*HEADER    TRANSCRIPTION/DNA                       28-NOV-13   4CH1
*TITLE     RRM DOMAIN FROM C. ELEGANS SUP-12
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: PROTEIN SUP-12, ISOFORM B;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: RRM DOMAIN, RESIDUES 28-121;
*COMPND   5 ENGINEERED: YES;
*COMPND   6 MOL_ID: 2;
*COMPND   7 MOLECULE: GGTGTGC;
*COMPND   8 CHAIN: B;
*COMPND   9 FRAGMENT: SUP-12 BINDING MOTIF;
*COMPND  10 OTHER_DETAILS: THE HEPTAMER SEQUENCE IS DERIVED FROM THE INTRON
*COMPND  11  BETWEEN EXONS 4 AND 5B FROM THE C. ELEGANS EGL-15 GENE.
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS;
*SOURCE   3 ORGANISM_TAXID: 6239;
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 469008;
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
*SOURCE   7 EXPRESSION_SYSTEM_VARIANT: PLYSY;
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET-HIS1A;
*SOURCE  10 MOL_ID: 2;
*SOURCE  11 SYNTHETIC: YES;
*SOURCE  12 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS;
*SOURCE  13 ORGANISM_TAXID: 6239
*KEYWDS    TRANSCRIPTION-DNA COMPLEX, MUSCLE, DEVELOPMENT
*EXPDTA    SOLUTION NMR
*AUTHOR    S.AMRANE,C.D.MACKERETH
*REVDAT   1   29-NOV-13 4CH1    0




!
!Unambiguous restraints
!
 ASSI {    6}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 35   and name HB  ))
      2.600     0.900     0.900 peak     6 spectrum    1 weight  0.10000E+01 volume  0.26952E-02 ppm1      8.447 ppm2      4.571 CV     1
 ASSI {    8}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 82   and name HA  ))
      2.200     0.600     0.600 peak     8 spectrum    1 weight  0.10000E+01 volume  0.67606E-02 ppm1      8.448 ppm2      5.204 CV     1
 ASSI {   10}
   (( segid "T22D" and resid 83   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
      4.200     2.200     1.800 peak    10 spectrum    1 weight  0.10000E+01 volume  0.39506E-03 ppm1      8.445 ppm2      1.593 CV     1
 ASSI {   13}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 35   and name HA  ))
      4.700     2.800     1.300 peak    13 spectrum    1 weight  0.10000E+01 volume  0.43649E-03 ppm1      8.555 ppm2      4.395 CV     1
 ASSI {   19}
   (( segid "T22D" and resid 31   and name HN  ))
   (( segid "T22D" and resid 30   and name HA  ))
      3.000     1.100     1.100 peak    19 spectrum    1 weight  0.10000E+01 volume  0.20219E-02 ppm1      8.422 ppm2      4.285 CV     1
 ASSI {   20}
   (( segid "T22D" and resid 31   and name HN  ))
   (( segid "T22D" and resid 31   and name HB1 ))
      3.200     1.300     1.300 peak    20 spectrum    1 weight  0.10000E+01 volume  0.12896E-02 ppm1      8.409 ppm2      2.631 CV     1
 ASSI {   21}
   (( segid "T22D" and resid 32   and name HN  ))
   (( segid "T22D" and resid 31   and name HA  ))
      2.700     0.900     0.900 peak    21 spectrum    1 weight  0.10000E+01 volume  0.43816E-02 ppm1      8.092 ppm2      4.630 CV     1
 ASSI {   22}
   (( segid "T22D" and resid 32   and name HN  ))
   (  segid "T22D" and resid 32   and name HG2%)
      3.200     1.300     1.300 peak    22 spectrum    1 weight  0.10000E+01 volume  0.14548E-02 ppm1      8.092 ppm2      1.074 CV     1
 ASSI {   24}
   (( segid "T22D" and resid 33   and name HN  ))
   (( segid "T22D" and resid 32   and name HA  ))
      2.900     1.100     1.100 peak    24 spectrum    1 weight  0.10000E+01 volume  0.21865E-02 ppm1      8.060 ppm2      4.614 CV     1
 ASSI {   25}
   (( segid "T22D" and resid 33   and name HN  ))
   (  segid "T22D" and resid 32   and name HG2%)
      4.500     2.500     1.500 peak    25 spectrum    1 weight  0.10000E+01 volume  0.60850E-03 ppm1      8.061 ppm2      1.105 CV     1
 ASSI {   26}
   (( segid "T22D" and resid 33   and name HN  ))
   (( segid "T22D" and resid 33   and name HA  ))
      2.600     0.900     0.900 peak    26 spectrum    1 weight  0.10000E+01 volume  0.37455E-02 ppm1      8.059 ppm2      3.765 CV     1
 ASSI {   27}
   (( segid "T22D" and resid 33   and name HN  ))
   (( segid "T22D" and resid 33   and name HB1 ))
      2.700     0.900     0.900 peak    27 spectrum    1 weight  0.10000E+01 volume  0.62744E-02 ppm1      8.058 ppm2      1.301 CV     1
 ASSI {   28}
   (( segid "T22D" and resid 33   and name HN  ))
   (( segid "T22D" and resid 33   and name HB2 ))
      2.300     0.600     0.600 peak    28 spectrum    1 weight  0.10000E+01 volume  0.65012E-02 ppm1      8.058 ppm2      1.769 CV     1
 ASSI {   30}
   (( segid "T22D" and resid 33   and name HN  ))
   (( segid "T22D" and resid 34   and name HN  ))
      3.300     1.300     1.300 peak    30 spectrum    1 weight  0.10000E+01 volume  0.18861E-02 ppm1      8.060 ppm2      8.420 CV     1
 ASSI {   32}
   (( segid "T22D" and resid 34   and name HN  ))
   (( segid "T22D" and resid 33   and name HA  ))
      3.400     1.400     1.400 peak    32 spectrum    1 weight  0.10000E+01 volume  0.81001E-03 ppm1      8.451 ppm2      3.746 CV     1
 ASSI {   33}
   (( segid "T22D" and resid 34   and name HN  ))
   (( segid "T22D" and resid 33   and name HB1 ))
      2.600     0.900     0.900 peak    33 spectrum    1 weight  0.10000E+01 volume  0.32917E-02 ppm1      8.450 ppm2      1.298 CV     1
 ASSI {   34}
   (( segid "T22D" and resid 34   and name HN  ))
   (( segid "T22D" and resid 33   and name HB2 ))
      3.400     1.400     1.400 peak    34 spectrum    1 weight  0.10000E+01 volume  0.17916E-02 ppm1      8.449 ppm2      1.777 CV     1
 ASSI {   35}
   (( segid "T22D" and resid 34   and name HN  ))
   (( segid "T22D" and resid 34   and name HA  ))
      2.700     0.900     0.900 peak    35 spectrum    1 weight  0.10000E+01 volume  0.31323E-02 ppm1      8.453 ppm2      4.939 CV     1
 ASSI {   36}
   (( segid "T22D" and resid 34   and name HN  ))
   (( segid "T22D" and resid 34   and name HB1 ))
      3.200     1.300     1.300 peak    36 spectrum    1 weight  0.10000E+01 volume  0.35788E-02 ppm1      8.450 ppm2      2.733 CV     1
 ASSI {   37}
   (( segid "T22D" and resid 34   and name HN  ))
   (( segid "T22D" and resid 34   and name HB2 ))
      2.900     1.000     1.000 peak    37 spectrum    1 weight  0.10000E+01 volume  0.17571E-02 ppm1      8.452 ppm2      3.515 CV     1
 ASSI {   38}
   (( segid "T22D" and resid 34   and name HN  ))
   (  segid "T22D" and resid 34   and name HD% )
      2.900     1.000     1.000 peak    38 spectrum    1 weight  0.10000E+01 volume  0.21377E-02 ppm1      8.451 ppm2      7.217 CV     1
 ASSI {   39}
   (( segid "T22D" and resid 34   and name HN  ))
   (( segid "T22D" and resid 35   and name HN  ))
      2.700     0.900     0.900 peak    39 spectrum    1 weight  0.10000E+01 volume  0.38325E-02 ppm1      8.453 ppm2      7.427 CV     1
 ASSI {   42}
   (( segid "T22D" and resid 35   and name HN  ))
   (( segid "T22D" and resid 32   and name HA  ))
      3.300     3.300     2.700 peak    42 spectrum    1 weight  0.10000E+01 volume  0.19041E-02 ppm1      7.454 ppm2      4.608 CV     1
 ASSI {   43}
   (( segid "T22D" and resid 35   and name HN  ))
   (( segid "T22D" and resid 33   and name HB1 ))
      4.000     2.000     2.000 peak    43 spectrum    1 weight  0.10000E+01 volume  0.49132E-03 ppm1      7.446 ppm2      1.302 CV     1
 ASSI {   45}
   (( segid "T22D" and resid 35   and name HN  ))
   (( segid "T22D" and resid 34   and name HA  ))
      3.000     1.100     1.100 peak    45 spectrum    1 weight  0.10000E+01 volume  0.17084E-02 ppm1      7.452 ppm2      4.947 CV     1
 ASSI {   46}
   (( segid "T22D" and resid 35   and name HN  ))
   (( segid "T22D" and resid 35   and name HA  ))
      3.100     1.200     1.200 peak    46 spectrum    1 weight  0.10000E+01 volume  0.14243E-02 ppm1      7.458 ppm2      4.401 CV     1
 ASSI {   47}
   (( segid "T22D" and resid 35   and name HN  ))
   (  segid "T22D" and resid 35   and name HG2%)
      3.000     1.100     1.100 peak    47 spectrum    1 weight  0.10000E+01 volume  0.22322E-02 ppm1      7.455 ppm2      0.799 CV     1
 ASSI {   49}
   (( segid "T22D" and resid 35   and name HN  ))
   (( segid "T22D" and resid 36   and name HB1 ))
      4.400     2.500     1.600 peak    49 spectrum    1 weight  0.10000E+01 volume  0.56897E-03 ppm1      7.453 ppm2      1.784 CV     1
 ASSI {   51}
   (( segid "T22D" and resid 36   and name HN  ))
   (  segid "T22D" and resid 82   and name HG2%)
      3.700     1.700     1.700 peak    51 spectrum    1 weight  0.10000E+01 volume  0.73403E-03 ppm1      7.905 ppm2      1.129 CV     1
 ASSI {   53}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 82   and name HA  ))
      4.200     2.200     1.800 peak    53 spectrum    1 weight  0.10000E+01 volume  0.45705E-03 ppm1      7.904 ppm2      5.199 CV     1
 ASSI {   55}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 35   and name HN  ))
      2.400     0.700     0.700 peak    55 spectrum    1 weight  0.10000E+01 volume  0.63682E-02 ppm1      7.902 ppm2      7.428 CV     1
 ASSI {   56}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 35   and name HA  ))
      3.200     1.300     1.300 peak    56 spectrum    1 weight  0.10000E+01 volume  0.13841E-02 ppm1      7.908 ppm2      4.404 CV     1
 ASSI {   57}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 36   and name HA  ))
      2.900     1.000     1.000 peak    57 spectrum    1 weight  0.10000E+01 volume  0.19032E-02 ppm1      7.904 ppm2      4.951 CV     1
 ASSI {   58}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 36   and name HB1 ))
      2.600     0.800     0.800 peak    58 spectrum    1 weight  0.10000E+01 volume  0.28028E-02 ppm1      7.899 ppm2      1.765 CV     1
 ASSI {   59}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 36   and name HB2 ))
      2.700     0.900     0.900 peak    59 spectrum    1 weight  0.10000E+01 volume  0.29799E-02 ppm1      7.903 ppm2      2.036 CV     1
 ASSI {   60}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 37   and name HN  ))
      4.200     2.200     1.800 peak    60 spectrum    1 weight  0.10000E+01 volume  0.69908E-03 ppm1      7.882 ppm2     10.036 CV     1
 ASSI {   61}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 83   and name HN  ))
      3.600     1.600     1.600 peak    61 spectrum    1 weight  0.10000E+01 volume  0.10769E-02 ppm1      7.900 ppm2      8.419 CV     1
 ASSI {   62}
   (( segid "T22D" and resid 37   and name HN  ))
   (( segid "T22D" and resid 37   and name HG11))
      2.900     1.000     1.000 peak    62 spectrum    1 weight  0.10000E+01 volume  0.11221E-02 ppm1     10.078 ppm2      1.678 CV     1
 ASSI {   63}
   (( segid "T22D" and resid 37   and name HN  ))
   (( segid "T22D" and resid 37   and name HB  ))
      2.800     1.000     1.000 peak    63 spectrum    1 weight  0.10000E+01 volume  0.19263E-02 ppm1     10.079 ppm2      1.859 CV     1
 ASSI {   64}
   (( segid "T22D" and resid 37   and name HN  ))
   (( segid "T22D" and resid 36   and name HA  ))
      2.500     0.800     0.800 peak    64 spectrum    1 weight  0.10000E+01 volume  0.31314E-02 ppm1     10.078 ppm2      4.956 CV     1
 ASSI {   65}
   (( segid "T22D" and resid 37   and name HN  ))
   (( segid "T22D" and resid 36   and name HG2 ))
      3.900     1.900     1.900 peak    65 spectrum    1 weight  0.10000E+01 volume  0.40894E-03 ppm1     10.079 ppm2      1.376 CV     1
 ASSI {   66}
   (( segid "T22D" and resid 37   and name HN  ))
   (( segid "T22D" and resid 37   and name HG12))
      4.600     2.600     1.400 peak    66 spectrum    1 weight  0.10000E+01 volume  0.50137E-03 ppm1     10.074 ppm2      0.514 CV     1
 ASSI {   67}
   (( segid "T22D" and resid 37   and name HN  ))
   (  segid "T22D" and resid 37   and name HG2%)
      4.200     2.200     1.800 peak    67 spectrum    1 weight  0.10000E+01 volume  0.77439E-03 ppm1     10.077 ppm2      0.684 CV     1
 ASSI {   70}
   (( segid "T22D" and resid 37   and name HN  ))
   (  segid "T22D" and resid 109  and name HD2%)
      4.900     3.000     1.100 peak    70 spectrum    1 weight  0.10000E+01 volume  0.40537E-03 ppm1     10.081 ppm2      0.910 CV     1
 ASSI {   71}
   (( segid "T22D" and resid 38   and name HN  ))
   (( segid "T22D" and resid 109  and name HA  ))
      3.700     1.700     1.700 peak    71 spectrum    1 weight  0.10000E+01 volume  0.88778E-03 ppm1      9.272 ppm2      4.518 CV     1
 ASSI {   73}
   (( segid "T22D" and resid 38   and name HN  ))
   (  segid "T22D" and resid 109  and name HD2%)
      5.000     3.200     1.000 peak    73 spectrum    1 weight  0.10000E+01 volume  0.43995E-03 ppm1      9.276 ppm2      0.856 CV     1
 ASSI {   74}
   (( segid "T22D" and resid 38   and name HN  ))
   (( segid "T22D" and resid 37   and name HA  ))
      2.200     0.600     0.600 peak    74 spectrum    1 weight  0.10000E+01 volume  0.60246E-02 ppm1      9.268 ppm2      4.184 CV     1
 ASSI {   76}
   (( segid "T22D" and resid 38   and name HN  ))
   (( segid "T22D" and resid 38   and name HB1 ))
      2.700     0.900     0.900 peak    76 spectrum    1 weight  0.10000E+01 volume  0.19100E-02 ppm1      9.271 ppm2      2.599 CV     1
 ASSI {   77}
   (( segid "T22D" and resid 38   and name HN  ))
   (( segid "T22D" and resid 38   and name HB2 ))
      2.800     1.000     1.000 peak    77 spectrum    1 weight  0.10000E+01 volume  0.29132E-02 ppm1      9.271 ppm2      2.778 CV     1
 ASSI {   78}
   (( segid "T22D" and resid 38   and name HN  ))
   (  segid "T22D" and resid 38   and name HD% )
      4.500     2.500     1.500 peak    78 spectrum    1 weight  0.10000E+01 volume  0.67569E-03 ppm1      9.277 ppm2      6.661 CV     1
 ASSI {   80}
   (( segid "T22D" and resid 38   and name HN  ))
   (( segid "T22D" and resid 110  and name HN  ))
      3.100     1.200     1.200 peak    80 spectrum    1 weight  0.10000E+01 volume  0.14322E-02 ppm1      9.262 ppm2      9.606 CV     1
 ASSI {   81}
   (( segid "T22D" and resid 38   and name HN  ))
   (  segid "T22D" and resid 110  and name HB% )
      3.000     1.100     1.100 peak    81 spectrum    1 weight  0.10000E+01 volume  0.17811E-02 ppm1      9.269 ppm2      1.636 CV     1
 ASSI {   82}
   (( segid "T22D" and resid 39   and name HN  ))
   (( segid "T22D" and resid 38   and name HB1 ))
      4.700     2.700     1.300 peak    82 spectrum    1 weight  0.10000E+01 volume  0.41906E-03 ppm1      7.536 ppm2      2.599 CV     1
 ASSI {   83}
   (( segid "T22D" and resid 39   and name HN  ))
   (( segid "T22D" and resid 38   and name HA  ))
      2.200     0.600     0.600 peak    83 spectrum    1 weight  0.10000E+01 volume  0.61801E-02 ppm1      7.538 ppm2      4.577 CV     1
 ASSI {   84}
   (( segid "T22D" and resid 39   and name HN  ))
   (  segid "T22D" and resid 38   and name HD% )
      3.400     1.500     1.500 peak    84 spectrum    1 weight  0.10000E+01 volume  0.11135E-02 ppm1      7.538 ppm2      6.631 CV     1
 ASSI {   85}
   (( segid "T22D" and resid 39   and name HN  ))
   (( segid "T22D" and resid 39   and name HA  ))
      3.000     1.100     1.100 peak    85 spectrum    1 weight  0.10000E+01 volume  0.15203E-02 ppm1      7.534 ppm2      4.380 CV     1
 ASSI {   86}
   (( segid "T22D" and resid 39   and name HN  ))
   (( segid "T22D" and resid 39   and name HB  ))
      2.700     0.900     0.900 peak    86 spectrum    1 weight  0.10000E+01 volume  0.24686E-02 ppm1      7.536 ppm2      1.441 CV     1
 ASSI {   89}
   (( segid "T22D" and resid 39   and name HN  ))
   (( segid "T22D" and resid 80   and name HA  ))
      3.600     1.600     1.600 peak    89 spectrum    1 weight  0.10000E+01 volume  0.50029E-03 ppm1      7.544 ppm2      5.582 CV     1
 ASSI {   90}
   (( segid "T22D" and resid 40   and name HN  ))
   (( segid "T22D" and resid 40   and name HA2 ))
      3.500     1.500     1.500 peak    90 spectrum    1 weight  0.10000E+01 volume  0.87865E-03 ppm1      9.018 ppm2      4.168 CV     1
 ASSI {   93}
   (( segid "T22D" and resid 40   and name HN  ))
   (( segid "T22D" and resid 39   and name HA  ))
      2.400     0.700     0.700 peak    93 spectrum    1 weight  0.10000E+01 volume  0.41454E-02 ppm1      9.015 ppm2      4.363 CV     1
 ASSI {   94}
   (( segid "T22D" and resid 40   and name HN  ))
   (  segid "T22D" and resid 39   and name HG1%)
      3.200     1.300     1.300 peak    94 spectrum    1 weight  0.10000E+01 volume  0.11689E-02 ppm1      9.018 ppm2      0.658 CV     1
 OR {   94}
   (( segid "T22D" and resid 40   and name HN  ))
   (  segid "T22D" and resid 39   and name HG2%)
 ASSI {   95}
   (( segid "T22D" and resid 40   and name HN  ))
   (( segid "T22D" and resid 40   and name HA1 ))
      3.100     1.200     1.200 peak    95 spectrum    1 weight  0.10000E+01 volume  0.10603E-02 ppm1      9.014 ppm2      3.737 CV     1
 ASSI {   98}
   (( segid "T22D" and resid 40   and name HN  ))
   (  segid "T22D" and resid 107  and name HG2%)
      4.200     2.300     1.800 peak    98 spectrum    1 weight  0.10000E+01 volume  0.46088E-03 ppm1      9.005 ppm2      1.011 CV     1
 OR {   98}
   (( segid "T22D" and resid 40   and name HN  ))
   (  segid "T22D" and resid 107  and name HG1%)
 ASSI {   99}
   (( segid "T22D" and resid 42   and name HN  ))
   (( segid "T22D" and resid 42   and name HB1 ))
      4.000     2.000     2.000 peak    99 spectrum    1 weight  0.10000E+01 volume  0.11528E-02 ppm1      7.699 ppm2      1.146 CV     1
 ASSI {  100}
   (( segid "T22D" and resid 42   and name HN  ))
   (( segid "T22D" and resid 41   and name HA2 ))
      3.700     1.700     1.700 peak   100 spectrum    1 weight  0.10000E+01 volume  0.59658E-03 ppm1      7.699 ppm2      3.986 CV     1
 ASSI {  102}
   (( segid "T22D" and resid 42   and name HN  ))
   (( segid "T22D" and resid 42   and name HA  ))
      3.100     1.200     1.200 peak   102 spectrum    1 weight  0.10000E+01 volume  0.10850E-02 ppm1      7.693 ppm2      4.282 CV     1
 ASSI {  104}
   (( segid "T22D" and resid 42   and name HN  ))
   (( segid "T22D" and resid 42   and name HB2 ))
      2.700     0.900     0.900 peak   104 spectrum    1 weight  0.10000E+01 volume  0.18900E-02 ppm1      7.696 ppm2      0.932 CV     1
 ASSI {  105}
   (( segid "T22D" and resid 42   and name HN  ))
   (  segid "T22D" and resid 42   and name HD1%)
      3.900     1.900     1.900 peak   105 spectrum    1 weight  0.10000E+01 volume  0.12978E-02 ppm1      7.691 ppm2      0.434 CV     1
 ASSI {  106}
   (( segid "T22D" and resid 42   and name HN  ))
   (  segid "T22D" and resid 42   and name HD2%)
      3.800     1.800     1.800 peak   106 spectrum    1 weight  0.10000E+01 volume  0.11693E-02 ppm1      7.693 ppm2      0.628 CV     1
 ASSI {  108}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 45   and name HA  ))
      3.000     3.000     3.000 peak   108 spectrum    1 weight  0.10000E+01 volume  0.52373E-02 ppm1      8.306 ppm2      4.792 CV     1
 ASSI {  109}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 44   and name HA  ))
      3.200     1.300     1.300 peak   109 spectrum    1 weight  0.10000E+01 volume  0.97026E-03 ppm1      8.308 ppm2      4.221 CV     1
 ASSI {  110}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 44   and name HB1 ))
      4.100     2.100     1.900 peak   110 spectrum    1 weight  0.10000E+01 volume  0.96734E-03 ppm1      8.302 ppm2      3.268 CV     1
 ASSI {  111}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 44   and name HB2 ))
      2.900     1.100     1.100 peak   111 spectrum    1 weight  0.10000E+01 volume  0.13545E-02 ppm1      8.303 ppm2      2.814 CV     1
 ASSI {  112}
   (( segid "T22D" and resid 44   and name HN  ))
   (  segid "T22D" and resid 44   and name HD% )
      3.300     1.300     1.300 peak   112 spectrum    1 weight  0.10000E+01 volume  0.11143E-02 ppm1      8.302 ppm2      6.814 CV     1
 ASSI {  113}
   (( segid "T22D" and resid 46   and name HN  ))
   (( segid "T22D" and resid 43   and name HB2 ))
      3.200     1.300     1.300 peak   113 spectrum    1 weight  0.10000E+01 volume  0.95375E-03 ppm1      7.275 ppm2      1.593 CV     1
 ASSI {  115}
   (( segid "T22D" and resid 46   and name HN  ))
   (( segid "T22D" and resid 46   and name HA  ))
      3.100     1.200     1.200 peak   115 spectrum    1 weight  0.10000E+01 volume  0.12890E-02 ppm1      7.272 ppm2      4.011 CV     1
 ASSI {  116}
   (( segid "T22D" and resid 46   and name HN  ))
   (( segid "T22D" and resid 46   and name HB  ))
      2.600     0.800     0.800 peak   116 spectrum    1 weight  0.10000E+01 volume  0.42981E-02 ppm1      7.278 ppm2      3.702 CV     1
