045   1.957
  699    HG1  THR  95           HG1      THR  95  -2.980  13.096   2.742
  700   1HG2  THR  95          HG21      THR  95  -2.367  11.646  -0.371
  701   2HG2  THR  95          HG22      THR  95  -2.127  13.093   0.610
  702   3HG2  THR  95          HG23      THR  95  -3.752  12.632   0.100
  703    H    ILE  96           HN       ILE  96  -2.681   8.123   0.733
  704    HA   ILE  96           HA       ILE  96  -2.695   6.972   3.449
  705    HB   ILE  96           HB       ILE  96  -2.114   5.482   0.888
  706   1HG1  ILE  96          HG12      ILE  96  -4.459   6.517   1.071
  707   2HG1  ILE  96          HG11      ILE  96  -4.363   4.788   0.752
  708   1HG2  ILE  96          HG21      ILE  96  -2.880   4.546   3.635
  709   2HG2  ILE  96          HG22      ILE  96  -1.263   4.474   2.927
  710   3HG2  ILE  96          HG23      ILE  96  -2.575   3.517   2.236
  711   1HD1  ILE  96          HD11      ILE  96  -6.083   5.279   2.382
  712   2HD1  ILE  96          HD12      ILE  96  -4.901   6.083   3.414
  713   3HD1  ILE  96          HD13      ILE  96  -4.782   4.348   3.124
  714    H    GLY  97           HN       GLY  97  -0.801   6.684   4.467
  715   1HA   GLY  97          HA2       GLY  97   1.599   7.560   3.022
  716   2HA   GLY  97          HA1       GLY  97   1.379   7.597   4.766
  717    H    ILE  98           HN       ILE  98   3.491   6.396   3.108
  718    HA   ILE  98           HA       ILE  98   3.151   3.574   3.758
  719    HB   ILE  98           HB       ILE  98   5.164   5.021   2.051
  720   1HG1  ILE  98          HG12      ILE  98   3.090   2.926   1.460
  721   2HG1  ILE  98          HG11      ILE  98   2.924   4.635   1.117
  722   1HG2  ILE  98          HG21      ILE  98   6.162   2.847   1.547
  723   2HG2  ILE  98          HG22      ILE  98   5.098   2.081   2.726
  724   3HG2  ILE  98          HG23      ILE  98   6.318   3.235   3.262
  725   1HD1  ILE  98          HD11      ILE  98   4.770   4.509  -0.465
  726   2HD1  ILE  98          HD12      ILE  98   3.484   3.377  -0.884
  727   3HD1  ILE  98          HD13      ILE  98   4.957   2.791  -0.113
  728    H    TYR  99           HN       TYR  99   3.797   2.950   5.654
  729    HA   TYR  99           HA       TYR  99   6.102   4.265   6.937
  730   1HB   TYR  99          HB2       TYR  99   3.933   2.709   8.365
  731   2HB   TYR  99          HB1       TYR  99   5.116   3.803   9.065
  732    HD1  TYR  99           HD1      TYR  99   4.610   6.085   9.366
  733    HD2  TYR  99           HD2      TYR  99   2.079   3.690   6.934
  734    HE1  TYR  99           HE1      TYR  99   2.983   7.922   9.261
  735    HE2  TYR  99           HE2      TYR  99   0.445   5.521   6.825
  736    HH   TYR  99           HH       TYR  99   1.176   8.704   7.884
  737    H    VAL 100           HN       VAL 100   7.817   2.953   7.407
  738    HA   VAL 100           HA       VAL 100   7.852   0.265   6.450
  739    HB   VAL 100           HB       VAL 100   9.860   1.681   6.444
  740   1HG1  VAL 100          HG11      VAL 100  11.068   2.167   8.452
  741   2HG1  VAL 100          HG12      VAL 100   9.893   1.278   9.423
  742   3HG1  VAL 100          HG13      VAL 100   9.423   2.777   8.620