 ASSI {  117}
   (( segid "T22D" and resid 46   and name HN  ))
   (  segid "T22D" and resid 46   and name HG2%)
      3.900     1.900     1.900 peak   117 spectrum    1 weight  0.10000E+01 volume  0.12300E-02 ppm1      7.276 ppm2      1.129 CV     1
 ASSI {  118}
   (( segid "T22D" and resid 47   and name HN  ))
   (  segid "T22D" and resid 50   and name HG2%)
      4.000     2.000     2.000 peak   118 spectrum    1 weight  0.10000E+01 volume  0.11018E-02 ppm1      8.418 ppm2      1.293 CV     1
 ASSI {  121}
   (( segid "T22D" and resid 47   and name HN  ))
   (( segid "T22D" and resid 46   and name HA  ))
      2.100     0.600     0.600 peak   121 spectrum    1 weight  0.10000E+01 volume  0.10422E-01 ppm1      8.416 ppm2      4.008 CV     1
 ASSI {  122}
   (( segid "T22D" and resid 47   and name HN  ))
   (  segid "T22D" and resid 46   and name HG2%)
      2.600     0.900     0.900 peak   122 spectrum    1 weight  0.10000E+01 volume  0.35253E-02 ppm1      8.417 ppm2      1.123 CV     1
 ASSI {  124}
   (( segid "T22D" and resid 47   and name HN  ))
   (( segid "T22D" and resid 50   and name HN  ))
      3.500     1.500     1.500 peak   124 spectrum    1 weight  0.10000E+01 volume  0.89783E-03 ppm1      8.417 ppm2      7.881 CV     1
 ASSI {  125}
   (( segid "T22D" and resid 47   and name HN  ))
   (( segid "T22D" and resid 50   and name HB  ))
      2.700     0.900     0.900 peak   125 spectrum    1 weight  0.10000E+01 volume  0.19849E-02 ppm1      8.419 ppm2      4.464 CV     1
 ASSI {  126}
   (( segid "T22D" and resid 48   and name HN  ))
   (( segid "T22D" and resid 47   and name HN  ))
      4.000     2.000     2.000 peak   126 spectrum    1 weight  0.10000E+01 volume  0.80900E-03 ppm1      8.706 ppm2      8.400 CV     1
 ASSI {  127}
   (( segid "T22D" and resid 48   and name HN  ))
   (( segid "T22D" and resid 47   and name HA  ))
      2.300     0.600     0.600 peak   127 spectrum    1 weight  0.10000E+01 volume  0.74520E-02 ppm1      8.712 ppm2      4.831 CV     1
 ASSI {  128}
   (( segid "T22D" and resid 48   and name HN  ))
   (( segid "T22D" and resid 47   and name HB1 ))
      3.300     1.400     1.400 peak   128 spectrum    1 weight  0.10000E+01 volume  0.55604E-02 ppm1      8.712 ppm2      4.011 CV     1
 ASSI {  129}
   (( segid "T22D" and resid 48   and name HN  ))
   (( segid "T22D" and resid 47   and name HB2 ))
      2.500     0.800     0.800 peak   129 spectrum    1 weight  0.10000E+01 volume  0.36510E-02 ppm1      8.710 ppm2      4.425 CV     1
 ASSI {  130}
   (( segid "T22D" and resid 48   and name HN  ))
   (( segid "T22D" and resid 48   and name HB1 ))
      3.400     1.400     1.400 peak   130 spectrum    1 weight  0.10000E+01 volume  0.23942E-02 ppm1      8.713 ppm2      2.970 CV     1
 ASSI {  131}
   (( segid "T22D" and resid 48   and name HN  ))
   (( segid "T22D" and resid 48   and name HB2 ))
      2.600     0.900     0.900 peak   131 spectrum    1 weight  0.10000E+01 volume  0.29057E-02 ppm1      8.712 ppm2      2.739 CV     1
 ASSI {  132}
   (( segid "T22D" and resid 48   and name HN  ))
   (( segid "T22D" and resid 49   and name HN  ))
      2.900     1.000     1.000 peak   132 spectrum    1 weight  0.10000E+01 volume  0.21263E-02 ppm1      8.711 ppm2      7.907 CV     1
 ASSI {  133}
   (( segid "T22D" and resid 48   and name HN  ))
   (( segid "T22D" and resid 66   and name HB  ))
      3.400     1.400     1.400 peak   133 spectrum    1 weight  0.10000E+01 volume  0.13116E-02 ppm1      8.713 ppm2      1.863 CV     1
 ASSI {  134}
   (( segid "T22D" and resid 48   and name HN  ))
   (  segid "T22D" and resid 66   and name HG2%)
      2.900     1.100     1.100 peak   134 spectrum    1 weight  0.10000E+01 volume  0.21147E-02 ppm1      8.714 ppm2      0.578 CV     1
 ASSI {  136}
   (( segid "T22D" and resid 49   and name HN  ))
   (( segid "T22D" and resid 47   and name HB1 ))
      4.100     2.100     1.900 peak   136 spectrum    1 weight  0.10000E+01 volume  0.14886E-02 ppm1      7.956 ppm2      4.006 CV     1
 ASSI {  137}
   (( segid "T22D" and resid 49   and name HN  ))
   (( segid "T22D" and resid 47   and name HB2 ))
      3.000     1.100     1.100 peak   137 spectrum    1 weight  0.10000E+01 volume  0.12290E-02 ppm1      7.949 ppm2      4.430 CV     1
 ASSI {  139}
   (( segid "T22D" and resid 49   and name HN  ))
   (( segid "T22D" and resid 48   and name HB1 ))
      3.900     1.900     1.900 peak   139 spectrum    1 weight  0.10000E+01 volume  0.14364E-02 ppm1      7.953 ppm2      2.985 CV     1
 ASSI {  140}
   (( segid "T22D" and resid 49   and name HN  ))
   (( segid "T22D" and resid 48   and name HB2 ))
      2.600     0.900     0.900 peak   140 spectrum    1 weight  0.10000E+01 volume  0.28864E-02 ppm1      7.956 ppm2      2.733 CV     1
 ASSI {  141}
   (( segid "T22D" and resid 49   and name HN  ))
   (( segid "T22D" and resid 49   and name HA  ))
      2.700     0.900     0.900 peak   141 spectrum    1 weight  0.10000E+01 volume  0.34576E-02 ppm1      7.955 ppm2      4.138 CV     1
 ASSI {  142}
   (( segid "T22D" and resid 49   and name HN  ))
   (( segid "T22D" and resid 49   and name HB1 ))
      2.600     0.800     0.800 peak   142 spectrum    1 weight  0.10000E+01 volume  0.57539E-02 ppm1      7.954 ppm2      1.822 CV     1
 ASSI {  143}
   (( segid "T22D" and resid 49   and name HN  ))
   (( segid "T22D" and resid 49   and name HB2 ))
      2.300     0.700     0.700 peak   143 spectrum    1 weight  0.10000E+01 volume  0.59745E-02 ppm1      7.954 ppm2      1.898 CV     1
 ASSI {  147}
   (( segid "T22D" and resid 50   and name HN  ))
   (( segid "T22D" and resid 47   and name HB1 ))
      4.400     2.400     1.600 peak   147 spectrum    1 weight  0.10000E+01 volume  0.63782E-03 ppm1      7.872 ppm2      3.977 CV     1
 ASSI {  148}
   (( segid "T22D" and resid 50   and name HN  ))
   (( segid "T22D" and resid 49   and name HB1 ))
      2.600     0.900     0.900 peak   148 spectrum    1 weight  0.10000E+01 volume  0.30719E-02 ppm1      7.882 ppm2      1.808 CV     1
 ASSI {  149}
   (( segid "T22D" and resid 50   and name HN  ))
   (( segid "T22D" and resid 49   and name HB2 ))
      3.400     1.500     1.500 peak   149 spectrum    1 weight  0.10000E+01 volume  0.12398E-02 ppm1      7.884 ppm2      1.893 CV     1
 ASSI {  150}
   (( segid "T22D" and resid 50   and name HN  ))
   (( segid "T22D" and resid 50   and name HA  ))
      2.600     0.800     0.800 peak   150 spectrum    1 weight  0.10000E+01 volume  0.41460E-02 ppm1      7.880 ppm2      4.146 CV     1
 ASSI {  151}
   (( segid "T22D" and resid 50   and name HN  ))
   (( segid "T22D" and resid 50   and name HB  ))
      2.600     0.800     0.800 peak   151 spectrum    1 weight  0.10000E+01 volume  0.32252E-02 ppm1      7.880 ppm2      4.463 CV     1
 ASSI {  152}
   (( segid "T22D" and resid 50   and name HN  ))
   (  segid "T22D" and resid 50   and name HG2%)
      3.300     1.400     1.400 peak   152 spectrum    1 weight  0.10000E+01 volume  0.36742E-02 ppm1      7.878 ppm2      1.274 CV     1
 ASSI {  153}
   (( segid "T22D" and resid 50   and name HN  ))
   (( segid "T22D" and resid 51   and name HN  ))
      2.700     0.900     0.900 peak   153 spectrum    1 weight  0.10000E+01 volume  0.26019E-02 ppm1      7.882 ppm2      8.251 CV     1
 ASSI {  154}
   (( segid "T22D" and resid 51   and name HN  ))
   (  segid "T22D" and resid 51   and name HD1%)
      4.000     2.000     2.000 peak   154 spectrum    1 weight  0.10000E+01 volume  0.12113E-02 ppm1      8.277 ppm2      0.537 CV     1
 ASSI {  155}
   (( segid "T22D" and resid 51   and name HN  ))
   (( segid "T22D" and resid 51   and name HG  ))
      3.100     1.200     1.200 peak   155 spectrum    1 weight  0.10000E+01 volume  0.96768E-03 ppm1      8.278 ppm2      1.493 CV     1
 ASSI {  157}
   (( segid "T22D" and resid 51   and name HN  ))
   (  segid "T22D" and resid 51   and name HD2%)
      4.100     2.100     1.900 peak   157 spectrum    1 weight  0.10000E+01 volume  0.77368E-03 ppm1      8.269 ppm2      0.894 CV     1
 ASSI {  158}
   (( segid "T22D" and resid 51   and name HN  ))
   (  segid "T22D" and resid 46   and name HG2%)
      3.500     1.600     1.600 peak   158 spectrum    1 weight  0.10000E+01 volume  0.13073E-02 ppm1      8.283 ppm2      1.122 CV     1
 ASSI {  160}
   (( segid "T22D" and resid 51   and name HN  ))
   (( segid "T22D" and resid 50   and name HB  ))
      2.900     1.000     1.000 peak   160 spectrum    1 weight  0.10000E+01 volume  0.15547E-02 ppm1      8.275 ppm2      4.471 CV     1
 ASSI {  161}
   (( segid "T22D" and resid 51   and name HN  ))
   (( segid "T22D" and resid 51   and name HA  ))
      2.700     0.900     0.900 peak   161 spectrum    1 weight  0.10000E+01 volume  0.25033E-02 ppm1      8.279 ppm2      4.126 CV     1
 ASSI {  163}
   (( segid "T22D" and resid 51   and name HN  ))
   (( segid "T22D" and resid 51   and name HB2 ))
      2.400     0.700     0.700 peak   163 spectrum    1 weight  0.10000E+01 volume  0.36489E-02 ppm1      8.280 ppm2      1.322 CV     1
 ASSI {  164}
   (( segid "T22D" and resid 51   and name HN  ))
   (( segid "T22D" and resid 52   and name HN  ))
      2.700     0.900     0.900 peak   164 spectrum    1 weight  0.10000E+01 volume  0.24793E-02 ppm1      8.279 ppm2      8.522 CV     1
 ASSI {  168}
   (( segid "T22D" and resid 52   and name HN  ))
   (( segid "T22D" and resid 50   and name HN  ))
      4.100     2.100     1.900 peak   168 spectrum    1 weight  0.10000E+01 volume  0.51609E-03 ppm1      8.540 ppm2      7.867 CV     1
 ASSI {  170}
   (( segid "T22D" and resid 52   and name HN  ))
   (( segid "T22D" and resid 51   and name HA  ))
      3.000     1.100     1.100 peak   170 spectrum    1 weight  0.10000E+01 volume  0.21356E-02 ppm1      8.549 ppm2      4.132 CV     1
 ASSI {  171}
   (( segid "T22D" and resid 52   and name HN  ))
   (( segid "T22D" and resid 52   and name HA  ))
      2.600     0.800     0.800 peak   171 spectrum    1 weight  0.10000E+01 volume  0.33813E-02 ppm1      8.550 ppm2      3.736 CV     1
 ASSI {  173}
   (( segid "T22D" and resid 52   and name HN  ))
   (  segid "T22D" and resid 64   and name HB% )
      2.800     1.000     1.000 peak   173 spectrum    1 weight  0.10000E+01 volume  0.35209E-02 ppm1      8.551 ppm2      1.318 CV     1
 ASSI {  176}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 49   and name HN  ))
      3.200     3.200     2.800 peak   176 spectrum    1 weight  0.10000E+01 volume  0.40986E-03 ppm1      8.535 ppm2      7.996 CV     1
 ASSI {  177}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 55   and name HB1 ))
      4.700     2.800     1.300 peak   177 spectrum    1 weight  0.10000E+01 volume  0.49270E-03 ppm1      8.537 ppm2      2.841 CV     1
 ASSI {  179}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 56   and name HG1 ))
      4.900     3.000     1.100 peak   179 spectrum    1 weight  0.10000E+01 volume  0.43811E-03 ppm1      8.537 ppm2      2.424 CV     1
 ASSI {  181}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 52   and name HA  ))
      3.300     1.400     1.400 peak   181 spectrum    1 weight  0.10000E+01 volume  0.12438E-02 ppm1      8.537 ppm2      3.739 CV     1
 ASSI {  183}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 53   and name HB1 ))
      3.000     1.100     1.100 peak   183 spectrum    1 weight  0.10000E+01 volume  0.45813E-02 ppm1      8.536 ppm2      2.068 CV     1
 ASSI {  184}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 53   and name HB2 ))
      2.200     0.600     0.600 peak   184 spectrum    1 weight  0.10000E+01 volume  0.77719E-02 ppm1      8.535 ppm2      2.265 CV     1
 ASSI {  185}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 53   and name HG2 ))
      2.300     0.700     0.700 peak   185 spectrum    1 weight  0.10000E+01 volume  0.50851E-02 ppm1      8.534 ppm2      2.627 CV     1
 ASSI {  186}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 54   and name HN  ))
      2.700     0.900     0.900 peak   186 spectrum    1 weight  0.10000E+01 volume  0.28179E-02 ppm1      8.534 ppm2      7.796 CV     1
 ASSI {  188}
   (( segid "T22D" and resid 54   and name HN  ))
   (( segid "T22D" and resid 53   and name HB1 ))
      3.300     1.300     1.300 peak   188 spectrum    1 weight  0.10000E+01 volume  0.22090E-02 ppm1      7.817 ppm2      2.066 CV     1
 ASSI {  189}
   (( segid "T22D" and resid 54   and name HN  ))
   (( segid "T22D" and resid 53   and name HB2 ))
      2.700     0.900     0.900 peak   189 spectrum    1 weight  0.10000E+01 volume  0.25205E-02 ppm1      7.816 ppm2      2.265 CV     1
 ASSI {  190}
   (( segid "T22D" and resid 54   and name HN  ))
   (( segid "T22D" and resid 53   and name HG2 ))
      4.400     2.500     1.600 peak   190 spectrum    1 weight  0.10000E+01 volume  0.37067E-03 ppm1      7.819 ppm2      2.656 CV     1
 ASSI {  191}
   (( segid "T22D" and resid 54   and name HN  ))
   (( segid "T22D" and resid 54   and name HA  ))
      2.600     0.800     0.800 peak   191 spectrum    1 weight  0.10000E+01 volume  0.51226E-02 ppm1      7.817 ppm2      4.098 CV     1
 ASSI {  192}
   (( segid "T22D" and resid 54   and name HN  ))
   (( segid "T22D" and resid 54   and name HB1 ))
      2.600     0.800     0.800 peak   192 spectrum    1 weight  0.10000E+01 volume  0.43728E-02 ppm1      7.818 ppm2      2.878 CV     1
 ASSI {  193}
   (( segid "T22D" and resid 54   and name HN  ))
   (( segid "T22D" and resid 54   and name HB2 ))
      2.500     0.800     0.800 peak   193 spectrum    1 weight  0.10000E+01 volume  0.46614E-02 ppm1      7.818 ppm2      3.207 CV     1
 ASSI {  194}
   (( segid "T22D" and resid 54   and name HN  ))
   (  segid "T22D" and resid 54   and name HD% )
      4.400     2.500     1.600 peak   194 spectrum    1 weight  0.10000E+01 volume  0.85041E-03 ppm1      7.817 ppm2      6.328 CV     1
 ASSI {  195}
   (( segid "T22D" and resid 55   and name HN  ))
   (( segid "T22D" and resid 52   and name HA  ))
      3.900     1.900     1.900 peak   195 spectrum    1 weight  0.10000E+01 volume  0.46422E-03 ppm1      7.814 ppm2      3.755 CV     1
 ASSI {  196}
   (( segid "T22D" and resid 55   and name HN  ))
   (( segid "T22D" and resid 54   and name HA  ))
      3.400     1.400     1.400 peak   196 spectrum    1 weight  0.10000E+01 volume  0.12400E-02 ppm1      7.808 ppm2      4.095 CV     1
 ASSI {  197}
   (( segid "T22D" and resid 55   and name HN  ))
   (  segid "T22D" and resid 54   and name HD% )
      3.800     1.800     1.800 peak   197 spectrum    1 weight  0.10000E+01 volume  0.55796E-03 ppm1      7.823 ppm2      6.344 CV     1
 ASSI {  198}
   (( segid "T22D" and resid 55   and name HN  ))
   (( segid "T22D" and resid 55   and name HA  ))
      3.100     1.200     1.200 peak   198 spectrum    1 weight  0.10000E+01 volume  0.10231E-02 ppm1      7.817 ppm2      4.297 CV     1
 ASSI {  199}
   (( segid "T22D" and resid 55   and name HN  ))
   (( segid "T22D" and resid 55   and name HB1 ))
      3.000     1.100     1.100 peak   199 spectrum    1 weight  0.10000E+01 volume  0.62681E-02 ppm1      7.815 ppm2      2.871 CV     1
 ASSI {  200}
   (( segid "T22D" and resid 55   and name HN  ))
   (( segid "T22D" and resid 55   and name HB2 ))
      2.300     2.300     3.700 peak   200 spectrum    1 weight  0.10000E+01 volume  0.37700E-02 ppm1      7.815 ppm2      3.218 CV     1
 ASSI {  204}
   (( segid "T22D" and resid 55   and name HN  ))
   (  segid "T22D" and resid 61   and name HD1%)
      3.700     1.700     1.700 peak   204 spectrum    1 weight  0.10000E+01 volume  0.12395E-02 ppm1      7.816 ppm2      0.302 CV     1
 ASSI {  205}
   (( segid "T22D" and resid 55   and name HN  ))
   (  segid "T22D" and resid 81   and name HG1%)
      5.400     3.600     0.600 peak   205 spectrum    1 weight  0.10000E+01 volume  0.53044E-03 ppm1      7.812 ppm2      0.520 CV     1
 ASSI {  209}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 55   and name HN  ))
      2.400     0.700     0.700 peak   209 spectrum    1 weight  0.10000E+01 volume  0.38153E-02 ppm1      8.430 ppm2      7.786 CV     1
 ASSI {  210}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 55   and name HB1 ))
      3.300     1.400     1.400 peak   210 spectrum    1 weight  0.10000E+01 volume  0.18105E-02 ppm1      8.428 ppm2      2.837 CV     1
 ASSI {  211}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 55   and name HB2 ))
      3.800     1.800     1.800 peak   211 spectrum    1 weight  0.10000E+01 volume  0.34123E-03 ppm1      8.432 ppm2      3.225 CV     1
 ASSI {  212}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 56   and name HA  ))
      2.600     0.800     0.800 peak   212 spectrum    1 weight  0.10000E+01 volume  0.34509E-02 ppm1      8.429 ppm2      4.428 CV     1
 ASSI {  213}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 56   and name HB1 ))
      2.500     0.800     0.800 peak   213 spectrum    1 weight  0.10000E+01 volume  0.34724E-02 ppm1      8.430 ppm2      2.077 CV     1
 ASSI {  214}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 56   and name HB2 ))
      3.200     1.300     1.300 peak   214 spectrum    1 weight  0.10000E+01 volume  0.32720E-02 ppm1      8.430 ppm2      2.135 CV     1
 ASSI {  216}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 56   and name HG2 ))
      2.700     0.900     0.900 peak   216 spectrum    1 weight  0.10000E+01 volume  0.24962E-02 ppm1      8.426 ppm2      2.595 CV     1
 ASSI {  217}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 57   and name HN  ))
      2.900     1.000     1.000 peak   217 spectrum    1 weight  0.10000E+01 volume  0.16152E-02 ppm1      8.435 ppm2      6.683 CV     1
 ASSI {  218}
   (( segid "T22D" and resid 56   and name HN  ))
   (  segid "T22D" and resid 61   and name HD1%)
      2.600     0.900     0.900 peak   218 spectrum    1 weight  0.10000E+01 volume  0.26426E-02 ppm1      8.430 ppm2      0.317 CV     1
 ASSI {  220}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 55   and name HA  ))
      3.300     1.300     1.300 peak   220 spectrum    1 weight  0.10000E+01 volume  0.96163E-03 ppm1      6.710 ppm2      4.270 CV     1
 ASSI {  222}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 56   and name HB1 ))
      3.900     1.900     1.900 peak   222 spectrum    1 weight  0.10000E+01 volume  0.78273E-03 ppm1      6.706 ppm2      2.120 CV     1
 ASSI {  224}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 57   and name HA  ))
      2.700     0.900     0.900 peak   224 spectrum    1 weight  0.10000E+01 volume  0.32803E-02 ppm1      6.705 ppm2      4.069 CV     1
 ASSI {  226}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 58   and name HN  ))
      2.800     1.000     1.000 peak   226 spectrum    1 weight  0.10000E+01 volume  0.19942E-02 ppm1      6.710 ppm2      7.620 CV     1
 ASSI {  228}
   (( segid "T22D" and resid 57   and name HE21))
   (( segid "T22D" and resid 57   and name HA  ))
      3.800     1.800     1.800 peak   228 spectrum    1 weight  0.10000E+01 volume  0.76071E-03 ppm1      6.766 ppm2      4.078 CV     1
 ASSI {  229}
   (( segid "T22D" and resid 57   and name HE22))
   (( segid "T22D" and resid 57   and name HE21))
      2.100     0.500     0.500 peak   229 spectrum    1 weight  0.10000E+01 volume  0.71926E-02 ppm1      6.062 ppm2      6.734 CV     1
 ASSI {  231}
   (( segid "T22D" and resid 57   and name HE21))
   (( segid "T22D" and resid 57   and name HG1 ))
      2.800     1.000     1.000 peak   231 spectrum    1 weight  0.10000E+01 volume  0.20425E-02 ppm1      6.763 ppm2      1.504 CV     1
 ASSI {  232}
   (( segid "T22D" and resid 57   and name HE22))
   (( segid "T22D" and resid 57   and name HG1 ))
      4.000     2.000     2.000 peak   232 spectrum    1 weight  0.10000E+01 volume  0.10373E-02 ppm1      6.064 ppm2      1.502 CV     1
 ASSI {  236}
   (( segid "T22D" and resid 58   and name HN  ))
   (( segid "T22D" and resid 56   and name HA  ))
      3.700     1.700     1.700 peak   236 spectrum    1 weight  0.10000E+01 volume  0.56822E-03 ppm1      7.646 ppm2      4.441 CV     1
 ASSI {  239}
   (( segid "T22D" and resid 58   and name HN  ))
   (( segid "T22D" and resid 57   and name HA  ))
      3.800     1.800     1.800 peak   239 spectrum    1 weight  0.10000E+01 volume  0.49424E-03 ppm1      7.640 ppm2      4.047 CV     1