  743   1HG2  VAL 100          HG21      VAL 100  11.417  -0.018   7.091
  744   2HG2  VAL 100          HG22      VAL 100   9.994  -0.799   6.407
  745   3HG2  VAL 100          HG23      VAL 100  10.229  -0.767   8.156
  746    H    ASP 101           HN       ASP 101   7.545  -1.629   7.548
  747    HA   ASP 101           HA       ASP 101   6.401  -1.509  10.172
  748   1HB   ASP 101          HB2       ASP 101   5.602  -3.153   8.521
  749   2HB   ASP 101          HB1       ASP 101   7.192  -3.910   8.504
  750    H    GLY 102           HN       GLY 102   7.996  -0.694  11.532
  751   1HA   GLY 102          HA2       GLY 102   9.318  -1.288  13.361
  752   2HA   GLY 102          HA1       GLY 102   9.729  -2.792  12.557
  753    H    GLN 103           HN       GLN 103  10.103  -0.033  10.594
  754    HA   GLN 103           HA       GLN 103  11.886   1.015   9.692
  755   1HB   GLN 103          HB2       GLN 103  12.150   1.990  11.898
  756   2HB   GLN 103          HB1       GLN 103  13.118   0.615  12.416
  757   1HG   GLN 103          HG2       GLN 103  14.827   1.197  10.771
  758   2HG   GLN 103          HG1       GLN 103  13.849   2.562  10.236
  759   1HE2  GLN 103          HE21      GLN 103  15.420   4.059  10.749
  760   2HE2  GLN 103          HE22      GLN 103  15.814   4.475  12.381
  761    H    GLN 104           HN       GLN 104  12.897   0.088   8.107
  762    HA   GLN 104           HA       GLN 104  14.227  -2.446   8.337
  763   1HB   GLN 104          HB2       GLN 104  13.044  -1.792   6.281
  764   2HB   GLN 104          HB1       GLN 104  14.143  -0.440   6.071
  765   1HG   GLN 104          HG2       GLN 104  14.828  -2.126   4.569
  766   2HG   GLN 104          HG1       GLN 104  16.008  -2.096   5.877
  767   1HE2  GLN 104          HE21      GLN 104  15.339  -4.230   3.976
  768   2HE2  GLN 104          HE22      GLN 104  14.879  -5.589   4.944
  769    H    THR 105           HN       THR 105  15.061   0.890   8.491
  770    HA   THR 105           HA       THR 105  16.961   2.033   8.927
  771    HB   THR 105           HB       THR 105  18.309  -0.588   9.602
  772    HG1  THR 105           HG1      THR 105  16.950  -0.786  11.219
  773   1HG2  THR 105          HG21      THR 105  19.504   0.779  11.242
  774   2HG2  THR 105          HG22      THR 105  18.584   2.200  10.748
  775   3HG2  THR 105          HG23      THR 105  19.711   1.444   9.622
  776    H    ASN 106           HN       ASN 106  16.397   0.528   6.353
  777    HA   ASN 106           HA       ASN 106  17.192   0.572   4.250
  778   1HB   ASN 106          HB2       ASN 106  17.745   2.916   4.954
  779   2HB   ASN 106          HB1       ASN 106  19.377   2.362   5.305
  780   1HD2  ASN 106          HD21      ASN 106  20.763   1.907   3.629
  781   2HD2  ASN 106          HD22      ASN 106  20.419   2.335   1.990
  782    H    THR 107           HN       THR 107  17.724  -1.618   4.261
  783    HA   THR 107           HA       THR 107  20.521  -2.357   4.643
  784    HB   THR 107           HB       THR 107  18.526  -4.250   3.480
  785    HG1  THR 107           HG1      THR 107  17.255  -4.252   5.168
  786   1HG2  THR 107          HG21      THR 107  19.624  -5.829   5.004