 ASSI {  241}
   (( segid "T22D" and resid 58   and name HN  ))
   (( segid "T22D" and resid 58   and name HA  ))
      3.100     1.200     1.200 peak   241 spectrum    1 weight  0.10000E+01 volume  0.14357E-02 ppm1      7.647 ppm2      4.701 CV     1
 ASSI {  242}
   (( segid "T22D" and resid 58   and name HN  ))
   (( segid "T22D" and resid 58   and name HB1 ))
      3.400     1.500     1.500 peak   242 spectrum    1 weight  0.10000E+01 volume  0.26287E-02 ppm1      7.645 ppm2      2.875 CV     1
 ASSI {  243}
   (( segid "T22D" and resid 58   and name HN  ))
   (( segid "T22D" and resid 58   and name HB2 ))
      3.000     1.100     1.100 peak   243 spectrum    1 weight  0.10000E+01 volume  0.11706E-02 ppm1      7.636 ppm2      3.646 CV     1
 ASSI {  244}
   (( segid "T22D" and resid 58   and name HN  ))
   (( segid "T22D" and resid 59   and name HN  ))
      2.300     0.700     0.700 peak   244 spectrum    1 weight  0.10000E+01 volume  0.60175E-02 ppm1      7.644 ppm2      7.317 CV     1
 ASSI {  245}
   (( segid "T22D" and resid 58   and name HN  ))
   (  segid "T22D" and resid 83   and name HE% )
      3.500     1.500     1.500 peak   245 spectrum    1 weight  0.10000E+01 volume  0.12007E-02 ppm1      7.643 ppm2      1.918 CV     1
 ASSI {  246}
   (( segid "T22D" and resid 59   and name HN  ))
   (( segid "T22D" and resid 56   and name HA  ))
      3.000     1.100     1.100 peak   246 spectrum    1 weight  0.10000E+01 volume  0.13842E-02 ppm1      7.325 ppm2      4.440 CV     1
 ASSI {  247}
   (( segid "T22D" and resid 59   and name HN  ))
   (( segid "T22D" and resid 57   and name HA  ))
      3.800     1.800     1.800 peak   247 spectrum    1 weight  0.10000E+01 volume  0.62114E-03 ppm1      7.325 ppm2      4.043 CV     1
 ASSI {  249}
   (( segid "T22D" and resid 59   and name HN  ))
   (( segid "T22D" and resid 58   and name HA  ))
      3.600     1.600     1.600 peak   249 spectrum    1 weight  0.10000E+01 volume  0.86747E-03 ppm1      7.324 ppm2      4.697 CV     1
 ASSI {  250}
   (( segid "T22D" and resid 59   and name HN  ))
   (( segid "T22D" and resid 58   and name HB1 ))
      4.100     2.100     1.900 peak   250 spectrum    1 weight  0.10000E+01 volume  0.94637E-03 ppm1      7.326 ppm2      2.873 CV     1
 ASSI {  251}
   (( segid "T22D" and resid 59   and name HN  ))
   (( segid "T22D" and resid 58   and name HB2 ))
      3.400     1.400     1.400 peak   251 spectrum    1 weight  0.10000E+01 volume  0.85796E-03 ppm1      7.325 ppm2      3.631 CV     1
 ASSI {  252}
   (( segid "T22D" and resid 59   and name HN  ))
   (( segid "T22D" and resid 59   and name HA1 ))
      3.000     1.100     1.100 peak   252 spectrum    1 weight  0.10000E+01 volume  0.17394E-02 ppm1      7.327 ppm2      4.551 CV     1
 ASSI {  253}
   (( segid "T22D" and resid 59   and name HN  ))
   (( segid "T22D" and resid 59   and name HA2 ))
      2.600     0.800     0.800 peak   253 spectrum    1 weight  0.10000E+01 volume  0.40735E-02 ppm1      7.325 ppm2      3.836 CV     1
 ASSI {  254}
   (( segid "T22D" and resid 59   and name HN  ))
   (( segid "T22D" and resid 60   and name HN  ))
      4.100     2.100     1.900 peak   254 spectrum    1 weight  0.10000E+01 volume  0.70116E-03 ppm1      7.323 ppm2      8.190 CV     1
 ASSI {  255}
   (( segid "T22D" and resid 59   and name HN  ))
   (  segid "T22D" and resid 83   and name HE% )
      3.000     1.200     1.200 peak   255 spectrum    1 weight  0.10000E+01 volume  0.16809E-02 ppm1      7.329 ppm2      1.908 CV     1
 ASSI {  260}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 88   and name HA  ))
      5.000     3.100     1.000 peak   260 spectrum    1 weight  0.10000E+01 volume  0.40487E-03 ppm1      8.210 ppm2      4.345 CV     1
 ASSI {  263}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 59   and name HA1 ))
      2.300     0.600     0.600 peak   263 spectrum    1 weight  0.10000E+01 volume  0.72310E-02 ppm1      8.211 ppm2      4.551 CV     1
 ASSI {  264}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 59   and name HA2 ))
      2.500     0.800     0.800 peak   264 spectrum    1 weight  0.10000E+01 volume  0.70342E-02 ppm1      8.211 ppm2      3.837 CV     1
 ASSI {  265}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 60   and name HA  ))
      2.500     0.800     0.800 peak   265 spectrum    1 weight  0.10000E+01 volume  0.50212E-02 ppm1      8.211 ppm2      4.721 CV     1
 ASSI {  266}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 60   and name HB2 ))
      2.200     0.600     0.600 peak   266 spectrum    1 weight  0.10000E+01 volume  0.10667E-01 ppm1      8.210 ppm2      2.535 CV     1
 OR {  266}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 60   and name HB1 ))
 ASSI {  267}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 61   and name HN  ))
      4.700     2.700     1.300 peak   267 spectrum    1 weight  0.10000E+01 volume  0.46138E-03 ppm1      8.211 ppm2      8.780 CV     1
 ASSI {  268}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 84   and name HB1 ))
      3.600     1.600     1.600 peak   268 spectrum    1 weight  0.10000E+01 volume  0.15610E-02 ppm1      8.209 ppm2      1.706 CV     1
 ASSI {  269}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 84   and name HB2 ))
      3.700     1.700     1.700 peak   269 spectrum    1 weight  0.10000E+01 volume  0.18916E-02 ppm1      8.212 ppm2      1.900 CV     1
 ASSI {  270}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 61   and name HG12))
      4.000     2.000     2.000 peak   270 spectrum    1 weight  0.10000E+01 volume  0.11172E-02 ppm1      8.810 ppm2      0.922 CV     1
 ASSI {  272}
   (( segid "T22D" and resid 61   and name HN  ))
   (  segid "T22D" and resid 64   and name HB% )
      4.900     3.000     1.100 peak   272 spectrum    1 weight  0.10000E+01 volume  0.64971E-03 ppm1      8.812 ppm2      1.320 CV     1
 ASSI {  274}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 60   and name HA  ))
      2.100     0.600     0.600 peak   274 spectrum    1 weight  0.10000E+01 volume  0.11766E-01 ppm1      8.810 ppm2      4.712 CV     1
 ASSI {  275}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 60   and name HB1 ))
      3.200     1.300     1.300 peak   275 spectrum    1 weight  0.10000E+01 volume  0.24012E-02 ppm1      8.807 ppm2      2.576 CV     1
 OR {  275}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 60   and name HB2 ))
 ASSI {  276}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 61   and name HA  ))
      2.900     1.100     1.100 peak   276 spectrum    1 weight  0.10000E+01 volume  0.14475E-02 ppm1      8.809 ppm2      4.095 CV     1
 ASSI {  277}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 61   and name HB  ))
      2.200     0.600     0.600 peak   277 spectrum    1 weight  0.10000E+01 volume  0.85229E-02 ppm1      8.809 ppm2      1.505 CV     1
 ASSI {  278}
   (( segid "T22D" and resid 61   and name HN  ))
   (  segid "T22D" and resid 61   and name HD1%)
      4.000     2.000     2.000 peak   278 spectrum    1 weight  0.10000E+01 volume  0.10610E-02 ppm1      8.811 ppm2      0.316 CV     1
 ASSI {  279}
   (( segid "T22D" and resid 61   and name HN  ))
   (  segid "T22D" and resid 61   and name HG2%)
      3.900     1.900     1.900 peak   279 spectrum    1 weight  0.10000E+01 volume  0.11517E-02 ppm1      8.807 ppm2      0.586 CV     1
 ASSI {  280}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 62   and name HN  ))
      4.500     2.500     1.500 peak   280 spectrum    1 weight  0.10000E+01 volume  0.43102E-03 ppm1      8.812 ppm2      9.134 CV     1
 ASSI {  281}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 84   and name HB1 ))
      4.100     2.100     1.900 peak   281 spectrum    1 weight  0.10000E+01 volume  0.11570E-02 ppm1      8.803 ppm2      1.697 CV     1
 ASSI {  282}
   (( segid "T22D" and resid 61   and name HN  ))
   (( segid "T22D" and resid 84   and name HB2 ))
      4.000     2.000     2.000 peak   282 spectrum    1 weight  0.10000E+01 volume  0.42177E-03 ppm1      8.818 ppm2      1.874 CV     1
 ASSI {  283}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 84   and name HN  ))
      3.500     1.500     1.500 peak   283 spectrum    1 weight  0.10000E+01 volume  0.85746E-03 ppm1      9.154 ppm2      8.314 CV     1
 ASSI {  284}
   (( segid "T22D" and resid 62   and name HN  ))
   (  segid "T22D" and resid 82   and name HG2%)
      4.000     2.000     2.000 peak   284 spectrum    1 weight  0.10000E+01 volume  0.65012E-03 ppm1      9.157 ppm2      1.138 CV     1
 ASSI {  285}
   (( segid "T22D" and resid 62   and name HN  ))
   (  segid "T22D" and resid 64   and name HB% )
      5.000     3.200     1.000 peak   285 spectrum    1 weight  0.10000E+01 volume  0.68240E-03 ppm1      9.157 ppm2      1.317 CV     1
 ASSI {  286}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 82   and name HB  ))
      3.800     1.800     1.800 peak   286 spectrum    1 weight  0.10000E+01 volume  0.71017E-03 ppm1      9.159 ppm2      3.911 CV     1
 ASSI {  290}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 61   and name HA  ))
      2.100     0.500     0.500 peak   290 spectrum    1 weight  0.10000E+01 volume  0.78186E-02 ppm1      9.155 ppm2      4.100 CV     1
 ASSI {  291}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 61   and name HG11))
      4.600     2.700     1.400 peak   291 spectrum    1 weight  0.10000E+01 volume  0.66205E-03 ppm1      9.155 ppm2      1.499 CV     1
 ASSI {  292}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 61   and name HG12))
      4.100     2.100     1.900 peak   292 spectrum    1 weight  0.10000E+01 volume  0.69324E-03 ppm1      9.157 ppm2      0.943 CV     1
 ASSI {  293}
   (( segid "T22D" and resid 62   and name HN  ))
   (  segid "T22D" and resid 61   and name HG2%)
      2.700     0.900     0.900 peak   293 spectrum    1 weight  0.10000E+01 volume  0.29448E-02 ppm1      9.156 ppm2      0.598 CV     1
 ASSI {  294}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 62   and name HA  ))
      2.800     1.000     1.000 peak   294 spectrum    1 weight  0.10000E+01 volume  0.21147E-02 ppm1      9.151 ppm2      4.400 CV     1
 ASSI {  295}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 62   and name HB1 ))
      2.700     0.900     0.900 peak   295 spectrum    1 weight  0.10000E+01 volume  0.32675E-02 ppm1      9.157 ppm2      1.722 CV     1
 ASSI {  296}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 62   and name HB2 ))
      2.600     0.900     0.900 peak   296 spectrum    1 weight  0.10000E+01 volume  0.17683E-02 ppm1      9.158 ppm2      1.823 CV     1
 ASSI {  297}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 62   and name HG1 ))
      4.200     2.200     1.800 peak   297 spectrum    1 weight  0.10000E+01 volume  0.10520E-02 ppm1      9.156 ppm2      2.094 CV     1
 OR {  297}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 62   and name HG2 ))
 ASSI {  299}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 83   and name HA  ))
      2.700     0.900     0.900 peak   299 spectrum    1 weight  0.10000E+01 volume  0.20528E-02 ppm1      9.158 ppm2      5.063 CV     1
 ASSI {  302}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 61   and name HA  ))
      4.000     2.000     2.000 peak   302 spectrum    1 weight  0.10000E+01 volume  0.11075E-02 ppm1      7.603 ppm2      4.097 CV     1
 ASSI {  303}
   (( segid "T22D" and resid 63   and name HN  ))
   (  segid "T22D" and resid 61   and name HG2%)
      2.300     0.700     0.700 peak   303 spectrum    1 weight  0.10000E+01 volume  0.49428E-02 ppm1      7.600 ppm2      0.597 CV     1
 ASSI {  304}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 62   and name HN  ))
      2.300     0.600     0.600 peak   304 spectrum    1 weight  0.10000E+01 volume  0.49866E-02 ppm1      7.601 ppm2      9.124 CV     1
 ASSI {  305}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 62   and name HA  ))
      3.600     1.600     1.600 peak   305 spectrum    1 weight  0.10000E+01 volume  0.84954E-03 ppm1      7.602 ppm2      4.416 CV     1
 ASSI {  306}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 62   and name HB1 ))
      2.900     1.000     1.000 peak   306 spectrum    1 weight  0.10000E+01 volume  0.13559E-02 ppm1      7.603 ppm2      1.701 CV     1
 ASSI {  307}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 62   and name HB2 ))
      3.400     1.400     1.400 peak   307 spectrum    1 weight  0.10000E+01 volume  0.25746E-02 ppm1      7.603 ppm2      1.784 CV     1
 ASSI {  308}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 62   and name HG1 ))
      3.800     1.800     1.800 peak   308 spectrum    1 weight  0.10000E+01 volume  0.17231E-02 ppm1      7.600 ppm2      2.100 CV     1
 OR {  308}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 62   and name HG2 ))
 ASSI {  309}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 63   and name HA  ))
      3.000     1.100     1.100 peak   309 spectrum    1 weight  0.10000E+01 volume  0.13850E-02 ppm1      7.600 ppm2      4.534 CV     1
 ASSI {  311}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 64   and name HN  ))
      3.900     1.900     1.900 peak   311 spectrum    1 weight  0.10000E+01 volume  0.87306E-03 ppm1      7.602 ppm2      8.911 CV     1
 ASSI {  312}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 82   and name HN  ))
      2.900     1.000     1.000 peak   312 spectrum    1 weight  0.10000E+01 volume  0.19125E-02 ppm1      7.599 ppm2      9.535 CV     1
 ASSI {  313}
   (( segid "T22D" and resid 63   and name HN  ))
   (( segid "T22D" and resid 82   and name HB  ))
      2.700     0.900     0.900 peak   313 spectrum    1 weight  0.10000E+01 volume  0.23579E-02 ppm1      7.600 ppm2      3.903 CV     1
 ASSI {  314}
   (( segid "T22D" and resid 63   and name HN  ))
   (  segid "T22D" and resid 82   and name HG2%)
      4.100     2.100     1.900 peak   314 spectrum    1 weight  0.10000E+01 volume  0.98870E-03 ppm1      7.602 ppm2      1.145 CV     1
 ASSI {  316}
   (( segid "T22D" and resid 64   and name HN  ))
   (( segid "T22D" and resid 52   and name HN  ))
      4.500     2.500     1.500 peak   316 spectrum    1 weight  0.10000E+01 volume  0.48144E-03 ppm1      8.912 ppm2      8.577 CV     1
 ASSI {  317}
   (( segid "T22D" and resid 64   and name HN  ))
   (  segid "T22D" and resid 61   and name HG2%)
      3.500     1.600     1.600 peak   317 spectrum    1 weight  0.10000E+01 volume  0.10290E-02 ppm1      8.914 ppm2      0.589 CV     1
 ASSI {  318}
   (( segid "T22D" and resid 64   and name HN  ))
   (( segid "T22D" and resid 63   and name HA  ))
      2.200     0.600     0.600 peak   318 spectrum    1 weight  0.10000E+01 volume  0.90116E-02 ppm1      8.914 ppm2      4.515 CV     1
 ASSI {  319}
   (( segid "T22D" and resid 64   and name HN  ))
   (( segid "T22D" and resid 63   and name HB1 ))
      3.400     1.400     1.400 peak   319 spectrum    1 weight  0.10000E+01 volume  0.26322E-02 ppm1      8.913 ppm2      1.979 CV     1
 ASSI {  320}
   (( segid "T22D" and resid 64   and name HN  ))
   (( segid "T22D" and resid 63   and name HB2 ))
      4.500     2.600     1.500 peak   320 spectrum    1 weight  0.10000E+01 volume  0.66063E-03 ppm1      8.916 ppm2      2.117 CV     1
 ASSI {  322}
   (( segid "T22D" and resid 64   and name HN  ))
   (( segid "T22D" and resid 63   and name HG2 ))
      3.600     1.600     1.600 peak   322 spectrum    1 weight  0.10000E+01 volume  0.15827E-02 ppm1      8.913 ppm2      2.336 CV     1
 ASSI {  323}
   (( segid "T22D" and resid 64   and name HN  ))
   (( segid "T22D" and resid 64   and name HA  ))
      2.900     1.100     1.100 peak   323 spectrum    1 weight  0.10000E+01 volume  0.17722E-02 ppm1      8.913 ppm2      5.235 CV     1
 ASSI {  324}
   (( segid "T22D" and resid 64   and name HN  ))
   (  segid "T22D" and resid 64   and name HB% )
      2.600     0.900     0.900 peak   324 spectrum    1 weight  0.10000E+01 volume  0.34678E-02 ppm1      8.915 ppm2      1.317 CV     1
 ASSI {  325}
   (( segid "T22D" and resid 64   and name HN  ))
   (  segid "T22D" and resid 65   and name HG1%)
      3.700     1.700     1.700 peak   325 spectrum    1 weight  0.10000E+01 volume  0.68198E-03 ppm1      8.911 ppm2      0.935 CV     1
 OR {  325}
   (( segid "T22D" and resid 64   and name HN  ))
   (  segid "T22D" and resid 65   and name HG2%)
 ASSI {  333}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 64   and name HA  ))
      2.200     0.600     0.600 peak   333 spectrum    1 weight  0.10000E+01 volume  0.86730E-02 ppm1      8.921 ppm2      5.240 CV     1
 ASSI {  334}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 64   and name HB% )
      3.300     1.400     1.400 peak   334 spectrum    1 weight  0.10000E+01 volume  0.22818E-02 ppm1      8.920 ppm2      1.313 CV     1
 ASSI {  335}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 65   and name HA  ))
      2.600     0.800     0.800 peak   335 spectrum    1 weight  0.10000E+01 volume  0.33778E-02 ppm1      8.919 ppm2      4.755 CV     1
 ASSI {  336}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 65   and name HB  ))
      3.600     1.700     1.700 peak   336 spectrum    1 weight  0.10000E+01 volume  0.12268E-02 ppm1      8.923 ppm2      1.935 CV     1
 ASSI {  337}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 65   and name HG2%)
      2.400     0.700     0.700 peak   337 spectrum    1 weight  0.10000E+01 volume  0.61226E-02 ppm1      8.920 ppm2      0.923 CV     1
 ASSI {  338}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 66   and name HA  ))
      4.000     2.000     2.000 peak   338 spectrum    1 weight  0.10000E+01 volume  0.41527E-03 ppm1      8.918 ppm2      3.770 CV     1
 ASSI {  339}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 81   and name HG2%)
      3.700     1.700     1.700 peak   339 spectrum    1 weight  0.10000E+01 volume  0.10057E-02 ppm1      8.925 ppm2      0.263 CV     1
 ASSI {  340}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 83   and name HB2 ))
      2.500     0.800     0.800 peak   340 spectrum    1 weight  0.10000E+01 volume  0.22911E-02 ppm1      8.449 ppm2      1.988 CV     1
 ASSI {  341}
   (( segid "T22D" and resid 66   and name HN  ))
   (( segid "T22D" and resid 65   and name HA  ))
      2.000     0.500     0.500 peak   341 spectrum    1 weight  0.10000E+01 volume  0.13024E-01 ppm1      8.447 ppm2      4.736 CV     1
 ASSI {  342}
   (( segid "T22D" and resid 66   and name HN  ))
   (  segid "T22D" and resid 65   and name HG2%)
      3.100     1.200     1.200 peak   342 spectrum    1 weight  0.10000E+01 volume  0.44816E-02 ppm1      8.448 ppm2      0.923 CV     1
 OR {  342}
   (( segid "T22D" and resid 66   and name HN  ))
   (  segid "T22D" and resid 65   and name HG1%)
 ASSI {  343}
   (( segid "T22D" and resid 66   and name HN  ))
   (( segid "T22D" and resid 66   and name HA  ))
      3.000     1.100     1.100 peak   343 spectrum    1 weight  0.10000E+01 volume  0.14653E-02 ppm1      8.453 ppm2      3.747 CV     1
 ASSI {  344}
   (( segid "T22D" and resid 66   and name HN  ))
   (( segid "T22D" and resid 66   and name HB  ))
      2.300     0.700     0.700 peak   344 spectrum    1 weight  0.10000E+01 volume  0.67719E-02 ppm1      8.448 ppm2      1.854 CV     1
 ASSI {  345}
   (( segid "T22D" and resid 66   and name HN  ))
   (  segid "T22D" and resid 66   and name HG1%)
      3.700     1.700     1.700 peak   345 spectrum    1 weight  0.10000E+01 volume  0.21681E-02 ppm1      8.449 ppm2      0.729 CV     1
 ASSI {  346}
   (( segid "T22D" and resid 66   and name HN  ))
   (  segid "T22D" and resid 66   and name HG2%)
      2.500     0.800     0.800 peak   346 spectrum    1 weight  0.10000E+01 volume  0.40183E-02 ppm1      8.448 ppm2      0.566 CV     1
 ASSI {  347}
   (( segid "T22D" and resid 67   and name HN  ))
   (( segid "T22D" and resid 67   and name HA  ))
      2.800     1.000     1.000 peak   347 spectrum    1 weight  0.10000E+01 volume  0.17168E-02 ppm1      8.346 ppm2      4.084 CV     1
 ASSI {  348}
   (( segid "T22D" and resid 67   and name HN  ))
   (( segid "T22D" and resid 79   and name HA2 ))
      2.500     0.800     0.800 peak   348 spectrum    1 weight  0.10000E+01 volume  0.21958E-02 ppm1      8.344 ppm2      3.937 CV     1