  787   2HG2  THR 107          HG22      THR 107  20.599  -4.514   5.661
  788   3HG2  THR 107          HG23      THR 107  20.793  -5.003   3.977
  789    HA   PRO 108           HA       PRO 108  22.375  -1.682   0.708
  790   1HB   PRO 108          HB2       PRO 108  22.074  -4.634   0.348
  791   2HB   PRO 108          HB1       PRO 108  23.475  -3.600   0.044
  792   1HG   PRO 108          HG2       PRO 108  23.015  -5.083   2.367
  793   2HG   PRO 108          HG1       PRO 108  24.182  -3.766   2.189
  794   1HD   PRO 108          HD2       PRO 108  21.907  -3.779   3.855
  795   2HD   PRO 108          HD1       PRO 108  22.899  -2.365   3.439
  796    HA   PRO 109           HA       PRO 109  18.361  -1.994  -1.411
  797   1HB   PRO 109          HB2       PRO 109  18.174   0.771  -1.740
  798   2HB   PRO 109          HB1       PRO 109  17.484  -0.171  -0.418
  799   1HG   PRO 109          HG2       PRO 109  19.564   1.739  -0.256
  800   2HG   PRO 109          HG1       PRO 109  18.997   0.663   1.028
  801   1HD   PRO 109          HD2       PRO 109  21.350   0.394  -0.760
  802   2HD   PRO 109          HD1       PRO 109  21.096  -0.203   0.897
  803    H    GLY 110           HN       GLY 110  17.755   0.063  -3.182
  804   1HA   GLY 110          HA2       GLY 110  19.496   0.573  -5.270
  805   2HA   GLY 110          HA1       GLY 110  18.740  -0.991  -5.594
  806    H    ASN 111           HN       ASN 111  17.227  -0.519  -7.148
  807    HA   ASN 111           HA       ASN 111  15.314   1.601  -6.500
  808   1HB   ASN 111          HB2       ASN 111  16.282   0.995  -8.912
  809   2HB   ASN 111          HB1       ASN 111  14.923  -0.128  -8.894
  810   1HD2  ASN 111          HD21      ASN 111  15.228   2.102 -10.623
  811   2HD2  ASN 111          HD22      ASN 111  13.925   3.192 -10.291
  812    H    TYR 112           HN       TYR 112  13.482   1.153  -5.482
  813    HA   TYR 112           HA       TYR 112  12.724  -1.670  -5.203
  814   1HB   TYR 112          HB2       TYR 112  12.336   0.698  -3.385
  815   2HB   TYR 112          HB1       TYR 112  11.332  -0.737  -3.234
  816    HD1  TYR 112           HD1      TYR 112  11.959  -2.095  -1.496
  817    HD2  TYR 112           HD2      TYR 112  14.995  -0.103  -3.695
  818    HE1  TYR 112           HE1      TYR 112  13.672  -3.164  -0.093
  819    HE2  TYR 112           HE2      TYR 112  16.705  -1.170  -2.309
  820    HH   TYR 112           HH       TYR 112  15.878  -3.500   0.212
  821    H    THR 113           HN       THR 113  10.923  -2.334  -6.049
  822    HA   THR 113           HA       THR 113   9.032  -0.342  -7.077
  823    HB   THR 113           HB       THR 113   9.408  -3.238  -7.866
  824    HG1  THR 113           HG1      THR 113  10.603  -2.495  -9.507
  825   1HG2  THR 113          HG21      THR 113   7.902  -2.707  -9.731
  826   2HG2  THR 113          HG22      THR 113   7.682  -1.079  -9.090
  827   3HG2  THR 113          HG23      THR 113   7.097  -2.471  -8.179
  828    H    LEU 114           HN       LEU 114   7.031  -0.279  -6.272
  829    HA   LEU 114           HA       LEU 114   6.006  -2.608  -4.848
  830   1HB   LEU 114          HB2       LEU 114   4.956  -0.805  -3.237