 ASSI {  350}
   (( segid "T22D" and resid 67   and name HN  ))
   (( segid "T22D" and resid 67   and name HG12))
      2.900     1.000     1.000 peak   350 spectrum    1 weight  0.10000E+01 volume  0.15830E-02 ppm1      8.346 ppm2      1.141 CV     1
 ASSI {  353}
   (( segid "T22D" and resid 67   and name HN  ))
   (  segid "T22D" and resid 51   and name HD1%)
      4.300     2.300     1.700 peak   353 spectrum    1 weight  0.10000E+01 volume  0.73569E-03 ppm1      8.332 ppm2      0.540 CV     1
 ASSI {  356}
   (( segid "T22D" and resid 67   and name HN  ))
   (( segid "T22D" and resid 66   and name HA  ))
      2.200     0.600     0.600 peak   356 spectrum    1 weight  0.10000E+01 volume  0.59428E-02 ppm1      8.345 ppm2      3.758 CV     1
 ASSI {  358}
   (( segid "T22D" and resid 68   and name HN  ))
   (  segid "T22D" and resid 67   and name HG2%)
      2.600     0.800     0.800 peak   358 spectrum    1 weight  0.10000E+01 volume  0.42452E-02 ppm1      7.928 ppm2      0.883 CV     1
 ASSI {  359}
   (( segid "T22D" and resid 68   and name HN  ))
   (  segid "T22D" and resid 67   and name HD1%)
      3.600     1.700     1.700 peak   359 spectrum    1 weight  0.10000E+01 volume  0.28553E-02 ppm1      7.928 ppm2      0.787 CV     1
 ASSI {  360}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "T22D" and resid 76   and name HN  ))
      4.400     2.400     1.600 peak   360 spectrum    1 weight  0.10000E+01 volume  0.39863E-03 ppm1      7.922 ppm2      9.093 CV     1
 ASSI {  363}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "T22D" and resid 76   and name HB1 ))
      5.100     3.200     0.900 peak   363 spectrum    1 weight  0.10000E+01 volume  0.37969E-03 ppm1      7.924 ppm2      1.329 CV     1
 ASSI {  364}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "T22D" and resid 67   and name HA  ))
      2.000     0.500     0.500 peak   364 spectrum    1 weight  0.10000E+01 volume  0.12199E-01 ppm1      7.927 ppm2      4.084 CV     1
 ASSI {  365}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "T22D" and resid 68   and name HB  ))
      3.400     1.400     1.400 peak   365 spectrum    1 weight  0.10000E+01 volume  0.14179E-02 ppm1      7.928 ppm2      3.690 CV     1
 ASSI {  367}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 76   and name HG1 ))
      3.600     1.600     1.600 peak   367 spectrum    1 weight  0.10000E+01 volume  0.48182E-03 ppm1      8.604 ppm2      1.683 CV     1
 ASSI {  368}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 68   and name HB  ))
      2.500     0.800     0.800 peak   368 spectrum    1 weight  0.10000E+01 volume  0.44145E-02 ppm1      8.605 ppm2      3.674 CV     1
 ASSI {  369}
   (( segid "T22D" and resid 69   and name HN  ))
   (  segid "T22D" and resid 68   and name HG2%)
      3.900     1.900     1.900 peak   369 spectrum    1 weight  0.10000E+01 volume  0.18142E-02 ppm1      8.605 ppm2      0.967 CV     1
 ASSI {  370}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 69   and name HA  ))
      2.800     1.000     1.000 peak   370 spectrum    1 weight  0.10000E+01 volume  0.24782E-02 ppm1      8.604 ppm2      4.599 CV     1
 ASSI {  371}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      2.600     0.900     0.900 peak   371 spectrum    1 weight  0.10000E+01 volume  0.35240E-02 ppm1      8.603 ppm2      2.480 CV     1
 ASSI {  372}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 69   and name HB2 ))
      2.500     0.800     0.800 peak   372 spectrum    1 weight  0.10000E+01 volume  0.41609E-02 ppm1      8.603 ppm2      3.068 CV     1
 ASSI {  373}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 74   and name HN  ))
      3.200     1.300     1.300 peak   373 spectrum    1 weight  0.10000E+01 volume  0.92001E-03 ppm1      8.605 ppm2      7.635 CV     1
 ASSI {  374}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 75   and name HA  ))
      4.300     2.300     1.700 peak   374 spectrum    1 weight  0.10000E+01 volume  0.65550E-03 ppm1      8.602 ppm2      4.176 CV     1
 ASSI {  376}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 76   and name HN  ))
      4.600     2.600     1.400 peak   376 spectrum    1 weight  0.10000E+01 volume  0.45192E-03 ppm1      8.604 ppm2      9.121 CV     1
 ASSI {  378}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "3T5T" and resid 6    and name H5''))
      3.000     3.000     3.000 peak   378 spectrum    1 weight  0.10000E+01 volume  0.56693E-03 ppm1      9.024 ppm2      4.253 CV     1
 ASSI {  379}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "T22D" and resid 69   and name HA  ))
      2.400     0.700     0.700 peak   379 spectrum    1 weight  0.10000E+01 volume  0.53599E-02 ppm1      9.023 ppm2      4.593 CV     1
 ASSI {  380}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      4.100     2.100     1.900 peak   380 spectrum    1 weight  0.10000E+01 volume  0.61901E-03 ppm1      9.016 ppm2      2.496 CV     1
 ASSI {  381}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "T22D" and resid 69   and name HB2 ))
      4.600     2.600     1.400 peak   381 spectrum    1 weight  0.10000E+01 volume  0.57523E-03 ppm1      9.028 ppm2      3.043 CV     1
 ASSI {  382}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "T22D" and resid 70   and name HA  ))
      3.000     1.100     1.100 peak   382 spectrum    1 weight  0.10000E+01 volume  0.19598E-02 ppm1      9.020 ppm2      4.053 CV     1
 ASSI {  383}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "T22D" and resid 70   and name HB2 ))
      2.500     0.800     0.800 peak   383 spectrum    1 weight  0.10000E+01 volume  0.46618E-02 ppm1      9.021 ppm2      1.854 CV     1
 OR {  383}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "T22D" and resid 70   and name HB1 ))
 ASSI {  384}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "T22D" and resid 70   and name HG2 ))
      3.800     1.800     1.800 peak   384 spectrum    1 weight  0.10000E+01 volume  0.21003E-02 ppm1      9.023 ppm2      1.678 CV     1
 OR {  384}
   (( segid "T22D" and resid 70   and name HN  ))
   (( segid "T22D" and resid 70   and name HG1 ))
 ASSI {  385}
   (( segid "T22D" and resid 71   and name HN  ))
   (  segid "T22D" and resid 72   and name HG2%)
      4.600     2.600     1.400 peak   385 spectrum    1 weight  0.10000E+01 volume  0.58682E-03 ppm1      8.844 ppm2      1.164 CV     1
 ASSI {  386}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 73   and name HN  ))
      3.700     1.700     1.700 peak   386 spectrum    1 weight  0.10000E+01 volume  0.85137E-03 ppm1      8.847 ppm2      8.296 CV     1
 ASSI {  387}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      3.800     1.800     1.800 peak   387 spectrum    1 weight  0.10000E+01 volume  0.46368E-03 ppm1      8.844 ppm2      2.496 CV     1
 ASSI {  389}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 70   and name HA  ))
      3.200     1.300     1.300 peak   389 spectrum    1 weight  0.10000E+01 volume  0.13276E-02 ppm1      8.850 ppm2      4.059 CV     1
 ASSI {  390}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 70   and name HB1 ))
      3.100     1.200     1.200 peak   390 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      8.842 ppm2      1.852 CV     1
 OR {  390}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 70   and name HB2 ))
 ASSI {  391}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 71   and name HA  ))
      2.300     0.600     0.600 peak   391 spectrum    1 weight  0.10000E+01 volume  0.11509E-01 ppm1      8.845 ppm2      4.745 CV     1
 ASSI {  392}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 71   and name HB1 ))
      3.600     1.600     1.600 peak   392 spectrum    1 weight  0.10000E+01 volume  0.28580E-02 ppm1      8.842 ppm2      3.004 CV     1
 ASSI {  393}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 71   and name HB2 ))
      2.800     1.000     1.000 peak   393 spectrum    1 weight  0.10000E+01 volume  0.20333E-02 ppm1      8.842 ppm2      2.835 CV     1
 ASSI {  394}
   (( segid "T22D" and resid 71   and name HN  ))
   (( segid "T22D" and resid 72   and name HN  ))
      2.600     0.900     0.900 peak   394 spectrum    1 weight  0.10000E+01 volume  0.29951E-02 ppm1      8.843 ppm2      8.096 CV     1
 ASSI {  396}
   (( segid "T22D" and resid 71   and name HD21))
   (( segid "T22D" and resid 71   and name HB1 ))
      3.100     1.200     1.200 peak   396 spectrum    1 weight  0.10000E+01 volume  0.18328E-02 ppm1      7.917 ppm2      3.002 CV     1
 ASSI {  397}
   (( segid "T22D" and resid 71   and name HD22))
   (( segid "T22D" and resid 71   and name HB1 ))
      4.000     2.000     2.000 peak   397 spectrum    1 weight  0.10000E+01 volume  0.11578E-02 ppm1      7.035 ppm2      2.999 CV     1
 ASSI {  398}
   (( segid "T22D" and resid 71   and name HD21))
   (( segid "T22D" and resid 71   and name HB2 ))
      3.300     1.400     1.400 peak   398 spectrum    1 weight  0.10000E+01 volume  0.70050E-03 ppm1      7.916 ppm2      2.821 CV     1
 ASSI {  399}
   (( segid "T22D" and resid 71   and name HD22))
   (( segid "T22D" and resid 71   and name HB2 ))
      4.400     2.400     1.600 peak   399 spectrum    1 weight  0.10000E+01 volume  0.65684E-03 ppm1      7.035 ppm2      2.831 CV     1
 ASSI {  400}
   (( segid "T22D" and resid 71   and name HD22))
   (( segid "T22D" and resid 71   and name HD21))
      1.800     0.400     0.400 peak   400 spectrum    1 weight  0.10000E+01 volume  0.17686E-01 ppm1      7.036 ppm2      7.888 CV     1
 ASSI {  402}
   (( segid "T22D" and resid 72   and name HN  ))
   (( segid "T22D" and resid 74   and name HN  ))
      4.300     2.300     1.700 peak   402 spectrum    1 weight  0.10000E+01 volume  0.63165E-03 ppm1      8.124 ppm2      7.625 CV     1
 ASSI {  405}
   (( segid "T22D" and resid 72   and name HN  ))
   (( segid "T22D" and resid 71   and name HA  ))
      2.700     0.900     0.900 peak   405 spectrum    1 weight  0.10000E+01 volume  0.53273E-02 ppm1      8.124 ppm2      4.743 CV     1
 ASSI {  406}
   (( segid "T22D" and resid 72   and name HN  ))
   (( segid "T22D" and resid 71   and name HB1 ))
      3.300     1.400     1.400 peak   406 spectrum    1 weight  0.10000E+01 volume  0.26624E-02 ppm1      8.124 ppm2      3.023 CV     1
 ASSI {  407}
   (( segid "T22D" and resid 72   and name HN  ))
   (( segid "T22D" and resid 71   and name HB2 ))
      3.000     1.100     1.100 peak   407 spectrum    1 weight  0.10000E+01 volume  0.10886E-02 ppm1      8.118 ppm2      2.822 CV     1
 ASSI {  408}
   (( segid "T22D" and resid 72   and name HN  ))
   (( segid "T22D" and resid 72   and name HA  ))
      2.600     0.900     0.900 peak   408 spectrum    1 weight  0.10000E+01 volume  0.35579E-02 ppm1      8.125 ppm2      4.349 CV     1
 ASSI {  409}
   (( segid "T22D" and resid 72   and name HN  ))
   (  segid "T22D" and resid 72   and name HG2%)
      2.500     0.800     0.800 peak   409 spectrum    1 weight  0.10000E+01 volume  0.53699E-02 ppm1      8.125 ppm2      1.170 CV     1
 ASSI {  410}
   (( segid "T22D" and resid 72   and name HN  ))
   (( segid "T22D" and resid 73   and name HN  ))
      2.300     0.600     0.600 peak   410 spectrum    1 weight  0.10000E+01 volume  0.54787E-02 ppm1      8.126 ppm2      8.265 CV     1
 ASSI {  411}
   (( segid "T22D" and resid 72   and name HN  ))
   (( segid "T22D" and resid 73   and name HA  ))
      4.300     2.300     1.700 peak   411 spectrum    1 weight  0.10000E+01 volume  0.13741E-02 ppm1      8.123 ppm2      3.982 CV     1
 ASSI {  413}
   (( segid "T22D" and resid 73   and name HN  ))
   (( segid "T22D" and resid 69   and name HB2 ))
      4.500     2.500     1.500 peak   413 spectrum    1 weight  0.10000E+01 volume  0.10394E-02 ppm1      8.302 ppm2      3.049 CV     1
 ASSI {  416}
   (( segid "T22D" and resid 73   and name HN  ))
   (( segid "T22D" and resid 72   and name HA  ))
      3.100     1.200     1.200 peak   416 spectrum    1 weight  0.10000E+01 volume  0.19906E-02 ppm1      8.296 ppm2      4.338 CV     1
 ASSI {  417}
   (( segid "T22D" and resid 73   and name HN  ))
   (  segid "T22D" and resid 72   and name HG2%)
      4.500     2.600     1.500 peak   417 spectrum    1 weight  0.10000E+01 volume  0.64954E-03 ppm1      8.292 ppm2      1.179 CV     1
 ASSI {  418}
   (( segid "T22D" and resid 73   and name HN  ))
   (( segid "T22D" and resid 73   and name HA  ))
      2.100     0.500     0.500 peak   418 spectrum    1 weight  0.10000E+01 volume  0.10440E-01 ppm1      8.296 ppm2      3.967 CV     1
 ASSI {  419}
   (( segid "T22D" and resid 73   and name HN  ))
   (( segid "T22D" and resid 73   and name HG1 ))
      2.800     1.000     1.000 peak   419 spectrum    1 weight  0.10000E+01 volume  0.32115E-02 ppm1      8.297 ppm2      2.321 CV     1
 OR {  419}
   (( segid "T22D" and resid 73   and name HN  ))
   (( segid "T22D" and resid 73   and name HG2 ))
 ASSI {  420}
   (( segid "T22D" and resid 73   and name HN  ))
   (( segid "T22D" and resid 74   and name HN  ))
      2.500     0.800     0.800 peak   420 spectrum    1 weight  0.10000E+01 volume  0.32770E-02 ppm1      8.295 ppm2      7.639 CV     1
 ASSI {  421}
   (( segid "T22D" and resid 73   and name HE22))
   (( segid "T22D" and resid 73   and name HE21))
      1.600     0.300     0.600 peak   421 spectrum    1 weight  0.10000E+01 volume  0.39458E-01 ppm1      6.756 ppm2      7.405 CV     1
 ASSI {  423}
   (( segid "T22D" and resid 73   and name HE21))
   (( segid "T22D" and resid 73   and name HG2 ))
      3.400     1.400     1.400 peak   423 spectrum    1 weight  0.10000E+01 volume  0.83619E-03 ppm1      7.433 ppm2      2.287 CV     1
 OR {  423}
   (( segid "T22D" and resid 73   and name HE21))
   (( segid "T22D" and resid 73   and name HG1 ))
 ASSI {  424}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 74   and name HB1 ))
      3.000     1.100     1.100 peak   424 spectrum    1 weight  0.10000E+01 volume  0.57619E-02 ppm1      7.666 ppm2      1.574 CV     1
 OR {  424}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 74   and name HD2 ))
 OR {  424}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 74   and name HD1 ))
 ASSI {  426}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 68   and name HB  ))
      3.600     1.600     1.600 peak   426 spectrum    1 weight  0.10000E+01 volume  0.42811E-03 ppm1      7.662 ppm2      3.697 CV     1
 ASSI {  427}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      3.100     1.200     1.200 peak   427 spectrum    1 weight  0.10000E+01 volume  0.10429E-02 ppm1      7.661 ppm2      2.481 CV     1
 ASSI {  428}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 69   and name HB2 ))
      3.600     1.600     1.600 peak   428 spectrum    1 weight  0.10000E+01 volume  0.22171E-02 ppm1      7.666 ppm2      3.064 CV     1
 ASSI {  429}
   (( segid "T22D" and resid 74   and name HN  ))
   (  segid "T22D" and resid 72   and name HG2%)
      4.400     2.500     1.600 peak   429 spectrum    1 weight  0.10000E+01 volume  0.79687E-03 ppm1      7.660 ppm2      1.188 CV     1
 ASSI {  431}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 73   and name HB1 ))
      3.700     1.700     1.700 peak   431 spectrum    1 weight  0.10000E+01 volume  0.78528E-03 ppm1      7.667 ppm2      2.325 CV     1
 OR {  431}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 73   and name HB2 ))
 OR {  431}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 73   and name HG1 ))
 ASSI {  432}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 73   and name HA  ))
      2.800     1.000     1.000 peak   432 spectrum    1 weight  0.10000E+01 volume  0.21446E-02 ppm1      7.663 ppm2      3.968 CV     1
 ASSI {  433}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 74   and name HA  ))
      2.500     0.800     0.800 peak   433 spectrum    1 weight  0.10000E+01 volume  0.41168E-02 ppm1      7.664 ppm2      4.345 CV     1
 ASSI {  434}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 74   and name HB2 ))
      2.500     0.800     0.800 peak   434 spectrum    1 weight  0.10000E+01 volume  0.26921E-02 ppm1      7.666 ppm2      1.774 CV     1
 ASSI {  435}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 74   and name HG1 ))
      2.500     0.800     0.800 peak   435 spectrum    1 weight  0.10000E+01 volume  0.38411E-02 ppm1      7.666 ppm2      1.377 CV     1
 OR {  435}
   (( segid "T22D" and resid 74   and name HN  ))
   (( segid "T22D" and resid 74   and name HG2 ))
 ASSI {  437}
   (( segid "T22D" and resid 75   and name HN  ))
   (  segid "T22D" and resid 68   and name HG2%)
      3.900     1.900     1.900 peak   437 spectrum    1 weight  0.10000E+01 volume  0.54520E-03 ppm1      8.717 ppm2      0.967 CV     1
 ASSI {  440}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 74   and name HN  ))
      4.600     2.700     1.400 peak   440 spectrum    1 weight  0.10000E+01 volume  0.38543E-03 ppm1      8.733 ppm2      7.636 CV     1
 ASSI {  441}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 74   and name HA  ))
      2.400     0.700     0.700 peak   441 spectrum    1 weight  0.10000E+01 volume  0.47727E-02 ppm1      8.724 ppm2      4.369 CV     1
 ASSI {  442}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 74   and name HB1 ))
      3.700     1.700     1.700 peak   442 spectrum    1 weight  0.10000E+01 volume  0.54024E-03 ppm1      8.724 ppm2      1.574 CV     1
 ASSI {  443}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 74   and name HB2 ))
      4.200     2.200     1.800 peak   443 spectrum    1 weight  0.10000E+01 volume  0.83874E-03 ppm1      8.723 ppm2      1.777 CV     1
 ASSI {  444}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 75   and name HA  ))
      3.100     1.200     1.200 peak   444 spectrum    1 weight  0.10000E+01 volume  0.10279E-02 ppm1      8.721 ppm2      4.234 CV     1
 ASSI {  445}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 75   and name HB1 ))
      3.100     1.200     1.200 peak   445 spectrum    1 weight  0.10000E+01 volume  0.19925E-02 ppm1      8.730 ppm2      4.002 CV     1
 ASSI {  446}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 75   and name HB2 ))
      2.700     0.900     0.900 peak   446 spectrum    1 weight  0.10000E+01 volume  0.28429E-02 ppm1      8.723 ppm2      4.193 CV     1
 ASSI {  449}
   (( segid "T22D" and resid 76   and name HN  ))
   (  segid "T22D" and resid 66   and name HG1%)
      3.700     1.700     1.700 peak   449 spectrum    1 weight  0.10000E+01 volume  0.68644E-03 ppm1      9.144 ppm2      0.717 CV     1
 ASSI {  450}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 68   and name HA  ))
      2.800     1.000     1.000 peak   450 spectrum    1 weight  0.10000E+01 volume  0.29160E-02 ppm1      9.134 ppm2      4.780 CV     1
 ASSI {  451}
   (( segid "T22D" and resid 76   and name HN  ))
   (  segid "T22D" and resid 68   and name HG2%)
      4.200     2.300     1.800 peak   451 spectrum    1 weight  0.10000E+01 volume  0.14967E-02 ppm1      9.142 ppm2      0.961 CV     1
 ASSI {  452}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 75   and name HN  ))
      4.600     2.600     1.400 peak   452 spectrum    1 weight  0.10000E+01 volume  0.48403E-03 ppm1      9.123 ppm2      8.760 CV     1
 ASSI {  453}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 75   and name HA  ))
      2.200     0.600     0.600 peak   453 spectrum    1 weight  0.10000E+01 volume  0.57710E-02 ppm1      9.134 ppm2      4.183 CV     1
 ASSI {  454}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 75   and name HB1 ))
      3.800     1.800     1.800 peak   454 spectrum    1 weight  0.10000E+01 volume  0.73632E-03 ppm1      9.134 ppm2      4.003 CV     1
 ASSI {  455}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 76   and name HA  ))
      3.100     1.200     1.200 peak   455 spectrum    1 weight  0.10000E+01 volume  0.14713E-02 ppm1      9.135 ppm2      4.563 CV     1
 ASSI {  456}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 76   and name HB1 ))
      3.700     1.700     1.700 peak   456 spectrum    1 weight  0.10000E+01 volume  0.17237E-02 ppm1      9.136 ppm2      1.325 CV     1
 ASSI {  457}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 76   and name HB2 ))