  831   2HB   LEU 114          HB1       LEU 114   6.545  -1.481  -2.939
  832    HG   LEU 114           HG       LEU 114   6.393   1.028  -4.527
  833   1HD1  LEU 114          HD11      LEU 114   6.050   0.914  -1.534
  834   2HD1  LEU 114          HD12      LEU 114   4.841   1.460  -2.697
  835   3HD1  LEU 114          HD13      LEU 114   6.335   2.373  -2.483
  836   1HD2  LEU 114          HD21      LEU 114   8.539  -0.056  -4.148
  837   2HD2  LEU 114          HD22      LEU 114   8.277   0.012  -2.406
  838   3HD2  LEU 114          HD23      LEU 114   8.470   1.504  -3.327
  839    H    THR 115           HN       THR 115   4.711  -3.054  -6.544
  840    HA   THR 115           HA       THR 115   3.062  -1.048  -7.772
  841    HB   THR 115           HB       THR 115   2.808  -4.040  -8.091
  842    HG1  THR 115           HG1      THR 115   4.996  -3.454  -8.452
  843   1HG2  THR 115          HG21      THR 115   2.256  -1.741  -9.973
  844   2HG2  THR 115          HG22      THR 115   1.036  -2.662  -9.094
  845   3HG2  THR 115          HG23      THR 115   2.019  -3.451 -10.328
  846    H    LEU 116           HN       LEU 116   1.221  -0.322  -6.919
  847    HA   LEU 116           HA       LEU 116  -0.158  -1.995  -4.934
  848   1HB   LEU 116          HB2       LEU 116  -0.238   0.975  -5.402
  849   2HB   LEU 116          HB1       LEU 116  -1.171   0.136  -4.178
  850    HG   LEU 116           HG       LEU 116   1.844   0.300  -4.286
  851   1HD1  LEU 116          HD11      LEU 116  -0.129   1.621  -2.431
  852   2HD1  LEU 116          HD12      LEU 116   0.800   2.426  -3.697
  853   3HD1  LEU 116          HD13      LEU 116   1.629   1.710  -2.313
  854   1HD2  LEU 116          HD21      LEU 116   1.079  -1.797  -3.306
  855   2HD2  LEU 116          HD22      LEU 116   0.022  -0.907  -2.209
  856   3HD2  LEU 116          HD23      LEU 116   1.772  -0.739  -2.077
  857    H    THR 117           HN       THR 117  -2.245  -2.551  -5.177
  858    HA   THR 117           HA       THR 117  -3.538  -1.750  -7.702
  859    HB   THR 117           HB       THR 117  -4.130  -4.220  -6.063
  860    HG1  THR 117           HG1      THR 117  -1.914  -3.800  -7.264
  861   1HG2  THR 117          HG21      THR 117  -5.909  -3.503  -7.600
  862   2HG2  THR 117          HG22      THR 117  -5.173  -5.013  -8.134
  863   3HG2  THR 117          HG23      THR 117  -4.754  -3.496  -8.932
  864    H    GLY 118           HN       GLY 118  -5.114  -0.302  -7.419
  865   1HA   GLY 118          HA2       GLY 118  -6.342   0.073  -4.826
  866   2HA   GLY 118          HA1       GLY 118  -6.638   1.029  -6.271
  867    H    GLY 119           HN       GLY 119  -8.746   0.354  -4.692
  868   1HA   GLY 119          HA2       GLY 119 -10.748  -0.408  -6.204
  869   2HA   GLY 119          HA1       GLY 119  -9.998  -1.977  -5.932
  870    H    TYR 120           HN       TYR 120 -12.339  -2.162  -5.086
  871    HA   TYR 120           HA       TYR 120 -12.526  -1.175  -2.343
  872   1HB   TYR 120          HB2       TYR 120 -14.868  -1.804  -2.427
  873   2HB   TYR 120          HB1       TYR 120 -14.461  -0.797  -3.808
  874    HD1  TYR 120           HD1      TYR 120 -15.482  -4.136  -2.709
  875    HD2  TYR 120           HD2      TYR 120 -14.475  -1.722  -6.064
  876    HE1  TYR 120           HE1      TYR 120 -16.489  -5.805  -4.203
  877    HE2  TYR 120           HE2      TYR 120 -15.479  -3.388  -7.567
  878    HH   TYR 120           HH       TYR 120 -16.098  -5.701  -7.626
  879    H    TRP 121           HN       TRP 121 -13.956  -2.865  -1.027
  880    HA   TRP 121           HA       TRP 121 -13.007  -5.589  -1.291
  881   1HB   TRP 121          HB2       TRP 121 -11.215  -4.980   0.036
  882   2HB   TRP 121          HB1       TRP 121 -12.088  -3.658   0.798
  883    HD1  TRP 121           HD1      TRP 121 -13.999  -4.498   2.645
  884    HE1  TRP 121           HE1      TRP 121 -13.826  -6.364   4.391
  885    HE3  TRP 121           HE3      TRP 121 -10.103  -7.152   0.628
  886    HZ2  TRP 121           HZ2      TRP 121 -12.259  -8.611   4.867
  887    HZ3  TRP 121           HZ3      TRP 121  -9.337  -9.160   1.854
  888    HH2  TRP 121           HH2      TRP 121 -10.398  -9.863   3.901
  889    H    ALA 122           HN       ALA 122 -14.331  -7.053  -0.112
  890    HA   ALA 122           HA       ALA 122 -16.758  -5.858   1.042
  891   1HB   ALA 122          HB1       ALA 122 -16.606  -8.394  -0.578
  892   2HB   ALA 122          HB2       ALA 122 -17.168  -6.834  -1.179
  893   3HB   ALA 122          HB3       ALA 122 -18.062  -7.662   0.096
  894    H    LYS 123           HN       LYS 123 -17.628  -6.796   2.807
  895    HA   LYS 123           HA       LYS 123 -17.822  -7.903   4.739
  896   1HB   LYS 123          HB2       LYS 123 -16.371 -10.066   3.231
  897   2HB   LYS 123          HB1       LYS 123 -17.046 -10.280   4.844
  898   1HG   LYS 123          HG2       LYS 123 -19.252  -9.455   3.774
  899   2HG   LYS 123          HG1       LYS 123 -18.467  -9.849   2.245
  900   1HD   LYS 123          HD2       LYS 123 -19.790 -11.729   2.969
  901   2HD   LYS 123          HD1       LYS 123 -18.079 -12.147   3.084
  902   1HE   LYS 123          HE2       LYS 123 -19.367 -12.903   5.043
  903   2HE   LYS 123          HE1       LYS 123 -18.107 -11.747   5.474
  904   1HZ   LYS 123          HZ1       LYS 123 -20.978 -11.063   5.104
  905   2HZ   LYS 123          HZ2       LYS 123 -19.751 -10.012   5.624
  906   3HZ   LYS 123          HZ3       LYS 123 -20.223 -11.311   6.603
  907    H    ASP 124           HN       ASP 124 -15.615  -9.874   5.686
  908    HA   ASP 124           HA       ASP 124 -13.444  -7.995   6.128
  909   1HB   ASP 124          HB2       ASP 124 -13.568  -7.963   8.519
  910   2HB   ASP 124          HB1       ASP 124 -15.144  -7.493   7.898
  911    H    ASN 125           HN       ASN 125 -11.611  -8.978   5.999
  912    HA   ASN 125           HA       ASN 125  -9.907 -10.439   6.125
  913   1HB   ASN 125          HB2       ASN 125 -10.590 -10.422   8.507
  914   2HB   ASN 125          HB1       ASN 125 -11.525 -11.880   8.207
  915   1HD2  ASN 125          HD21      ASN 125 -10.469 -13.830   7.943
  916   2HD2  ASN 125          HD22      ASN 125  -8.772 -14.030   8.256
  917    H    LYS 126           HN       LYS 126 -13.013 -11.673   5.389