      3.100     1.200     1.200 peak   457 spectrum    1 weight  0.10000E+01 volume  0.75504E-03 ppm1      9.136 ppm2      2.278 CV     1
 ASSI {  458}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 76   and name HG1 ))
      3.100     1.200     1.200 peak   458 spectrum    1 weight  0.10000E+01 volume  0.70267E-03 ppm1      9.137 ppm2      1.711 CV     1
 ASSI {  459}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 76   and name HG2 ))
      3.800     1.800     1.800 peak   459 spectrum    1 weight  0.10000E+01 volume  0.11558E-02 ppm1      9.136 ppm2      1.512 CV     1
 ASSI {  460}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 77   and name HN  ))
      2.900     1.100     1.100 peak   460 spectrum    1 weight  0.10000E+01 volume  0.13978E-02 ppm1      9.132 ppm2      9.726 CV     1
 ASSI {  464}
   (( segid "T22D" and resid 77   and name HN  ))
   (  segid "T22D" and resid 66   and name HG1%)
      4.100     2.100     1.900 peak   464 spectrum    1 weight  0.10000E+01 volume  0.38134E-03 ppm1      9.770 ppm2      0.687 CV     1
 ASSI {  466}
   (( segid "T22D" and resid 77   and name HN  ))
   (( segid "T22D" and resid 76   and name HA  ))
      3.700     1.800     1.800 peak   466 spectrum    1 weight  0.10000E+01 volume  0.40644E-03 ppm1      9.756 ppm2      4.569 CV     1
 ASSI {  467}
   (( segid "T22D" and resid 77   and name HN  ))
   (( segid "T22D" and resid 77   and name HA1 ))
      3.400     1.400     1.400 peak   467 spectrum    1 weight  0.10000E+01 volume  0.14189E-02 ppm1      9.762 ppm2      3.226 CV     1
 ASSI {  468}
   (( segid "T22D" and resid 77   and name HN  ))
   (( segid "T22D" and resid 77   and name HA2 ))
      2.800     1.000     1.000 peak   468 spectrum    1 weight  0.10000E+01 volume  0.16121E-02 ppm1      9.762 ppm2      4.218 CV     1
 ASSI {  470}
   (( segid "T22D" and resid 78   and name HN  ))
   (( segid "T22D" and resid 76   and name HB2 ))
      3.500     1.500     1.500 peak   470 spectrum    1 weight  0.10000E+01 volume  0.55525E-03 ppm1      7.089 ppm2      2.316 CV     1
 ASSI {  471}
   (( segid "T22D" and resid 78   and name HN  ))
   (( segid "T22D" and resid 42   and name HB2 ))
      3.600     1.600     1.600 peak   471 spectrum    1 weight  0.10000E+01 volume  0.69979E-03 ppm1      7.086 ppm2      0.932 CV     1
 ASSI {  472}
   (( segid "T22D" and resid 78   and name HN  ))
   (( segid "T22D" and resid 76   and name HB1 ))
      4.000     2.000     2.000 peak   472 spectrum    1 weight  0.10000E+01 volume  0.80221E-03 ppm1      7.091 ppm2      1.325 CV     1
 ASSI {  473}
   (( segid "T22D" and resid 78   and name HN  ))
   (( segid "T22D" and resid 76   and name HN  ))
      3.600     1.600     1.600 peak   473 spectrum    1 weight  0.10000E+01 volume  0.58227E-03 ppm1      7.090 ppm2      9.085 CV     1
 ASSI {  474}
   (( segid "T22D" and resid 78   and name HN  ))
   (( segid "T22D" and resid 78   and name HB1 ))
      4.500     2.500     1.500 peak   474 spectrum    1 weight  0.10000E+01 volume  0.18435E-03 ppm1      7.086 ppm2      2.430 CV     1
 ASSI {  475}
   (( segid "T22D" and resid 78   and name HN  ))
   (  segid "T22D" and resid 42   and name HD1%)
      4.000     2.000     2.000 peak   475 spectrum    1 weight  0.10000E+01 volume  0.79353E-03 ppm1      7.089 ppm2      0.430 CV     1
 ASSI {  476}
   (( segid "T22D" and resid 78   and name HN  ))
   (  segid "T22D" and resid 66   and name HG1%)
      3.500     1.500     1.500 peak   476 spectrum    1 weight  0.10000E+01 volume  0.84153E-03 ppm1      7.082 ppm2      0.686 CV     1
 ASSI {  477}
   (( segid "T22D" and resid 78   and name HN  ))
   (( segid "T22D" and resid 77   and name HN  ))
      2.700     0.900     0.900 peak   477 spectrum    1 weight  0.10000E+01 volume  0.29402E-02 ppm1      7.084 ppm2      9.722 CV     1
 ASSI {  479}
   (( segid "T22D" and resid 78   and name HN  ))
   (( segid "T22D" and resid 77   and name HA2 ))
      3.300     1.400     1.400 peak   479 spectrum    1 weight  0.10000E+01 volume  0.10630E-02 ppm1      7.089 ppm2      4.219 CV     1
 ASSI {  480}
   (( segid "T22D" and resid 78   and name HN  ))
   (( segid "T22D" and resid 78   and name HA  ))
      2.900     1.100     1.100 peak   480 spectrum    1 weight  0.10000E+01 volume  0.16566E-02 ppm1      7.085 ppm2      4.974 CV     1
 ASSI {  481}
   (( segid "T22D" and resid 78   and name HN  ))
   (  segid "T22D" and resid 78   and name HD% )
      3.900     1.900     1.900 peak   481 spectrum    1 weight  0.10000E+01 volume  0.43286E-03 ppm1      7.079 ppm2      6.370 CV     1
 ASSI {  482}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 78   and name HB2 ))
      2.600     0.800     0.800 peak   482 spectrum    1 weight  0.10000E+01 volume  0.20575E-02 ppm1      8.772 ppm2      2.456 CV     1
 ASSI {  483}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 39   and name HN  ))
      3.200     1.300     1.300 peak   483 spectrum    1 weight  0.10000E+01 volume  0.89808E-03 ppm1      8.765 ppm2      7.507 CV     1
 ASSI {  484}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 78   and name HN  ))
      4.400     2.400     1.600 peak   484 spectrum    1 weight  0.10000E+01 volume  0.38333E-03 ppm1      8.765 ppm2      7.065 CV     1
 ASSI {  486}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 78   and name HB1 ))
      4.000     2.000     2.000 peak   486 spectrum    1 weight  0.10000E+01 volume  0.12227E-02 ppm1      8.776 ppm2      2.398 CV     1
 ASSI {  489}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 39   and name HB  ))
      2.800     1.000     1.000 peak   489 spectrum    1 weight  0.10000E+01 volume  0.14062E-02 ppm1      8.769 ppm2      1.422 CV     1
 ASSI {  491}
   (( segid "T22D" and resid 79   and name HN  ))
   (  segid "T22D" and resid 42   and name HD1%)
      2.800     1.000     1.000 peak   491 spectrum    1 weight  0.10000E+01 volume  0.13836E-02 ppm1      8.774 ppm2      0.426 CV     1
 ASSI {  492}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 78   and name HA  ))
      2.400     0.800     0.800 peak   492 spectrum    1 weight  0.10000E+01 volume  0.33997E-02 ppm1      8.772 ppm2      4.970 CV     1
 ASSI {  493}
   (( segid "T22D" and resid 79   and name HN  ))
   (  segid "T22D" and resid 78   and name HD% )
      3.600     1.600     1.600 peak   493 spectrum    1 weight  0.10000E+01 volume  0.93206E-03 ppm1      8.769 ppm2      6.354 CV     1
 ASSI {  494}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 79   and name HA1 ))
      2.700     0.900     0.900 peak   494 spectrum    1 weight  0.10000E+01 volume  0.17265E-02 ppm1      8.774 ppm2      3.774 CV     1
 ASSI {  495}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 79   and name HA2 ))
      3.200     1.300     1.300 peak   495 spectrum    1 weight  0.10000E+01 volume  0.78728E-03 ppm1      8.771 ppm2      3.933 CV     1
 ASSI {  496}
   (( segid "T22D" and resid 80   and name HN  ))
   (( segid "T22D" and resid 65   and name HN  ))
      3.000     1.200     1.200 peak   496 spectrum    1 weight  0.10000E+01 volume  0.14899E-02 ppm1      8.427 ppm2      8.899 CV     1
 ASSI {  497}
   (( segid "T22D" and resid 80   and name HN  ))
   (  segid "T22D" and resid 67   and name HD1%)
      3.600     1.600     1.600 peak   497 spectrum    1 weight  0.10000E+01 volume  0.89095E-03 ppm1      8.427 ppm2      0.727 CV     1
 ASSI {  498}
   (( segid "T22D" and resid 80   and name HN  ))
   (( segid "T22D" and resid 79   and name HN  ))
      4.300     2.300     1.700 peak   498 spectrum    1 weight  0.10000E+01 volume  0.41914E-03 ppm1      8.429 ppm2      8.729 CV     1
 ASSI {  499}
   (( segid "T22D" and resid 80   and name HN  ))
   (( segid "T22D" and resid 67   and name HN  ))
      3.900     1.900     1.900 peak   499 spectrum    1 weight  0.10000E+01 volume  0.12673E-02 ppm1      8.429 ppm2      8.304 CV     1
 ASSI {  500}
   (( segid "T22D" and resid 80   and name HN  ))
   (  segid "T22D" and resid 65   and name HG2%)
      2.600     0.900     0.900 peak   500 spectrum    1 weight  0.10000E+01 volume  0.43857E-02 ppm1      8.427 ppm2      0.927 CV     1
 OR {  500}
   (( segid "T22D" and resid 80   and name HN  ))
   (  segid "T22D" and resid 65   and name HG1%)
 ASSI {  501}
   (( segid "T22D" and resid 80   and name HN  ))
   (  segid "T22D" and resid 66   and name HG2%)
      2.500     2.500     3.500 peak   501 spectrum    1 weight  0.10000E+01 volume  0.17872E-02 ppm1      8.425 ppm2      0.558 CV     1
 ASSI {  502}
   (( segid "T22D" and resid 80   and name HN  ))
   (( segid "T22D" and resid 79   and name HA1 ))
      2.400     0.700     0.700 peak   502 spectrum    1 weight  0.10000E+01 volume  0.50025E-02 ppm1      8.426 ppm2      3.776 CV     1
 ASSI {  503}
   (( segid "T22D" and resid 80   and name HN  ))
   (( segid "T22D" and resid 79   and name HA2 ))
      2.500     0.800     0.800 peak   503 spectrum    1 weight  0.10000E+01 volume  0.34627E-02 ppm1      8.425 ppm2      3.940 CV     1
 ASSI {  504}
   (( segid "T22D" and resid 80   and name HN  ))
   (( segid "T22D" and resid 80   and name HA  ))
      3.000     1.200     1.200 peak   504 spectrum    1 weight  0.10000E+01 volume  0.14053E-02 ppm1      8.425 ppm2      5.574 CV     1
 ASSI {  505}
   (( segid "T22D" and resid 80   and name HN  ))
   (( segid "T22D" and resid 80   and name HB1 ))
      3.900     1.900     1.900 peak   505 spectrum    1 weight  0.10000E+01 volume  0.13183E-02 ppm1      8.426 ppm2      2.168 CV     1
 ASSI {  506}
   (( segid "T22D" and resid 80   and name HN  ))
   (( segid "T22D" and resid 80   and name HB2 ))
      3.200     1.200     1.200 peak   506 spectrum    1 weight  0.10000E+01 volume  0.87827E-03 ppm1      8.420 ppm2      2.767 CV     1
 ASSI {  507}
   (( segid "T22D" and resid 80   and name HN  ))
   (  segid "T22D" and resid 80   and name HD% )
      3.400     1.500     1.500 peak   507 spectrum    1 weight  0.10000E+01 volume  0.10303E-02 ppm1      8.423 ppm2      6.594 CV     1
 ASSI {  508}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 81   and name HB  ))
      2.700     0.900     0.900 peak   508 spectrum    1 weight  0.10000E+01 volume  0.26575E-02 ppm1      8.805 ppm2      1.083 CV     1
 ASSI {  510}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 37   and name HG2%)
      3.800     1.800     1.800 peak   510 spectrum    1 weight  0.10000E+01 volume  0.95771E-03 ppm1      8.813 ppm2      0.701 CV     1
 OR {  510}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 37   and name HD1%)
 ASSI {  514}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 38   and name HA  ))
      4.100     2.100     1.900 peak   514 spectrum    1 weight  0.10000E+01 volume  0.42152E-03 ppm1      8.807 ppm2      4.582 CV     1
 ASSI {  515}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 36   and name HA  ))
      4.400     2.400     1.600 peak   515 spectrum    1 weight  0.10000E+01 volume  0.41070E-03 ppm1      8.805 ppm2      4.949 CV     1
 ASSI {  517}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 37   and name HN  ))
      3.000     1.200     1.200 peak   517 spectrum    1 weight  0.10000E+01 volume  0.12417E-02 ppm1      8.801 ppm2     10.046 CV     1
 ASSI {  518}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 37   and name HB  ))
      3.000     1.100     1.100 peak   518 spectrum    1 weight  0.10000E+01 volume  0.14703E-02 ppm1      8.803 ppm2      1.861 CV     1
 ASSI {  519}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 80   and name HA  ))
      2.300     0.700     0.700 peak   519 spectrum    1 weight  0.10000E+01 volume  0.62581E-02 ppm1      8.805 ppm2      5.575 CV     1
 ASSI {  520}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 80   and name HB1 ))
      3.400     1.500     1.500 peak   520 spectrum    1 weight  0.10000E+01 volume  0.67706E-03 ppm1      8.802 ppm2      2.172 CV     1
 ASSI {  521}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 80   and name HB2 ))
      4.000     2.000     2.000 peak   521 spectrum    1 weight  0.10000E+01 volume  0.12909E-02 ppm1      8.806 ppm2      2.750 CV     1
 ASSI {  522}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 80   and name HD% )
      3.500     1.500     1.500 peak   522 spectrum    1 weight  0.10000E+01 volume  0.11527E-02 ppm1      8.802 ppm2      6.585 CV     1
 ASSI {  523}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 81   and name HA  ))
      2.900     1.100     1.100 peak   523 spectrum    1 weight  0.10000E+01 volume  0.15984E-02 ppm1      8.804 ppm2      4.775 CV     1
 ASSI {  524}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 81   and name HG2%)
      3.300     1.300     1.300 peak   524 spectrum    1 weight  0.10000E+01 volume  0.16014E-02 ppm1      8.804 ppm2      0.270 CV     1
 ASSI {  525}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 82   and name HN  ))
      4.100     2.100     1.900 peak   525 spectrum    1 weight  0.10000E+01 volume  0.57977E-03 ppm1      8.799 ppm2      9.535 CV     1
 ASSI {  528}
   (( segid "T22D" and resid 82   and name HN  ))
   (  segid "T22D" and resid 64   and name HB% )
      4.200     2.200     1.800 peak   528 spectrum    1 weight  0.10000E+01 volume  0.50805E-03 ppm1      9.573 ppm2      1.316 CV     1
 ASSI {  531}
   (( segid "T22D" and resid 82   and name HN  ))
   (( segid "T22D" and resid 63   and name HB1 ))
      3.700     1.700     1.700 peak   531 spectrum    1 weight  0.10000E+01 volume  0.51710E-03 ppm1      9.558 ppm2      1.954 CV     1
 ASSI {  532}
   (( segid "T22D" and resid 82   and name HN  ))
   (( segid "T22D" and resid 63   and name HB2 ))
      4.800     2.900     1.200 peak   532 spectrum    1 weight  0.10000E+01 volume  0.41052E-03 ppm1      9.565 ppm2      2.130 CV     1
 ASSI {  533}
   (( segid "T22D" and resid 82   and name HN  ))
   (( segid "T22D" and resid 64   and name HA  ))
      3.100     1.200     1.200 peak   533 spectrum    1 weight  0.10000E+01 volume  0.23642E-02 ppm1      9.565 ppm2      5.230 CV     1
 ASSI {  535}
   (( segid "T22D" and resid 82   and name HN  ))
   (( segid "T22D" and resid 81   and name HA  ))
      2.200     0.600     0.600 peak   535 spectrum    1 weight  0.10000E+01 volume  0.77264E-02 ppm1      9.567 ppm2      4.774 CV     1
 ASSI {  536}
   (( segid "T22D" and resid 82   and name HN  ))
   (  segid "T22D" and resid 81   and name HG1%)
      2.800     1.000     1.000 peak   536 spectrum    1 weight  0.10000E+01 volume  0.23789E-02 ppm1      9.567 ppm2      0.527 CV     1
 ASSI {  537}
   (( segid "T22D" and resid 82   and name HN  ))
   (  segid "T22D" and resid 81   and name HG2%)
      4.300     2.300     1.700 peak   537 spectrum    1 weight  0.10000E+01 volume  0.10878E-02 ppm1      9.563 ppm2      0.293 CV     1
 ASSI {  538}
   (( segid "T22D" and resid 82   and name HN  ))
   (( segid "T22D" and resid 82   and name HB  ))
      2.800     1.000     1.000 peak   538 spectrum    1 weight  0.10000E+01 volume  0.22240E-02 ppm1      9.568 ppm2      3.905 CV     1
 ASSI {  539}
   (( segid "T22D" and resid 82   and name HN  ))
   (  segid "T22D" and resid 82   and name HG2%)
      4.100     2.100     1.900 peak   539 spectrum    1 weight  0.10000E+01 volume  0.92714E-03 ppm1      9.563 ppm2      1.123 CV     1
 ASSI {  540}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 83   and name HG2 ))
      2.500     0.800     0.800 peak   540 spectrum    1 weight  0.10000E+01 volume  0.34364E-02 ppm1      8.447 ppm2      2.542 CV     1
 OR {  540}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 83   and name HB1 ))
 ASSI {  541}
   (( segid "T22D" and resid 83   and name HN  ))
   (  segid "T22D" and resid 82   and name HG2%)
      2.800     1.000     1.000 peak   541 spectrum    1 weight  0.10000E+01 volume  0.31738E-02 ppm1      8.445 ppm2      1.138 CV     1
 ASSI {  542}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 83   and name HG1 ))
      4.200     2.200     1.800 peak   542 spectrum    1 weight  0.10000E+01 volume  0.87610E-03 ppm1      8.446 ppm2      2.198 CV     1
 ASSI {  546}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 83   and name HA  ))
      2.200     0.600     0.600 peak   546 spectrum    1 weight  0.10000E+01 volume  0.59979E-02 ppm1      8.346 ppm2      5.066 CV     1
 ASSI {  547}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 83   and name HB1 ))
      2.400     0.700     0.700 peak   547 spectrum    1 weight  0.10000E+01 volume  0.38749E-02 ppm1      8.344 ppm2      2.547 CV     1
 ASSI {  548}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 83   and name HB2 ))
      4.100     2.100     1.900 peak   548 spectrum    1 weight  0.10000E+01 volume  0.68732E-03 ppm1      8.347 ppm2      2.046 CV     1
 ASSI {  549}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 83   and name HG1 ))
      4.400     2.400     1.600 peak   549 spectrum    1 weight  0.10000E+01 volume  0.69207E-03 ppm1      8.340 ppm2      2.210 CV     1
 ASSI {  550}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 84   and name HA  ))
      2.400     0.700     0.700 peak   550 spectrum    1 weight  0.10000E+01 volume  0.64775E-02 ppm1      8.346 ppm2      4.097 CV     1
 ASSI {  551}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 84   and name HB1 ))
      2.400     0.700     0.700 peak   551 spectrum    1 weight  0.10000E+01 volume  0.71855E-02 ppm1      8.345 ppm2      1.712 CV     1
 ASSI {  552}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 84   and name HB2 ))
      2.200     0.600     0.600 peak   552 spectrum    1 weight  0.10000E+01 volume  0.55071E-02 ppm1      8.345 ppm2      1.899 CV     1
 ASSI {  553}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 84   and name HG1 ))
      3.500     1.600     1.600 peak   553 spectrum    1 weight  0.10000E+01 volume  0.29700E-02 ppm1      8.343 ppm2      1.364 CV     1
 OR {  553}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 84   and name HG2 ))
 ASSI {  558}
   (( segid "T22D" and resid 85   and name HN  ))
   (  segid "T22D" and resid 35   and name HG2%)
      3.200     1.300     1.300 peak   558 spectrum    1 weight  0.10000E+01 volume  0.15267E-02 ppm1      7.729 ppm2      0.794 CV     1
 ASSI {  560}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 83   and name HB2 ))
      3.700     1.700     1.700 peak   560 spectrum    1 weight  0.10000E+01 volume  0.50542E-03 ppm1      7.739 ppm2      1.996 CV     1
 ASSI {  561}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 83   and name HG1 ))
      4.600     2.700     1.400 peak   561 spectrum    1 weight  0.10000E+01 volume  0.52110E-03 ppm1      7.733 ppm2      2.214 CV     1
 ASSI {  562}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 84   and name HN  ))
      2.500     0.800     0.800 peak   562 spectrum    1 weight  0.10000E+01 volume  0.41881E-02 ppm1      7.731 ppm2      8.320 CV     1
 ASSI {  563}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 84   and name HB2 ))
      3.100     1.200     1.200 peak   563 spectrum    1 weight  0.10000E+01 volume  0.39358E-02 ppm1      7.732 ppm2      1.902 CV     1
 ASSI {  564}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 84   and name HD2 ))
      2.400     2.400     3.600 peak   564 spectrum    1 weight  0.10000E+01 volume  0.23525E-02 ppm1      7.736 ppm2      1.715 CV     1
 OR {  564}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 84   and name HD1 ))
 ASSI {  565}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 84   and name HG2 ))
      4.300     2.300     1.700 peak   565 spectrum    1 weight  0.10000E+01 volume  0.52310E-03 ppm1      7.730 ppm2      1.370 CV     1
 OR {  565}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 84   and name HG1 ))
 ASSI {  566}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 85   and name HA  ))
      2.800     1.000     1.000 peak   566 spectrum    1 weight  0.10000E+01 volume  0.26721E-02 ppm1      7.733 ppm2      4.884 CV     1
 ASSI {  567}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 85   and name HB1 ))
      3.300     1.400     1.400 peak   567 spectrum    1 weight  0.10000E+01 volume  0.10495E-02 ppm1      7.730 ppm2      2.961 CV     1
 ASSI {  568}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 85   and name HB2 ))
      3.200     1.300     1.300 peak   568 spectrum    1 weight  0.10000E+01 volume  0.15696E-02 ppm1      7.736 ppm2      2.733 CV     1
 ASSI {  569}
   (( segid "T22D" and resid 86   and name HN  ))
   (  segid "T22D" and resid 35   and name HG2%)
      3.400     1.400     1.400 peak   569 spectrum    1 weight  0.10000E+01 volume  0.12060E-02 ppm1      8.755 ppm2      0.800 CV     1
 ASSI {  570}
   (( segid "T22D" and resid 86   and name HN  ))
   (( segid "T22D" and resid 85   and name HA  ))
      2.500     0.800     0.800 peak   570 spectrum    1 weight  0.10000E+01 volume  0.38474E-02 ppm1      8.757 ppm2      4.900 CV     1
 ASSI {  571}
   (( segid "T22D" and resid 86   and name HN  ))
   (( segid "T22D" and resid 85   and name HB1 ))
      3.100     1.200     1.200 peak   571 spectrum    1 weight  0.10000E+01 volume  0.25292E-02 ppm1      8.758 ppm2      2.968 CV     1
 ASSI {  572}
   (( segid "T22D" and resid 86   and name HN  ))
   (( segid "T22D" and resid 85   and name HB2 ))
      3.600     1.600     1.600 peak   572 spectrum    1 weight  0.10000E+01 volume  0.16017E-02 ppm1      8.758 ppm2      2.738 CV     1
 ASSI {  573}
   (( segid "T22D" and resid 86   and name HN  ))
   (( segid "T22D" and resid 86   and name HA  ))
      3.100     1.200     1.200 peak   573 spectrum    1 weight  0.10000E+01 volume  0.14068E-02 ppm1      8.755 ppm2      4.044 CV     1
 ASSI {  574}
   (( segid "T22D" and resid 86   and name HN  ))
   (( segid "T22D" and resid 86   and name HB1 ))
      2.600     0.800     0.800 peak   574 spectrum    1 weight  0.10000E+01 volume  0.33472E-02 ppm1      8.758 ppm2      1.863 CV     1
 OR {  574}
   (( segid "T22D" and resid 86   and name HN  ))
   (( segid "T22D" and resid 86   and name HB2 ))
 ASSI {  575}
   (( segid "T22D" and resid 86   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
      4.400     2.400     1.600 peak   575 spectrum    1 weight  0.10000E+01 volume  0.47744E-03 ppm1      8.761 ppm2      1.608 CV     1
 ASSI {  577}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 89   and name HN  ))
      3.900     1.900     1.900 peak   577 spectrum    1 weight  0.10000E+01 volume  0.60880E-03 ppm1      8.687 ppm2      7.530 CV     1
 ASSI {  578}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 86   and name HG1 ))
      4.100     2.100     1.900 peak   578 spectrum    1 weight  0.10000E+01 volume  0.84866E-03 ppm1      8.692 ppm2      1.694 CV     1
 ASSI {  580}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 86   and name HB1 ))
      2.700     0.900     0.900 peak   580 spectrum    1 weight  0.10000E+01 volume  0.33521E-02 ppm1      8.681 ppm2      1.842 CV     1
 OR {  580}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 86   and name HB2 ))
 ASSI {  581}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 86   and name HD1 ))
      3.300     1.400     1.400 peak   581 spectrum    1 weight  0.10000E+01 volume  0.13829E-02 ppm1      8.679 ppm2      2.964 CV     1
 ASSI {  582}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 87   and name HA  ))
      2.600     0.900     0.900 peak   582 spectrum    1 weight  0.10000E+01 volume  0.44082E-02 ppm1      8.681 ppm2      4.234 CV     1
 ASSI {  583}
   (( segid "T22D" and resid 87   and name HN  ))
   (  segid "T22D" and resid 87   and name HB% )
      2.200     0.600     0.600 peak   583 spectrum    1 weight  0.10000E+01 volume  0.12124E-01 ppm1      8.680 ppm2      1.511 CV     1
 ASSI {  584}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 88   and name HN  ))
      2.600     0.900     0.900 peak   584 spectrum    1 weight  0.10000E+01 volume  0.35723E-02 ppm1      8.681 ppm2      8.329 CV     1
 ASSI {  585}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 86   and name HB1 ))
      3.300     1.400     1.400 peak   585 spectrum    1 weight  0.10000E+01 volume  0.88248E-03 ppm1      8.347 ppm2      1.875 CV     1
 OR {  585}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 86   and name HG2 ))
 OR {  585}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 86   and name HB2 ))
 ASSI {  587}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 85   and name HB1 ))
      3.600     1.600     1.600 peak   587 spectrum    1 weight  0.10000E+01 volume  0.51297E-03 ppm1      8.349 ppm2      2.973 CV     1
 ASSI {  588}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 85   and name HN  ))
      4.000     2.000     2.000 peak   588 spectrum    1 weight  0.10000E+01 volume  0.46956E-03 ppm1      8.352 ppm2      7.726 CV     1
 ASSI {  591}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 87   and name HA  ))
      3.100     1.200     1.200 peak   591 spectrum    1 weight  0.10000E+01 volume  0.20966E-02 ppm1      8.356 ppm2      4.286 CV     1
 ASSI {  592}
   (( segid "T22D" and resid 88   and name HN  ))
   (  segid "T22D" and resid 87   and name HB% )
      2.500     0.800     0.800 peak   592 spectrum    1 weight  0.10000E+01 volume  0.65988E-02 ppm1      8.353 ppm2      1.520 CV     1
 ASSI {  593}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 88   and name HA  ))
      2.900     1.100     1.100 peak   593 spectrum    1 weight  0.10000E+01 volume  0.19821E-02 ppm1      8.347 ppm2      4.338 CV     1
 ASSI {  594}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 88   and name HB1 ))
      3.200     1.300     1.300 peak   594 spectrum    1 weight  0.10000E+01 volume  0.20005E-02 ppm1      8.356 ppm2      3.859 CV     1
 ASSI {  595}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 88   and name HB2 ))
      2.500     0.800     0.800 peak   595 spectrum    1 weight  0.10000E+01 volume  0.42531E-02 ppm1      8.355 ppm2      4.054 CV     1
 ASSI {  596}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 89   and name HN  ))
      2.500     0.800     0.800 peak   596 spectrum    1 weight  0.10000E+01 volume  0.42710E-02 ppm1      8.355 ppm2      7.545 CV     1
 ASSI {  598}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 83   and name HB1 ))
      3.600     1.600     1.600 peak   598 spectrum    1 weight  0.10000E+01 volume  0.12126E-02 ppm1      7.570 ppm2      2.549 CV     1
 OR {  598}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 83   and name HG2 ))
 ASSI {  605}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 83   and name HB2 ))
      3.600     1.600     1.600 peak   605 spectrum    1 weight  0.10000E+01 volume  0.50446E-03 ppm1      7.574 ppm2      2.025 CV     1
 ASSI {  606}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 85   and name HN  ))
      3.500     1.500     1.500 peak   606 spectrum    1 weight  0.10000E+01 volume  0.10297E-02 ppm1      7.570 ppm2      7.704 CV     1
 ASSI {  608}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 88   and name HB1 ))
      3.700     1.700     1.700 peak   608 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      7.571 ppm2      3.864 CV     1
 ASSI {  609}
   (( segid "T22D" and resid 89   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
      2.200     0.600     0.600 peak   609 spectrum    1 weight  0.10000E+01 volume  0.81926E-02 ppm1      7.572 ppm2      1.565 CV     1
 ASSI {  610}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 90   and name HN  ))
      2.500     0.800     0.800 peak   610 spectrum    1 weight  0.10000E+01 volume  0.43248E-02 ppm1      7.571 ppm2      8.529 CV     1
 ASSI {  613}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 87   and name HA  ))
      2.900     1.000     1.000 peak   613 spectrum    1 weight  0.10000E+01 volume  0.25810E-02 ppm1      8.554 ppm2      4.231 CV     1
 ASSI {  615}
   (( segid "T22D" and resid 90   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
      2.400     0.700     0.700 peak   615 spectrum    1 weight  0.10000E+01 volume  0.47748E-02 ppm1      8.556 ppm2      1.569 CV     1
 ASSI {  616}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 90   and name HB2 ))
      2.300     0.700     0.700 peak   616 spectrum    1 weight  0.10000E+01 volume  0.84191E-02 ppm1      8.557 ppm2      2.218 CV     1
 OR {  616}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 90   and name HB1 ))
 OR {  616}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 90   and name HG1 ))
 ASSI {  617}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 90   and name HA  ))
      2.500     0.800     0.800 peak   617 spectrum    1 weight  0.10000E+01 volume  0.49070E-02 ppm1      8.556 ppm2      4.027 CV     1
 ASSI {  619}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 90   and name HG2 ))
      3.300     1.400     1.400 peak   619 spectrum    1 weight  0.10000E+01 volume  0.46889E-02 ppm1      8.557 ppm2      2.540 CV     1
 ASSI {  620}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 91   and name HN  ))
      2.500     0.800     0.800 peak   620 spectrum    1 weight  0.10000E+01 volume  0.37529E-02 ppm1      8.556 ppm2      7.872 CV     1
 ASSI {  621}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 91   and name HG1 ))
      3.300     1.300     1.300 peak   621 spectrum    1 weight  0.10000E+01 volume  0.25395E-02 ppm1      7.894 ppm2      1.727 CV     1
 ASSI {  622}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 91   and name HA  ))
      2.600     0.800     0.800 peak   622 spectrum    1 weight  0.10000E+01 volume  0.42256E-02 ppm1      7.891 ppm2      3.974 CV     1
 ASSI {  623}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 89   and name HN  ))
      4.100     2.100     1.900 peak   623 spectrum    1 weight  0.10000E+01 volume  0.44454E-03 ppm1      7.904 ppm2      7.543 CV     1
 ASSI {  624}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 90   and name HG2 ))
      4.000     2.000     2.000 peak   624 spectrum    1 weight  0.10000E+01 volume  0.67835E-03 ppm1      7.893 ppm2      2.537 CV     1
 ASSI {  627}
   (( segid "T22D" and resid 91   and name HN  ))
   (  segid "T22D" and resid 92   and name HB% )
      4.600     2.600     1.400 peak   627 spectrum    1 weight  0.10000E+01 volume  0.51388E-03 ppm1      7.887 ppm2      1.416 CV     1
 ASSI {  628}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 88   and name HA  ))
      3.300     1.400     1.400 peak   628 spectrum    1 weight  0.10000E+01 volume  0.10218E-02 ppm1      7.893 ppm2      4.306 CV     1
 ASSI {  631}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 91   and name HB1 ))
      3.200     1.300     1.300 peak   631 spectrum    1 weight  0.10000E+01 volume  0.42735E-02 ppm1      7.890 ppm2      2.345 CV     1
 ASSI {  632}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 91   and name HB2 ))
      2.100     0.600     0.600 peak   632 spectrum    1 weight  0.10000E+01 volume  0.93336E-02 ppm1      7.892 ppm2      2.063 CV     1
 ASSI {  634}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 58   and name HB2 ))
      3.800     1.800     1.800 peak   634 spectrum    1 weight  0.10000E+01 volume  0.70542E-03 ppm1      7.923 ppm2      3.643 CV     1
 ASSI {  635}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 91   and name HG1 ))
      4.400     2.400     1.600 peak   635 spectrum    1 weight  0.10000E+01 volume  0.82619E-03 ppm1      7.917 ppm2      1.739 CV     1
 ASSI {  638}
   (( segid "T22D" and resid 92   and name HN  ))
   (  segid "T22D" and resid 58   and name HE% )
      4.100     2.100     1.900 peak   638 spectrum    1 weight  0.10000E+01 volume  0.74095E-03 ppm1      7.910 ppm2      6.960 CV     1
 ASSI {  639}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 89   and name HN  ))
      3.800     1.800     1.800 peak   639 spectrum    1 weight  0.10000E+01 volume  0.55805E-03 ppm1      7.916 ppm2      7.546 CV     1
 ASSI {  641}
   (( segid "T22D" and resid 92   and name HN  ))
   (  segid "T22D" and resid 37   and name HD1%)
      4.100     2.200     1.900 peak   641 spectrum    1 weight  0.10000E+01 volume  0.59971E-03 ppm1      7.917 ppm2      0.695 CV     1
 ASSI {  642}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 89   and name HA  ))
      3.000     1.100     1.100 peak   642 spectrum    1 weight  0.10000E+01 volume  0.12657E-02 ppm1      7.919 ppm2      4.076 CV     1
 ASSI {  643}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 90   and name HN  ))
      3.900     1.900     1.900 peak   643 spectrum    1 weight  0.10000E+01 volume  0.60838E-03 ppm1      7.919 ppm2      8.540 CV     1
 ASSI {  644}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 91   and name HA  ))
      3.400     1.400     1.400 peak   644 spectrum    1 weight  0.10000E+01 volume  0.12042E-02 ppm1      7.919 ppm2      3.993 CV     1
 ASSI {  645}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 91   and name HB1 ))
      3.500     1.500     1.500 peak   645 spectrum    1 weight  0.10000E+01 volume  0.23516E-02 ppm1      7.922 ppm2      2.320 CV     1
 ASSI {  646}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 91   and name HB2 ))
      2.600     0.900     0.900 peak   646 spectrum    1 weight  0.10000E+01 volume  0.20724E-02 ppm1      7.922 ppm2      2.020 CV     1
 ASSI {  647}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 92   and name HA  ))
      2.700     0.900     0.900 peak   647 spectrum    1 weight  0.10000E+01 volume  0.32135E-02 ppm1      7.919 ppm2      1.937 CV     1
 ASSI {  648}
   (( segid "T22D" and resid 92   and name HN  ))
   (  segid "T22D" and resid 92   and name HB% )
      2.200     0.600     0.600 peak   648 spectrum    1 weight  0.10000E+01 volume  0.88315E-02 ppm1      7.920 ppm2      1.401 CV     1
 ASSI {  649}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 93   and name HN  ))
      2.600     0.900     0.900 peak   649 spectrum    1 weight  0.10000E+01 volume  0.31807E-02 ppm1      7.919 ppm2      7.152 CV     1
 ASSI {  652}
   (( segid "T22D" and resid 93   and name HN  ))
   (  segid "T22D" and resid 37   and name HD1%)
      3.700     1.700     1.700 peak   652 spectrum    1 weight  0.10000E+01 volume  0.59787E-03 ppm1      7.179 ppm2      0.666 CV     1
 ASSI {  653}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 90   and name HA  ))
      3.100     1.200     1.200 peak   653 spectrum    1 weight  0.10000E+01 volume  0.16057E-02 ppm1      7.176 ppm2      4.033 CV     1
 ASSI {  655}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 92   and name HA  ))
      3.500     1.500     1.500 peak   655 spectrum    1 weight  0.10000E+01 volume  0.10216E-02 ppm1      7.180 ppm2      1.952 CV     1
 ASSI {  656}
   (( segid "T22D" and resid 93   and name HN  ))
   (  segid "T22D" and resid 92   and name HB% )
      2.900     1.100     1.100 peak   656 spectrum    1 weight  0.10000E+01 volume  0.20324E-02 ppm1      7.175 ppm2      1.400 CV     1
 ASSI {  657}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 93   and name HA  ))
      2.800     1.000     1.000 peak   657 spectrum    1 weight  0.10000E+01 volume  0.24787E-02 ppm1      7.176 ppm2      4.237 CV     1
 ASSI {  658}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 93   and name HB1 ))
      3.500     1.600     1.600 peak   658 spectrum    1 weight  0.10000E+01 volume  0.26084E-02 ppm1      7.177 ppm2      3.035 CV     1
 ASSI {  659}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 93   and name HB2 ))
      2.400     0.700     0.700 peak   659 spectrum    1 weight  0.10000E+01 volume  0.39687E-02 ppm1      7.176 ppm2      2.808 CV     1
 ASSI {  660}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 94   and name HN  ))
      2.500     0.800     0.800 peak   660 spectrum    1 weight  0.10000E+01 volume  0.40437E-02 ppm1      7.177 ppm2      7.002 CV     1
 ASSI {  661}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 94   and name HB1 ))
      2.300     0.700     0.700 peak   661 spectrum    1 weight  0.10000E+01 volume  0.70363E-02 ppm1      7.041 ppm2      1.828 CV     1
 ASSI {  662}
   (( segid "T22D" and resid 94   and name HN  ))
   (  segid "T22D" and resid 92   and name HB% )
      3.000     3.000     3.000 peak   662 spectrum    1 weight  0.10000E+01 volume  0.58519E-03 ppm1      7.036 ppm2      1.384 CV     1
 ASSI {  663}
   (( segid "T22D" and resid 114  and name HN  ))
   (( segid "T22D" and resid 112  and name HA  ))
      3.800     1.800     1.800 peak   663 spectrum    1 weight  0.10000E+01 volume  0.56234E-03 ppm1      7.044 ppm2      3.678 CV     1
 ASSI {  664}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 95   and name HB1 ))
      4.800     2.800     1.200 peak   664 spectrum    1 weight  0.10000E+01 volume  0.41359E-03 ppm1      7.031 ppm2      2.506 CV     1
 ASSI {  666}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 93   and name HA  ))
      3.200     1.200     1.200 peak   666 spectrum    1 weight  0.10000E+01 volume  0.14666E-02 ppm1      7.040 ppm2      4.216 CV     1
 ASSI {  667}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 93   and name HB1 ))
      4.000     2.100     2.000 peak   667 spectrum    1 weight  0.10000E+01 volume  0.69424E-03 ppm1      7.035 ppm2      3.040 CV     1
 ASSI {  668}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 93   and name HB2 ))
      3.300     1.400     1.400 peak   668 spectrum    1 weight  0.10000E+01 volume  0.93590E-03 ppm1      7.041 ppm2      2.803 CV     1
 ASSI {  669}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 94   and name HA  ))
      2.500     0.800     0.800 peak   669 spectrum    1 weight  0.10000E+01 volume  0.54245E-02 ppm1      7.041 ppm2      3.884 CV     1
 ASSI {  670}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 94   and name HB2 ))
      2.300     0.600     0.600 peak   670 spectrum    1 weight  0.10000E+01 volume  0.76693E-02 ppm1      7.041 ppm2      1.892 CV     1
 ASSI {  671}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 94   and name HG2 ))
      3.700     1.700     1.700 peak   671 spectrum    1 weight  0.10000E+01 volume  0.23806E-02 ppm1      7.038 ppm2      1.562 CV     1
 OR {  671}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 94   and name HG1 ))
 ASSI {  672}
   (( segid "T22D" and resid 94   and name HN  ))
   (( segid "T22D" and resid 95   and name HN  ))
      2.700     0.900     0.900 peak   672 spectrum    1 weight  0.10000E+01 volume  0.27124E-02 ppm1      7.038 ppm2      7.773 CV     1
 ASSI {  673}
   (( segid "T22D" and resid 95   and name HN  ))
   (( segid "T22D" and resid 96   and name HD2 ))
      4.500     2.600     1.500 peak   673 spectrum    1 weight  0.10000E+01 volume  0.49074E-03 ppm1      7.798 ppm2      4.081 CV     1
 ASSI {  675}
   (( segid "T22D" and resid 95   and name HN  ))
   (( segid "T22D" and resid 94   and name HA  ))
      3.300     1.300     1.300 peak   675 spectrum    1 weight  0.10000E+01 volume  0.16040E-02 ppm1      7.798 ppm2      3.890 CV     1
 ASSI {  676}
   (( segid "T22D" and resid 95   and name HN  ))
   (( segid "T22D" and resid 94   and name HB1 ))
      2.600     0.800     0.800 peak   676 spectrum    1 weight  0.10000E+01 volume  0.49162E-02 ppm1      7.796 ppm2      1.828 CV     1
 OR {  676}
   (( segid "T22D" and resid 95   and name HN  ))
   (( segid "T22D" and resid 94   and name HB2 ))
 ASSI {  677}
   (( segid "T22D" and resid 95   and name HN  ))
   (( segid "T22D" and resid 94   and name HG1 ))
      3.800     1.800     1.800 peak   677 spectrum    1 weight  0.10000E+01 volume  0.11118E-02 ppm1      7.795 ppm2      1.534 CV     1
 ASSI {  678}
   (( segid "T22D" and resid 95   and name HN  ))
   (( segid "T22D" and resid 95   and name HA  ))
      3.000     1.100     1.100 peak   678 spectrum    1 weight  0.10000E+01 volume  0.18583E-02 ppm1      7.798 ppm2      5.131 CV     1
 ASSI {  679}
   (( segid "T22D" and resid 95   and name HN  ))
   (( segid "T22D" and resid 95   and name HB1 ))
      2.600     0.800     0.800 peak   679 spectrum    1 weight  0.10000E+01 volume  0.41764E-02 ppm1      7.798 ppm2      2.474 CV     1
 ASSI {  680}
   (( segid "T22D" and resid 95   and name HN  ))
   (( segid "T22D" and resid 95   and name HB2 ))
      2.700     0.900     0.900 peak   680 spectrum    1 weight  0.10000E+01 volume  0.53870E-02 ppm1      7.797 ppm2      2.813 CV     1
 ASSI {  682}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 95   and name HA  ))
      3.800     1.800     1.800 peak   682 spectrum    1 weight  0.10000E+01 volume  0.96301E-03 ppm1      8.177 ppm2      5.141 CV     1
 ASSI {  683}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 96   and name HD1 ))