  918    HA   LYS 126           HA       LYS 126 -12.271 -14.310   4.644
  919   1HB   LYS 126          HB2       LYS 126 -14.446 -14.438   3.618
  920   2HB   LYS 126          HB1       LYS 126 -14.593 -13.575   5.144
  921   1HG   LYS 126          HG2       LYS 126 -15.756 -12.077   3.964
  922   2HG   LYS 126          HG1       LYS 126 -14.183 -11.530   3.380
  923   1HD   LYS 126          HD2       LYS 126 -14.405 -13.157   1.494
  924   2HD   LYS 126          HD1       LYS 126 -16.047 -13.493   2.046
  925   1HE   LYS 126          HE2       LYS 126 -16.493 -11.023   1.828
  926   2HE   LYS 126          HE1       LYS 126 -14.939 -10.897   1.007
  927   1HZ   LYS 126          HZ1       LYS 126 -16.655 -11.117  -0.626
  928   2HZ   LYS 126          HZ2       LYS 126 -17.278 -12.503   0.127
  929   3HZ   LYS 126          HZ3       LYS 126 -15.754 -12.553  -0.617
  930    H    GLN 127           HN       GLN 127 -11.348 -11.447   3.396
  931    HA   GLN 127           HA       GLN 127 -10.295 -10.760   1.534
  932   1HB   GLN 127          HB2       GLN 127  -9.119 -12.907   1.563
  933   2HB   GLN 127          HB1       GLN 127 -10.438 -13.655   0.673
  934   1HG   GLN 127          HG2       GLN 127  -9.986 -12.202  -1.231
  935   2HG   GLN 127          HG1       GLN 127  -8.677 -11.432  -0.337
  936   1HE2  GLN 127          HE21      GLN 127  -7.771 -13.922   0.866
  937   2HE2  GLN 127          HE22      GLN 127  -6.970 -14.806  -0.390
  938    H    GLY 128           HN       GLY 128 -12.359  -9.612   1.253
  939   1HA   GLY 128          HA2       GLY 128 -13.723 -10.535  -1.175
  940   2HA   GLY 128          HA1       GLY 128 -14.364  -9.351  -0.040
  941    H    PHE 129           HN       PHE 129 -11.059  -9.400  -1.257
  942    HA   PHE 129           HA       PHE 129 -11.246  -6.624  -1.867
  943   1HB   PHE 129          HB2       PHE 129  -8.946  -6.673  -2.056
  944   2HB   PHE 129          HB1       PHE 129  -9.207  -8.052  -1.006
  945    HD1  PHE 129           HD1      PHE 129  -9.054 -10.348  -1.934
  946    HD2  PHE 129           HD2      PHE 129  -8.000  -6.913  -4.216
  947    HE1  PHE 129           HE1      PHE 129  -7.811 -11.772  -3.506
  948    HE2  PHE 129           HE2      PHE 129  -6.762  -8.333  -5.793
  949    HZ   PHE 129           HZ       PHE 129  -6.665 -10.767  -5.440
  950    H    THR 130           HN       THR 130 -11.247  -5.626  -3.854
  951    HA   THR 130           HA       THR 130 -11.053  -7.270  -6.266
  952    HB   THR 130           HB       THR 130 -13.313  -5.305  -5.817
  953    HG1  THR 130           HG1      THR 130 -13.055  -8.005  -5.278
  954   1HG2  THR 130          HG21      THR 130 -14.209  -6.190  -7.904
  955   2HG2  THR 130          HG22      THR 130 -12.825  -7.273  -8.059
  956   3HG2  THR 130          HG23      THR 130 -12.596  -5.527  -8.163
  957    HA   PRO 131           HA       PRO 131  -8.670  -3.663  -7.486
  958   1HB   PRO 131          HB2       PRO 131  -8.239  -4.389 -10.062
  959   2HB   PRO 131          HB1       PRO 131  -7.358  -5.105  -8.709
  960   1HG   PRO 131          HG2       PRO 131  -9.693  -6.183 -10.234
  961   2HG   PRO 131          HG1       PRO 131  -8.246  -7.028  -9.652