      3.600     1.600     1.600 peak   683 spectrum    1 weight  0.10000E+01 volume  0.21102E-02 ppm1      8.171 ppm2      3.981 CV     1
 ASSI {  684}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 96   and name HD2 ))
      2.900     1.100     1.100 peak   684 spectrum    1 weight  0.10000E+01 volume  0.19524E-02 ppm1      8.175 ppm2      4.068 CV     1
 ASSI {  685}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 96   and name HG2 ))
      2.700     0.900     0.900 peak   685 spectrum    1 weight  0.10000E+01 volume  0.33141E-02 ppm1      8.174 ppm2      2.087 CV     1
 OR {  685}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 96   and name HG1 ))
 ASSI {  686}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 97   and name HA  ))
      2.800     1.000     1.000 peak   686 spectrum    1 weight  0.10000E+01 volume  0.20560E-02 ppm1      8.175 ppm2      6.015 CV     1
 ASSI {  687}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 97   and name HB1 ))
      3.100     1.200     1.200 peak   687 spectrum    1 weight  0.10000E+01 volume  0.44295E-02 ppm1      8.176 ppm2      2.435 CV     1
 ASSI {  688}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 97   and name HB2 ))
      2.800     1.000     1.000 peak   688 spectrum    1 weight  0.10000E+01 volume  0.22634E-02 ppm1      8.179 ppm2      2.803 CV     1
 ASSI {  690}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 98   and name HD1 ))
      2.700     0.900     0.900 peak   690 spectrum    1 weight  0.10000E+01 volume  0.19113E-02 ppm1      8.175 ppm2      3.570 CV     1
 ASSI {  691}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 98   and name HD2 ))
      4.200     2.200     1.800 peak   691 spectrum    1 weight  0.10000E+01 volume  0.81409E-03 ppm1      8.179 ppm2      3.175 CV     1
 ASSI {  696}
   (( segid "T22D" and resid 97   and name HD21))
   (( segid "T22D" and resid 97   and name HA  ))
      2.400     0.700     0.700 peak   696 spectrum    1 weight  0.10000E+01 volume  0.25611E-02 ppm1      8.152 ppm2      6.029 CV     1
 ASSI {  697}
   (( segid "T22D" and resid 97   and name HD22))
   (( segid "T22D" and resid 97   and name HA  ))
      4.400     2.400     1.600 peak   697 spectrum    1 weight  0.10000E+01 volume  0.17926E-02 ppm1      6.905 ppm2      6.029 CV     1
 ASSI {  698}
   (( segid "T22D" and resid 97   and name HD21))
   (( segid "T22D" and resid 97   and name HB1 ))
      3.300     1.400     1.400 peak   698 spectrum    1 weight  0.10000E+01 volume  0.11757E-02 ppm1      8.148 ppm2      2.426 CV     1
 ASSI {  699}
   (( segid "T22D" and resid 97   and name HD22))
   (( segid "T22D" and resid 97   and name HB1 ))
      4.300     2.300     1.700 peak   699 spectrum    1 weight  0.10000E+01 volume  0.69900E-03 ppm1      6.903 ppm2      2.426 CV     1
 ASSI {  700}
   (( segid "T22D" and resid 97   and name HD21))
   (( segid "T22D" and resid 97   and name HB2 ))
      3.200     1.300     1.300 peak   700 spectrum    1 weight  0.10000E+01 volume  0.23074E-02 ppm1      8.152 ppm2      2.792 CV     1
 ASSI {  701}
   (( segid "T22D" and resid 97   and name HD22))
   (( segid "T22D" and resid 97   and name HB2 ))
      3.900     1.900     1.900 peak   701 spectrum    1 weight  0.10000E+01 volume  0.14115E-02 ppm1      6.905 ppm2      2.804 CV     1
 ASSI {  703}
   (( segid "T22D" and resid 97   and name HD21))
   (( segid "T22D" and resid 98   and name HD2 ))
      4.600     2.700     1.400 peak   703 spectrum    1 weight  0.10000E+01 volume  0.42740E-03 ppm1      8.147 ppm2      3.132 CV     1
 ASSI {  705}
   (( segid "T22D" and resid 97   and name HD22))
   (( segid "T22D" and resid 106  and name HA  ))
      3.500     1.600     1.600 peak   705 spectrum    1 weight  0.10000E+01 volume  0.16392E-02 ppm1      6.905 ppm2      5.408 CV     1
 ASSI {  706}
   (( segid "T22D" and resid 99   and name HN  ))
   (( segid "T22D" and resid 98   and name HB2 ))
      3.100     1.200     1.200 peak   706 spectrum    1 weight  0.10000E+01 volume  0.19724E-02 ppm1      8.085 ppm2      1.586 CV     1
 ASSI {  707}
   (( segid "T22D" and resid 99   and name HN  ))
   (( segid "T22D" and resid 98   and name HA  ))
      2.200     0.600     0.600 peak   707 spectrum    1 weight  0.10000E+01 volume  0.87481E-02 ppm1      8.088 ppm2      4.460 CV     1
 ASSI {  708}
   (( segid "T22D" and resid 99   and name HN  ))
   (( segid "T22D" and resid 98   and name HB1 ))
      4.000     2.000     2.000 peak   708 spectrum    1 weight  0.10000E+01 volume  0.14064E-02 ppm1      8.087 ppm2      2.121 CV     1
 ASSI {  709}
   (( segid "T22D" and resid 99   and name HN  ))
   (( segid "T22D" and resid 99   and name HA  ))
      2.700     0.900     0.900 peak   709 spectrum    1 weight  0.10000E+01 volume  0.22881E-02 ppm1      8.085 ppm2      4.143 CV     1
 ASSI {  710}
   (( segid "T22D" and resid 99   and name HN  ))
   (( segid "T22D" and resid 99   and name HB  ))
      2.300     0.700     0.700 peak   710 spectrum    1 weight  0.10000E+01 volume  0.68945E-02 ppm1      8.086 ppm2      1.783 CV     1
 ASSI {  711}
   (( segid "T22D" and resid 99   and name HN  ))
   (  segid "T22D" and resid 99   and name HD1%)
      4.000     2.000     2.000 peak   711 spectrum    1 weight  0.10000E+01 volume  0.93469E-03 ppm1      8.085 ppm2      0.718 CV     1
 ASSI {  712}
   (( segid "T22D" and resid 99   and name HN  ))
   (( segid "T22D" and resid 99   and name HG11))
      3.700     1.700     1.700 peak   712 spectrum    1 weight  0.10000E+01 volume  0.29139E-02 ppm1      8.085 ppm2      1.479 CV     1
 ASSI {  713}
   (( segid "T22D" and resid 99   and name HN  ))
   (( segid "T22D" and resid 99   and name HG12))
      2.600     0.800     0.800 peak   713 spectrum    1 weight  0.10000E+01 volume  0.23107E-02 ppm1      8.088 ppm2      1.116 CV     1
 ASSI {  714}
   (( segid "T22D" and resid 99   and name HN  ))
   (  segid "T22D" and resid 99   and name HG2%)
      4.000     2.000     2.000 peak   714 spectrum    1 weight  0.10000E+01 volume  0.13552E-02 ppm1      8.084 ppm2      0.531 CV     1
 ASSI {  715}
   (( segid "T22D" and resid 100  and name HN  ))
   (  segid "T22D" and resid 99   and name HG2%)
      3.000     1.200     1.200 peak   715 spectrum    1 weight  0.10000E+01 volume  0.24532E-02 ppm1      8.356 ppm2      0.551 CV     1
 ASSI {  717}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 103  and name HB2 ))
      3.800     1.800     1.800 peak   717 spectrum    1 weight  0.10000E+01 volume  0.68753E-03 ppm1      8.353 ppm2      1.499 CV     1
 ASSI {  721}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 99   and name HN  ))
      4.800     2.900     1.200 peak   721 spectrum    1 weight  0.10000E+01 volume  0.28335E-03 ppm1      8.358 ppm2      8.106 CV     1
 ASSI {  722}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 99   and name HA  ))
      2.100     0.500     0.500 peak   722 spectrum    1 weight  0.10000E+01 volume  0.97606E-02 ppm1      8.356 ppm2      4.148 CV     1
 ASSI {  723}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 100  and name HA  ))
      3.100     1.200     1.200 peak   723 spectrum    1 weight  0.10000E+01 volume  0.12447E-02 ppm1      8.358 ppm2      3.785 CV     1
 ASSI {  724}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 100  and name HB  ))
      2.600     0.900     0.900 peak   724 spectrum    1 weight  0.10000E+01 volume  0.32376E-02 ppm1      8.354 ppm2      1.306 CV     1
 ASSI {  725}
   (( segid "T22D" and resid 100  and name HN  ))
   (  segid "T22D" and resid 100  and name HD1%)
      4.700     2.700     1.300 peak   725 spectrum    1 weight  0.10000E+01 volume  0.46751E-03 ppm1      8.361 ppm2      0.230 CV     1
 ASSI {  727}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 103  and name HN  ))
      3.000     1.100     1.100 peak   727 spectrum    1 weight  0.10000E+01 volume  0.16992E-02 ppm1      8.360 ppm2      7.764 CV     1
 ASSI {  730}
   (( segid "T22D" and resid 101  and name HN  ))
   (  segid "T22D" and resid 100  and name HD1%)
      3.200     3.200     2.800 peak   730 spectrum    1 weight  0.10000E+01 volume  0.40829E-03 ppm1      8.952 ppm2      0.247 CV     1
 ASSI {  731}
   (( segid "T22D" and resid 101  and name HN  ))
   (( segid "T22D" and resid 100  and name HN  ))
      4.200     2.200     1.800 peak   731 spectrum    1 weight  0.10000E+01 volume  0.54554E-03 ppm1      8.959 ppm2      8.327 CV     1
 ASSI {  732}
   (( segid "T22D" and resid 101  and name HN  ))
   (  segid "T22D" and resid 50   and name HG2%)
      4.000     2.000     2.000 peak   732 spectrum    1 weight  0.10000E+01 volume  0.48373E-03 ppm1      8.950 ppm2      1.278 CV     1
 ASSI {  733}
   (( segid "T22D" and resid 101  and name HN  ))
   (( segid "T22D" and resid 100  and name HA  ))
      2.100     0.600     0.600 peak   733 spectrum    1 weight  0.10000E+01 volume  0.89916E-02 ppm1      8.957 ppm2      3.765 CV     1
 ASSI {  734}
   (( segid "T22D" and resid 101  and name HN  ))
   (( segid "T22D" and resid 100  and name HG11))
      5.100     3.300     0.900 peak   734 spectrum    1 weight  0.10000E+01 volume  0.47973E-03 ppm1      8.957 ppm2      0.777 CV     1
 ASSI {  735}
   (( segid "T22D" and resid 101  and name HN  ))
   (  segid "T22D" and resid 100  and name HG2%)
      2.900     1.000     1.000 peak   735 spectrum    1 weight  0.10000E+01 volume  0.29843E-02 ppm1      8.957 ppm2      0.439 CV     1
 ASSI {  736}
   (( segid "T22D" and resid 101  and name HN  ))
   (( segid "T22D" and resid 101  and name HA  ))
      2.200     0.600     0.600 peak   736 spectrum    1 weight  0.10000E+01 volume  0.86480E-02 ppm1      8.956 ppm2      4.218 CV     1
 ASSI {  737}
   (( segid "T22D" and resid 101  and name HN  ))
   (( segid "T22D" and resid 101  and name HB1 ))
      3.900     1.900     1.900 peak   737 spectrum    1 weight  0.10000E+01 volume  0.96580E-03 ppm1      8.950 ppm2      2.227 CV     1
 ASSI {  738}
   (( segid "T22D" and resid 101  and name HN  ))
   (( segid "T22D" and resid 101  and name HB2 ))
      3.700     1.700     1.700 peak   738 spectrum    1 weight  0.10000E+01 volume  0.62189E-03 ppm1      8.958 ppm2      3.031 CV     1
 ASSI {  739}
   (( segid "T22D" and resid 101  and name HN  ))
   (( segid "T22D" and resid 102  and name HN  ))
      2.900     1.000     1.000 peak   739 spectrum    1 weight  0.10000E+01 volume  0.19072E-02 ppm1      8.955 ppm2      7.962 CV     1
 ASSI {  740}
   (( segid "T22D" and resid 101  and name HN  ))
   (( segid "T22D" and resid 102  and name HA1 ))
      4.800     2.900     1.200 peak   740 spectrum    1 weight  0.10000E+01 volume  0.57306E-03 ppm1      8.955 ppm2      3.418 CV     1
 ASSI {  742}
   (( segid "T22D" and resid 102  and name HN  ))
   (  segid "T22D" and resid 99   and name HD1%)
      4.500     2.500     1.500 peak   742 spectrum    1 weight  0.10000E+01 volume  0.92347E-03 ppm1      7.985 ppm2      0.738 CV     1
 ASSI {  743}
   (( segid "T22D" and resid 102  and name HN  ))
   (  segid "T22D" and resid 99   and name HG2%)
      2.600     0.800     0.800 peak   743 spectrum    1 weight  0.10000E+01 volume  0.41160E-02 ppm1      7.986 ppm2      0.553 CV     1
 ASSI {  744}
   (( segid "T22D" and resid 102  and name HN  ))
   (( segid "T22D" and resid 100  and name HN  ))
      3.800     1.800     1.800 peak   744 spectrum    1 weight  0.10000E+01 volume  0.56009E-03 ppm1      7.983 ppm2      8.327 CV     1
 ASSI {  745}
   (( segid "T22D" and resid 102  and name HN  ))
   (( segid "T22D" and resid 100  and name HA  ))
      4.100     2.100     1.900 peak   745 spectrum    1 weight  0.10000E+01 volume  0.56472E-03 ppm1      7.983 ppm2      3.796 CV     1
 ASSI {  747}
   (( segid "T22D" and resid 102  and name HN  ))
   (( segid "T22D" and resid 101  and name HA  ))
      2.600     0.900     0.900 peak   747 spectrum    1 weight  0.10000E+01 volume  0.45463E-02 ppm1      7.985 ppm2      4.211 CV     1
 ASSI {  748}
   (( segid "T22D" and resid 102  and name HN  ))
   (( segid "T22D" and resid 102  and name HA1 ))
      2.700     0.900     0.900 peak   748 spectrum    1 weight  0.10000E+01 volume  0.63398E-02 ppm1      7.985 ppm2      3.444 CV     1
 ASSI {  749}
   (( segid "T22D" and resid 102  and name HN  ))
   (( segid "T22D" and resid 102  and name HA2 ))
      2.400     0.700     0.700 peak   749 spectrum    1 weight  0.10000E+01 volume  0.47281E-02 ppm1      7.986 ppm2      4.145 CV     1
 ASSI {  750}
   (( segid "T22D" and resid 102  and name HN  ))
   (( segid "T22D" and resid 103  and name HN  ))
      2.800     1.000     1.000 peak   750 spectrum    1 weight  0.10000E+01 volume  0.24631E-02 ppm1      7.984 ppm2      7.787 CV     1
 ASSI {  751}
   (( segid "T22D" and resid 103  and name HN  ))
   (( segid "T22D" and resid 43   and name HG2 ))
      4.300     2.300     1.700 peak   751 spectrum    1 weight  0.10000E+01 volume  0.68594E-03 ppm1      7.796 ppm2      1.801 CV     1
 ASSI {  752}
   (( segid "T22D" and resid 103  and name HN  ))
   (  segid "T22D" and resid 99   and name HG2%)
      3.000     1.100     1.100 peak   752 spectrum    1 weight  0.10000E+01 volume  0.24668E-02 ppm1      7.798 ppm2      0.538 CV     1
 ASSI {  756}
   (( segid "T22D" and resid 103  and name HN  ))
   (( segid "T22D" and resid 102  and name HA1 ))
      3.500     1.500     1.500 peak   756 spectrum    1 weight  0.10000E+01 volume  0.10133E-02 ppm1      7.795 ppm2      3.434 CV     1
 ASSI {  757}
   (( segid "T22D" and resid 103  and name HN  ))
   (( segid "T22D" and resid 102  and name HA2 ))
      3.200     1.300     1.300 peak   757 spectrum    1 weight  0.10000E+01 volume  0.17324E-02 ppm1      7.798 ppm2      4.144 CV     1
 ASSI {  758}
   (( segid "T22D" and resid 103  and name HN  ))
   (( segid "T22D" and resid 103  and name HA  ))
      3.000     1.100     1.100 peak   758 spectrum    1 weight  0.10000E+01 volume  0.18025E-02 ppm1      7.798 ppm2      4.602 CV     1
 ASSI {  759}
   (( segid "T22D" and resid 103  and name HN  ))
   (( segid "T22D" and resid 103  and name HB1 ))
      2.800     1.000     1.000 peak   759 spectrum    1 weight  0.10000E+01 volume  0.19066E-02 ppm1      7.797 ppm2      1.665 CV     1
 ASSI {  760}
   (( segid "T22D" and resid 103  and name HN  ))
   (( segid "T22D" and resid 103  and name HB2 ))
      3.100     1.200     1.200 peak   760 spectrum    1 weight  0.10000E+01 volume  0.17110E-02 ppm1      7.797 ppm2      1.477 CV     1
 ASSI {  761}
   (( segid "T22D" and resid 103  and name HN  ))
   (  segid "T22D" and resid 105  and name HB% )
      4.200     2.200     1.800 peak   761 spectrum    1 weight  0.10000E+01 volume  0.43661E-03 ppm1      7.801 ppm2      1.287 CV     1
 ASSI {  765}
   (( segid "T22D" and resid 103  and name HE  ))
   (( segid "T22D" and resid 103  and name HB2 ))
      5.200     3.400     0.800 peak   765 spectrum    1 weight  0.10000E+01 volume  0.28868E-03 ppm1      6.730 ppm2      1.498 CV     1
 ASSI {  766}
   (( segid "T22D" and resid 103  and name HE  ))
   (( segid "T22D" and resid 103  and name HD1 ))
      3.700     1.700     1.700 peak   766 spectrum    1 weight  0.10000E+01 volume  0.50980E-03 ppm1      6.737 ppm2      2.740 CV     1
 ASSI {  767}
   (( segid "T22D" and resid 103  and name HE  ))
   (( segid "T22D" and resid 103  and name HD2 ))
      4.100     2.100     1.900 peak   767 spectrum    1 weight  0.10000E+01 volume  0.28606E-03 ppm1      6.737 ppm2      2.908 CV     1
 ASSI {  768}
   (( segid "T22D" and resid 103  and name HE  ))
   (( segid "T22D" and resid 103  and name HG2 ))
      3.800     1.800     1.800 peak   768 spectrum    1 weight  0.10000E+01 volume  0.32824E-03 ppm1      6.732 ppm2      1.772 CV     1
 ASSI {  769}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 103  and name HG1 ))
      3.300     1.400     1.400 peak   769 spectrum    1 weight  0.10000E+01 volume  0.73870E-03 ppm1      8.715 ppm2      1.454 CV     1
 ASSI {  770}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 100  and name HN  ))
      4.000     2.000     2.000 peak   770 spectrum    1 weight  0.10000E+01 volume  0.52147E-03 ppm1      8.714 ppm2      8.394 CV     1
 ASSI {  771}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 103  and name HA  ))
      2.800     0.900     0.900 peak   771 spectrum    1 weight  0.10000E+01 volume  0.21891E-02 ppm1      8.707 ppm2      4.597 CV     1
 ASSI {  773}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 104  and name HB1 ))
      2.900     1.100     1.100 peak   773 spectrum    1 weight  0.10000E+01 volume  0.22444E-02 ppm1      8.710 ppm2      1.633 CV     1
 OR {  773}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 104  and name HB2 ))
 OR {  773}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 104  and name HG1 ))
 OR {  773}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 104  and name HG2 ))
 OR {  773}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 104  and name HE1 ))
 OR {  773}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 104  and name HD2 ))
 ASSI {  774}
   (( segid "T22D" and resid 104  and name HN  ))
   (( segid "T22D" and resid 104  and name HA  ))
      3.400     1.400     1.400 peak   774 spectrum    1 weight  0.10000E+01 volume  0.68932E-03 ppm1      8.717 ppm2      4.135 CV     1
 ASSI {  778}
   (( segid "T22D" and resid 105  and name HN  ))
   (( segid "T22D" and resid 104  and name HG2 ))
      3.500     1.500     1.500 peak   778 spectrum    1 weight  0.10000E+01 volume  0.10617E-02 ppm1      8.995 ppm2      1.625 CV     1
 OR {  778}
   (( segid "T22D" and resid 105  and name HN  ))
   (( segid "T22D" and resid 104  and name HG1 ))
 OR {  778}
   (( segid "T22D" and resid 105  and name HN  ))
   (( segid "T22D" and resid 104  and name HB1 ))
 OR {  778}
   (( segid "T22D" and resid 105  and name HN  ))
   (( segid "T22D" and resid 104  and name HB2 ))
 ASSI {  779}
   (( segid "T22D" and resid 105  and name HN  ))
   (( segid "T22D" and resid 104  and name HA  ))
      2.300     0.600     0.600 peak   779 spectrum    1 weight  0.10000E+01 volume  0.58724E-02 ppm1      8.993 ppm2      4.134 CV     1
 ASSI {  780}
   (( segid "T22D" and resid 105  and name HN  ))
   (  segid "T22D" and resid 105  and name HB% )
      2.600     0.900     0.900 peak   780 spectrum    1 weight  0.10000E+01 volume  0.35664E-02 ppm1      8.993 ppm2      1.297 CV     1
 ASSI {  784}
   (( segid "T22D" and resid 106  and name HN  ))
   (  segid "T22D" and resid 39   and name HG1%)
      3.700     1.700     1.700 peak   784 spectrum    1 weight  0.10000E+01 volume  0.64587E-03 ppm1      8.218 ppm2      0.656 CV     1
 ASSI {  785}
   (( segid "T22D" and resid 106  and name HN  ))
   (( segid "T22D" and resid 40   and name HN  ))
      2.800     1.000     1.000 peak   785 spectrum    1 weight  0.10000E+01 volume  0.19931E-02 ppm1      8.213 ppm2      8.975 CV     1
 ASSI {  786}
   (( segid "T22D" and resid 106  and name HN  ))
   (( segid "T22D" and resid 105  and name HA  ))
      2.400     0.700     0.700 peak   786 spectrum    1 weight  0.10000E+01 volume  0.49612E-02 ppm1      8.216 ppm2      4.740 CV     1
 ASSI {  787}
   (( segid "T22D" and resid 106  and name HN  ))
   (  segid "T22D" and resid 105  and name HB% )
      2.500     0.800     0.800 peak   787 spectrum    1 weight  0.10000E+01 volume  0.56167E-02 ppm1      8.212 ppm2      1.293 CV     1
 ASSI {  788}
   (( segid "T22D" and resid 106  and name HN  ))
   (( segid "T22D" and resid 106  and name HA  ))
      3.000     1.200     1.200 peak   788 spectrum    1 weight  0.10000E+01 volume  0.15199E-02 ppm1      8.215 ppm2      5.417 CV     1
 ASSI {  790}
   (( segid "T22D" and resid 106  and name HN  ))
   (  segid "T22D" and resid 107  and name HG1%)
      4.600     2.600     1.400 peak   790 spectrum    1 weight  0.10000E+01 volume  0.43824E-03 ppm1      8.223 ppm2      1.051 CV     1
 ASSI {  793}
   (( segid "T22D" and resid 106  and name HD21))
   (( segid "3T5T" and resid 3    and name H73 ))
      4.200     2.200     1.800 peak   793 spectrum    1 weight  0.10000E+01 volume  0.40725E-03 ppm1      8.184 ppm2      1.913 CV     1
 OR {  793}
   (( segid "T22D" and resid 106  and name HD21))
   (( segid "3T5T" and resid 3    and name H72 ))
 OR {  793}
   (( segid "T22D" and resid 106  and name HD21))
   (( segid "3T5T" and resid 3    and name H71 ))