  962   1HD   PRO 131          HD2       PRO 131 -10.650  -7.137  -8.378
  963   2HD   PRO 131          HD1       PRO 131  -9.097  -7.287  -7.535
  964    H    SER 132           HN       SER 132  -9.475  -1.739  -8.016
  965    HA   SER 132           HA       SER 132 -11.288  -1.419 -10.253
  966   1HB   SER 132          HB2       SER 132 -12.148  -0.571  -7.475
  967   2HB   SER 132          HB1       SER 132 -13.068  -0.376  -8.969
  968    HG   SER 132           HG       SER 132 -12.574  -2.887  -8.929
  969    H    GLY 133           HN       GLY 133 -10.392   0.223 -11.319
  970   1HA   GLY 133          HA2       GLY 133 -10.106   2.705 -11.192
  971   2HA   GLY 133          HA1       GLY 133  -9.152   2.397  -9.747
  972    H    THR 134           HN       THR 134  -7.027   2.035  -9.962
  973    HA   THR 134           HA       THR 134  -5.963   1.083 -12.481
  974    HB   THR 134           HB       THR 134  -6.047   3.511 -12.842
  975    HG1  THR 134           HG1      THR 134  -4.180   2.146 -13.541
  976   1HG2  THR 134          HG21      THR 134  -4.268   3.675 -10.416
  977   2HG2  THR 134          HG22      THR 134  -5.937   4.236 -10.518
  978   3HG2  THR 134          HG23      THR 134  -4.683   5.017 -11.482
  979    H    THR 135           HN       THR 135  -3.806   0.332 -12.320
  980    HA   THR 135           HA       THR 135  -3.029  -0.366  -9.596
  981    HB   THR 135           HB       THR 135  -1.748  -1.305 -12.168
  982    HG1  THR 135           HG1      THR 135  -3.608  -2.284 -12.480
  983   1HG2  THR 135          HG21      THR 135  -1.019  -3.190 -10.815
  984   2HG2  THR 135          HG22      THR 135  -1.871  -2.542  -9.415
  985   3HG2  THR 135          HG23      THR 135  -0.485  -1.678 -10.080
  986    H    GLY 136           HN       GLY 136  -2.017   1.376  -8.725
  987   1HA   GLY 136          HA2       GLY 136  -0.179   2.970 -10.300
  988   2HA   GLY 136          HA1       GLY 136  -0.654   3.264  -8.634
  989    H    THR 137           HN       THR 137   1.963   2.869 -10.288
  990    HA   THR 137           HA       THR 137   3.212   0.878  -8.524
  991    HB   THR 137           HB       THR 137   4.388   2.189 -10.984
  992    HG1  THR 137           HG1      THR 137   2.535   0.880 -11.470
  993   1HG2  THR 137          HG21      THR 137   5.211  -0.263  -9.420
  994   2HG2  THR 137          HG22      THR 137   6.046   1.291  -9.432
  995   3HG2  THR 137          HG23      THR 137   5.975   0.318 -10.901
  996    H    THR 138           HN       THR 138   3.915   1.823  -6.686
  997    HA   THR 138           HA       THR 138   5.061   4.486  -6.801
  998    HB   THR 138           HB       THR 138   4.912   2.637  -4.403
  999    HG1  THR 138           HG1      THR 138   2.897   3.638  -5.678
 1000   1HG2  THR 138          HG21      THR 138   5.103   4.719  -3.124
 1001   2HG2  THR 138          HG22      THR 138   5.257   5.627  -4.628
 1002   3HG2  THR 138          HG23      THR 138   6.506   4.473  -4.163
 1003    H    LYS 139           HN       LYS 139   7.085   4.773  -7.341
 1004    HA   LYS 139           HA       LYS 139   8.959   2.517  -7.095
 1005   1HB   LYS 139          HB2       LYS 139   8.535   3.542  -9.359
 1006   2HB   LYS 139          HB1       LYS 139   9.240   5.029  -8.753
 1007   1HG   LYS 139          HG2       LYS 139  10.960   3.968  -9.939
 1008   2HG   LYS 139          HG1       LYS 139  11.320   3.671  -8.240
 1009   1HD   LYS 139          HD2       LYS 139  11.659   1.650  -9.543
 1010   2HD   LYS 139          HD1       LYS 139  10.312   1.443  -8.423
 1011   1HE   LYS 139          HE2       LYS 139   8.717   1.669 -10.154
 1012   2HE   LYS 139          HE1       LYS 139   9.929   2.254 -11.294
 1013   1HZ   LYS 139          HZ1       LYS 139   9.286  -0.081 -11.661
 1014   2HZ   LYS 139          HZ2       LYS 139   9.904  -0.479 -10.129
 1015   3HZ   LYS 139          HZ3       LYS 139  10.939   0.100 -11.338
 1016    H    LEU 140           HN       LEU 140  10.569   2.598  -5.743
 1017    HA   LEU 140           HA       LEU 140  11.190   5.183  -4.495
 1018   1HB   LEU 140          HB2       LEU 140   9.899   4.077  -2.889
 1019   2HB   LEU 140          HB1       LEU 140  10.619   2.519  -3.242
 1020    HG   LEU 140           HG       LEU 140  12.702   3.241  -2.201
 1021   1HD1  LEU 140          HD11      LEU 140  12.549   5.645  -2.642
 1022   2HD1  LEU 140          HD12      LEU 140  12.806   5.332  -0.926
 1023   3HD1  LEU 140          HD13      LEU 140  11.201   5.770  -1.512
 1024   1HD2  LEU 140          HD21      LEU 140  10.273   3.634  -0.465
 1025   2HD2  LEU 140          HD22      LEU 140  11.904   3.288   0.113
 1026   3HD2  LEU 140          HD23      LEU 140  11.038   2.095  -0.857
 1027    H    THR 141           HN       THR 141  13.100   5.646  -5.372
 1028    HA   THR 141           HA       THR 141  15.165   3.568  -5.531
 1029    HB   THR 141           HB       THR 141  15.320   6.391  -6.601
 1030    HG1  THR 141           HG1      THR 141  14.082   4.081  -7.640
 1031   1HG2  THR 141          HG21      THR 141  16.809   3.855  -7.306
 1032   2HG2  THR 141          HG22      THR 141  17.461   5.230  -6.413
 1033   3HG2  THR 141          HG23      THR 141  17.007   5.411  -8.109
 1034    H    VAL 142           HN       VAL 142  17.113   3.749  -4.413
 1035    HA   VAL 142           HA       VAL 142  17.064   5.657  -2.211
 1036    HB   VAL 142           HB       VAL 142  17.454   3.354  -1.595
 1037   1HG1  VAL 142          HG11      VAL 142  19.476   2.153  -2.260
 1038   2HG1  VAL 142          HG12      VAL 142  19.906   3.481  -3.338
 1039   3HG1  VAL 142          HG13      VAL 142  18.452   2.531  -3.645
 1040   1HG2  VAL 142          HG21      VAL 142  19.535   3.613  -0.313
 1041   2HG2  VAL 142          HG22      VAL 142  18.506   5.043  -0.222
 1042   3HG2  VAL 142          HG23      VAL 142  19.928   5.044  -1.267
 1043    H    THR 143           HN       THR 143  17.823   7.580  -2.780
 1044    HA   THR 143           HA       THR 143  20.632   7.806  -3.368
 1045    HB   THR 143           HB       THR 143  18.622   9.014  -5.296
 1046    HG1  THR 143           HG1      THR 143  19.750   6.635  -5.299
 1047   1HG2  THR 143          HG21      THR 143  20.578   9.860  -6.503
 1048   2HG2  THR 143          HG22      THR 143  21.640   9.202  -5.258
 1049   3HG2  THR 143          HG23      THR 143  20.524  10.510  -4.864