 ASSI {  794}
   (( segid "T22D" and resid 106  and name HD22))
   (( segid "3T5T" and resid 3    and name H73 ))
      3.800     1.800     1.800 peak   794 spectrum    1 weight  0.10000E+01 volume  0.65704E-03 ppm1      7.151 ppm2      1.881 CV     1
 OR {  794}
   (( segid "T22D" and resid 106  and name HD22))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {  794}
   (( segid "T22D" and resid 106  and name HD22))
   (( segid "3T5T" and resid 3    and name H72 ))
 ASSI {  795}
   (( segid "T22D" and resid 106  and name HD21))
   (( segid "T22D" and resid 106  and name HB2 ))
      3.000     1.200     1.200 peak   795 spectrum    1 weight  0.10000E+01 volume  0.13670E-02 ppm1      8.181 ppm2      2.758 CV     1
 OR {  795}
   (( segid "T22D" and resid 106  and name HD21))
   (( segid "T22D" and resid 106  and name HB1 ))
 ASSI {  797}
   (( segid "T22D" and resid 106  and name HD22))
   (( segid "T22D" and resid 106  and name HD21))
      2.200     0.600     0.600 peak   797 spectrum    1 weight  0.10000E+01 volume  0.50292E-02 ppm1      7.150 ppm2      8.152 CV     1
 ASSI {  799}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 96   and name HB2 ))
      3.500     1.500     1.500 peak   799 spectrum    1 weight  0.10000E+01 volume  0.55946E-03 ppm1      8.996 ppm2      2.186 CV     1
 ASSI {  802}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 96   and name HA  ))
      3.200     1.300     1.300 peak   802 spectrum    1 weight  0.10000E+01 volume  0.11550E-02 ppm1      8.989 ppm2      4.682 CV     1
 ASSI {  803}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 97   and name HA  ))
      4.000     2.000     2.000 peak   803 spectrum    1 weight  0.10000E+01 volume  0.53344E-03 ppm1      8.988 ppm2      6.043 CV     1
 ASSI {  804}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 97   and name HD21))
      3.300     1.400     1.400 peak   804 spectrum    1 weight  0.10000E+01 volume  0.13852E-02 ppm1      8.990 ppm2      8.156 CV     1
 ASSI {  805}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 97   and name HD22))
      3.200     3.200     2.800 peak   805 spectrum    1 weight  0.10000E+01 volume  0.38979E-03 ppm1      8.978 ppm2      6.867 CV     1
 ASSI {  806}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 106  and name HB1 ))
      3.700     1.700     1.700 peak   806 spectrum    1 weight  0.10000E+01 volume  0.12835E-02 ppm1      8.988 ppm2      2.782 CV     1
 OR {  806}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 106  and name HB2 ))
 ASSI {  807}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 107  and name HA  ))
      3.100     1.200     1.200 peak   807 spectrum    1 weight  0.10000E+01 volume  0.11164E-02 ppm1      8.996 ppm2      5.195 CV     1
 ASSI {  809}
   (( segid "T22D" and resid 107  and name HN  ))
   (( segid "T22D" and resid 107  and name HB  ))
      2.500     0.800     0.800 peak   809 spectrum    1 weight  0.10000E+01 volume  0.39720E-02 ppm1      8.990 ppm2      1.997 CV     1
 ASSI {  810}
   (( segid "T22D" and resid 107  and name HN  ))
   (  segid "T22D" and resid 107  and name HG2%)
      2.700     0.900     0.900 peak   810 spectrum    1 weight  0.10000E+01 volume  0.33027E-02 ppm1      8.991 ppm2      1.010 CV     1
 OR {  810}
   (( segid "T22D" and resid 107  and name HN  ))
   (  segid "T22D" and resid 107  and name HG1%)
 ASSI {  811}
   (( segid "T22D" and resid 108  and name HN  ))
   (( segid "T22D" and resid 107  and name HN  ))
      4.200     2.300     1.800 peak   811 spectrum    1 weight  0.10000E+01 volume  0.46318E-03 ppm1      8.700 ppm2      8.978 CV     1
 ASSI {  812}
   (( segid "T22D" and resid 108  and name HN  ))
   (  segid "T22D" and resid 38   and name HD% )
      4.100     2.100     1.900 peak   812 spectrum    1 weight  0.10000E+01 volume  0.37155E-03 ppm1      8.687 ppm2      6.686 CV     1
 ASSI {  814}
   (( segid "T22D" and resid 108  and name HN  ))
   (  segid "T22D" and resid 37   and name HG2%)
      2.700     0.900     0.900 peak   814 spectrum    1 weight  0.10000E+01 volume  0.33173E-02 ppm1      8.692 ppm2      0.661 CV     1
 ASSI {  815}
   (( segid "T22D" and resid 108  and name HN  ))
   (( segid "T22D" and resid 38   and name HN  ))
      3.100     1.200     1.200 peak   815 spectrum    1 weight  0.10000E+01 volume  0.13539E-02 ppm1      8.694 ppm2      9.232 CV     1
 ASSI {  816}
   (( segid "T22D" and resid 108  and name HN  ))
   (( segid "T22D" and resid 39   and name HA  ))
      3.900     1.900     1.900 peak   816 spectrum    1 weight  0.10000E+01 volume  0.64916E-03 ppm1      8.694 ppm2      4.348 CV     1
 ASSI {  818}
   (( segid "T22D" and resid 108  and name HN  ))
   (( segid "T22D" and resid 107  and name HB  ))
      4.000     2.000     2.000 peak   818 spectrum    1 weight  0.10000E+01 volume  0.85709E-03 ppm1      8.695 ppm2      1.989 CV     1
 ASSI {  819}
   (( segid "T22D" and resid 108  and name HN  ))
   (  segid "T22D" and resid 107  and name HG1%)
      2.700     0.900     0.900 peak   819 spectrum    1 weight  0.10000E+01 volume  0.43549E-02 ppm1      8.695 ppm2      1.029 CV     1
 OR {  819}
   (( segid "T22D" and resid 108  and name HN  ))
   (  segid "T22D" and resid 107  and name HG2%)
 ASSI {  820}
   (( segid "T22D" and resid 108  and name HN  ))
   (( segid "T22D" and resid 108  and name HA  ))
      2.900     1.100     1.100 peak   820 spectrum    1 weight  0.10000E+01 volume  0.15942E-02 ppm1      8.689 ppm2      4.920 CV     1
 ASSI {  821}
   (( segid "T22D" and resid 108  and name HN  ))
   (( segid "T22D" and resid 108  and name HB1 ))
      3.700     1.700     1.700 peak   821 spectrum    1 weight  0.10000E+01 volume  0.57448E-03 ppm1      8.697 ppm2      3.002 CV     1
 ASSI {  822}
   (( segid "T22D" and resid 108  and name HN  ))
   (( segid "T22D" and resid 108  and name HB2 ))
      3.500     1.600     1.600 peak   822 spectrum    1 weight  0.10000E+01 volume  0.12105E-02 ppm1      8.693 ppm2      2.794 CV     1
 ASSI {  823}
   (( segid "T22D" and resid 108  and name HD21))
   (( segid "T22D" and resid 108  and name HA  ))
      4.500     2.600     1.500 peak   823 spectrum    1 weight  0.10000E+01 volume  0.45367E-03 ppm1      7.078 ppm2      4.936 CV     1
 ASSI {  824}
   (( segid "T22D" and resid 108  and name HD21))
   (( segid "T22D" and resid 108  and name HB1 ))
      3.800     1.800     1.800 peak   824 spectrum    1 weight  0.10000E+01 volume  0.12161E-02 ppm1      7.073 ppm2      2.983 CV     1
 ASSI {  825}
   (( segid "T22D" and resid 108  and name HD22))
   (( segid "T22D" and resid 108  and name HB1 ))
      4.500     2.600     1.500 peak   825 spectrum    1 weight  0.10000E+01 volume  0.76684E-03 ppm1      6.602 ppm2      2.994 CV     1
 ASSI {  826}
   (( segid "T22D" and resid 108  and name HD21))
   (( segid "T22D" and resid 108  and name HB2 ))
      2.500     0.800     0.800 peak   826 spectrum    1 weight  0.10000E+01 volume  0.24876E-02 ppm1      7.074 ppm2      2.778 CV     1
 ASSI {  827}
   (( segid "T22D" and resid 108  and name HD22))
   (( segid "T22D" and resid 108  and name HD21))
      1.800     0.400     0.400 peak   827 spectrum    1 weight  0.10000E+01 volume  0.12399E-01 ppm1      6.605 ppm2      7.049 CV     1
 ASSI {  829}
   (( segid "T22D" and resid 108  and name HD21))
   (( segid "T22D" and resid 110  and name HA  ))
      3.700     1.800     1.800 peak   829 spectrum    1 weight  0.10000E+01 volume  0.53519E-03 ppm1      7.078 ppm2      4.119 CV     1
 ASSI {  830}
   (( segid "T22D" and resid 108  and name HD21))
   (( segid "T22D" and resid 112  and name HB1 ))
      4.400     2.400     1.600 peak   830 spectrum    1 weight  0.10000E+01 volume  0.48303E-03 ppm1      7.084 ppm2      1.504 CV     1
 ASSI {  831}
   (( segid "T22D" and resid 108  and name HD21))
   (  segid "T22D" and resid 112  and name HD1%)
      3.500     1.600     1.600 peak   831 spectrum    1 weight  0.10000E+01 volume  0.59132E-03 ppm1      7.080 ppm2      0.947 CV     1
 ASSI {  832}
   (( segid "T22D" and resid 108  and name HD22))
   (( segid "T22D" and resid 108  and name HA  ))
      5.400     3.700     0.600 peak   832 spectrum    1 weight  0.10000E+01 volume  0.32013E-03 ppm1      6.603 ppm2      4.946 CV     1
 ASSI {  833}
   (( segid "T22D" and resid 108  and name HD22))
   (( segid "T22D" and resid 108  and name HB2 ))
      3.800     1.800     1.800 peak   833 spectrum    1 weight  0.10000E+01 volume  0.18525E-02 ppm1      6.603 ppm2      2.782 CV     1
 ASSI {  834}
   (( segid "T22D" and resid 108  and name HD22))
   (( segid "T22D" and resid 110  and name HA  ))
      3.800     1.800     1.800 peak   834 spectrum    1 weight  0.10000E+01 volume  0.51293E-03 ppm1      6.600 ppm2      4.119 CV     1
 ASSI {  835}
   (( segid "T22D" and resid 108  and name HD22))
   (  segid "T22D" and resid 112  and name HD1%)
      5.100     3.300     0.900 peak   835 spectrum    1 weight  0.10000E+01 volume  0.46876E-03 ppm1      6.603 ppm2      0.949 CV     1
 ASSI {  836}
   (( segid "T22D" and resid 109  and name HN  ))
   (  segid "T22D" and resid 109  and name HD1%)
      4.000     2.000     2.000 peak   836 spectrum    1 weight  0.10000E+01 volume  0.12427E-02 ppm1      9.358 ppm2      1.305 CV     1
 ASSI {  838}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 90   and name HG2 ))
      4.500     2.500     1.500 peak   838 spectrum    1 weight  0.10000E+01 volume  0.43219E-03 ppm1      9.362 ppm2      2.561 CV     1
 ASSI {  839}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 108  and name HN  ))
      4.000     2.000     2.000 peak   839 spectrum    1 weight  0.10000E+01 volume  0.56626E-03 ppm1      9.369 ppm2      8.690 CV     1
 ASSI {  840}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 108  and name HA  ))
      2.300     0.600     0.600 peak   840 spectrum    1 weight  0.10000E+01 volume  0.56355E-02 ppm1      9.361 ppm2      4.923 CV     1
 ASSI {  841}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 108  and name HB1 ))
      3.700     1.700     1.700 peak   841 spectrum    1 weight  0.10000E+01 volume  0.24055E-02 ppm1      9.361 ppm2      3.001 CV     1
 ASSI {  842}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 108  and name HB2 ))
      2.700     0.900     0.900 peak   842 spectrum    1 weight  0.10000E+01 volume  0.20814E-02 ppm1      9.361 ppm2      2.786 CV     1
 ASSI {  843}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 108  and name HD21))
      4.000     2.000     2.000 peak   843 spectrum    1 weight  0.10000E+01 volume  0.41806E-03 ppm1      9.366 ppm2      7.069 CV     1
 ASSI {  844}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 109  and name HA  ))
      2.900     1.000     1.000 peak   844 spectrum    1 weight  0.10000E+01 volume  0.12902E-02 ppm1      9.360 ppm2      4.450 CV     1
 ASSI {  845}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 109  and name HB2 ))
      2.500     0.800     0.800 peak   845 spectrum    1 weight  0.10000E+01 volume  0.38683E-02 ppm1      9.363 ppm2      1.850 CV     1
 OR {  845}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 109  and name HB1 ))
 ASSI {  846}
   (( segid "T22D" and resid 109  and name HN  ))
   (( segid "T22D" and resid 109  and name HG  ))
      2.300     0.700     0.700 peak   846 spectrum    1 weight  0.10000E+01 volume  0.42890E-02 ppm1      9.362 ppm2      2.065 CV     1
 ASSI {  848}
   (( segid "T22D" and resid 110  and name HN  ))
   (( segid "T22D" and resid 109  and name HA  ))
      2.400     0.700     0.700 peak   848 spectrum    1 weight  0.10000E+01 volume  0.31502E-02 ppm1      9.645 ppm2      4.454 CV     1
 ASSI {  849}
   (( segid "T22D" and resid 110  and name HN  ))
   (( segid "T22D" and resid 109  and name HB1 ))
      3.200     1.300     1.300 peak   849 spectrum    1 weight  0.10000E+01 volume  0.92493E-03 ppm1      9.647 ppm2      1.823 CV     1
 ASSI {  850}
   (( segid "T22D" and resid 110  and name HN  ))
   (  segid "T22D" and resid 109  and name HD2%)
      4.300     2.300     1.700 peak   850 spectrum    1 weight  0.10000E+01 volume  0.85600E-03 ppm1      9.650 ppm2      0.879 CV     1
 ASSI {  851}
   (( segid "T22D" and resid 110  and name HN  ))
   (( segid "T22D" and resid 110  and name HA  ))
      2.800     1.000     1.000 peak   851 spectrum    1 weight  0.10000E+01 volume  0.18362E-02 ppm1      9.641 ppm2      4.158 CV     1
 ASSI {  852}
   (( segid "T22D" and resid 110  and name HN  ))
   (  segid "T22D" and resid 110  and name HB% )
      2.600     0.800     0.800 peak   852 spectrum    1 weight  0.10000E+01 volume  0.29006E-02 ppm1      9.645 ppm2      1.629 CV     1
 ASSI {  855}
   (( segid "T22D" and resid 111  and name HN  ))
   (( segid "T22D" and resid 109  and name HB1 ))
      3.400     1.500     1.500 peak   855 spectrum    1 weight  0.10000E+01 volume  0.66709E-03 ppm1      9.063 ppm2      1.808 CV     1
 ASSI {  856}
   (( segid "T22D" and resid 111  and name HN  ))
   (( segid "T22D" and resid 110  and name HN  ))
      2.900     1.100     1.100 peak   856 spectrum    1 weight  0.10000E+01 volume  0.12735E-02 ppm1      9.066 ppm2      9.612 CV     1
 ASSI {  857}
   (( segid "T22D" and resid 111  and name HN  ))
   (  segid "T22D" and resid 110  and name HB% )
      2.800     1.000     1.000 peak   857 spectrum    1 weight  0.10000E+01 volume  0.23241E-02 ppm1      9.066 ppm2      1.629 CV     1
 ASSI {  858}
   (( segid "T22D" and resid 111  and name HN  ))
   (( segid "T22D" and resid 111  and name HA  ))
      2.800     1.000     1.000 peak   858 spectrum    1 weight  0.10000E+01 volume  0.25957E-02 ppm1      9.058 ppm2      4.435 CV     1
 ASSI {  859}
   (( segid "T22D" and resid 111  and name HN  ))
   (( segid "T22D" and resid 111  and name HB1 ))
      2.500     0.800     0.800 peak   859 spectrum    1 weight  0.10000E+01 volume  0.25361E-02 ppm1      9.062 ppm2      2.919 CV     1
 ASSI {  860}
   (( segid "T22D" and resid 111  and name HN  ))
   (( segid "T22D" and resid 111  and name HB2 ))
      4.000     2.000     2.000 peak   860 spectrum    1 weight  0.10000E+01 volume  0.15552E-02 ppm1      9.064 ppm2      3.209 CV     1
 ASSI {  861}
   (( segid "T22D" and resid 111  and name HN  ))
   (  segid "T22D" and resid 111  and name HD% )
      2.600     0.800     0.800 peak   861 spectrum    1 weight  0.10000E+01 volume  0.30116E-02 ppm1      9.065 ppm2      7.081 CV     1
 ASSI {  862}
   (( segid "T22D" and resid 111  and name HN  ))
   (  segid "T22D" and resid 111  and name HE% )
      4.200     2.200     1.800 peak   862 spectrum    1 weight  0.10000E+01 volume  0.12684E-02 ppm1      9.063 ppm2      6.746 CV     1
 ASSI {  863}
   (( segid "T22D" and resid 112  and name HN  ))
   (  segid "T22D" and resid 112  and name HD1%)
      4.100     2.100     1.900 peak   863 spectrum    1 weight  0.10000E+01 volume  0.10902E-02 ppm1      6.799 ppm2      0.967 CV     1
 ASSI {  864}
   (( segid "T22D" and resid 112  and name HN  ))
   (( segid "T22D" and resid 112  and name HG  ))
      2.400     0.700     0.700 peak   864 spectrum    1 weight  0.10000E+01 volume  0.35901E-02 ppm1      6.804 ppm2      0.817 CV     1
 ASSI {  865}
   (( segid "T22D" and resid 112  and name HN  ))
   (  segid "T22D" and resid 112  and name HD2%)
      3.800     1.800     1.800 peak   865 spectrum    1 weight  0.10000E+01 volume  0.15389E-02 ppm1      6.805 ppm2      0.626 CV     1
 ASSI {  866}
   (( segid "T22D" and resid 112  and name HN  ))
   (( segid "T22D" and resid 111  and name HN  ))
      3.100     1.200     1.200 peak   866 spectrum    1 weight  0.10000E+01 volume  0.10289E-02 ppm1      6.802 ppm2      9.047 CV     1
 ASSI {  867}
   (( segid "T22D" and resid 112  and name HN  ))
   (( segid "T22D" and resid 111  and name HA  ))
      3.500     1.500     1.500 peak   867 spectrum    1 weight  0.10000E+01 volume  0.70091E-03 ppm1      6.811 ppm2      4.409 CV     1
 ASSI {  868}
   (( segid "T22D" and resid 112  and name HN  ))
   (( segid "T22D" and resid 112  and name HA  ))
      2.900     1.100     1.100 peak   868 spectrum    1 weight  0.10000E+01 volume  0.18829E-02 ppm1      6.805 ppm2      3.686 CV     1
 ASSI {  869}
   (( segid "T22D" and resid 112  and name HN  ))
   (( segid "T22D" and resid 112  and name HB1 ))
      3.400     1.400     1.400 peak   869 spectrum    1 weight  0.10000E+01 volume  0.32766E-02 ppm1      6.804 ppm2      1.477 CV     1
 ASSI {  870}
   (( segid "T22D" and resid 112  and name HN  ))
   (( segid "T22D" and resid 112  and name HB2 ))
      2.800     1.000     1.000 peak   870 spectrum    1 weight  0.10000E+01 volume  0.15183E-02 ppm1      6.805 ppm2      1.369 CV     1
 ASSI {  872}
   (( segid "T22D" and resid 113  and name HN  ))
   (( segid "T22D" and resid 112  and name HG  ))
      4.500     2.500     1.500 peak   872 spectrum    1 weight  0.10000E+01 volume  0.44866E-03 ppm1      7.028 ppm2      0.825 CV     1
 ASSI {  873}
   (( segid "T22D" and resid 113  and name HN  ))
   (  segid "T22D" and resid 112  and name HD2%)
      3.200     1.300     1.300 peak   873 spectrum    1 weight  0.10000E+01 volume  0.38664E-03 ppm1      7.022 ppm2      0.645 CV     1
 ASSI {  874}
   (( segid "T22D" and resid 113  and name HN  ))
   (( segid "T22D" and resid 108  and name HD22))
      4.100     2.100     1.900 peak   874 spectrum    1 weight  0.10000E+01 volume  0.39248E-03 ppm1      7.019 ppm2      6.580 CV     1
 ASSI {  875}
   (( segid "T22D" and resid 113  and name HN  ))
   (( segid "3T5T" and resid 5    and name H3  ))
      4.100     2.100     1.900 peak   875 spectrum    1 weight  0.10000E+01 volume  0.31936E-03 ppm1      7.016 ppm2     11.136 CV     1
 ASSI {  876}
   (( segid "T22D" and resid 113  and name HN  ))
   (( segid "T22D" and resid 112  and name HN  ))
      2.800     1.000     1.000 peak   876 spectrum    1 weight  0.10000E+01 volume  0.24858E-02 ppm1      7.022 ppm2      6.790 CV     1
 ASSI {  877}
   (( segid "T22D" and resid 113  and name HN  ))
   (( segid "T22D" and resid 112  and name HA  ))
      3.300     1.400     1.400 peak   877 spectrum    1 weight  0.10000E+01 volume  0.12039E-02 ppm1      7.022 ppm2      3.667 CV     1
 ASSI {  878}
   (( segid "T22D" and resid 113  and name HN  ))
   (( segid "T22D" and resid 112  and name HB1 ))
      3.700     1.700     1.700 peak   878 spectrum    1 weight  0.10000E+01 volume  0.11445E-02 ppm1      7.026 ppm2      1.470 CV     1
 ASSI {  880}
   (( segid "T22D" and resid 113  and name HN  ))
   (( segid "T22D" and resid 113  and name HA1 ))
      2.700     0.900     0.900 peak   880 spectrum    1 weight  0.10000E+01 volume  0.30176E-02 ppm1      7.024 ppm2      4.146 CV     1
 ASSI {  881}
   (( segid "T22D" and resid 113  and name HN  ))
   (( segid "T22D" and resid 113  and name HA2 ))
      2.900     1.100     1.100 peak   881 spectrum    1 weight  0.10000E+01 volume  0.34957E-02 ppm1      7.022 ppm2      3.323 CV     1
 ASSI {  882}
   (( segid "T22D" and resid 114  and name HN  ))
   (( segid "T22D" and resid 113  and name HA1 ))
      3.500     1.500     1.500 peak   882 spectrum    1 weight  0.10000E+01 volume  0.14072E-02 ppm1      7.057 ppm2      4.133 CV     1
 ASSI {  883}
   (( segid "T22D" and resid 114  and name HN  ))
   (( segid "T22D" and resid 113  and name HA2 ))
      3.300     1.300     1.300 peak   883 spectrum    1 weight  0.10000E+01 volume  0.12944E-02 ppm1      7.059 ppm2      3.334 CV     1
 ASSI {  884}
   (( segid "T22D" and resid 114  and name HN  ))
   (( segid "T22D" and resid 114  and name HA  ))
      3.000     1.200     1.200 peak   884 spectrum    1 weight  0.10000E+01 volume  0.17688E-02 ppm1      7.056 ppm2      4.003 CV     1
 ASSI {  885}
   (( segid "T22D" and resid 114  and name HN  ))
   (  segid "T22D" and resid 114  and name HB% )
      2.500     0.800     0.800 peak   885 spectrum    1 weight  0.10000E+01 volume  0.59983E-02 ppm1      7.058 ppm2      1.272 CV     1
 ASSI {  886}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 115  and name HB2 ))
      2.400     0.700     0.700 peak   886 spectrum    1 weight  0.10000E+01 volume  0.52352E-02 ppm1      8.338 ppm2      1.677 CV     1
 OR {  886}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 115  and name HD2 ))
 OR {  886}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 115  and name HD1 ))
 ASSI {  888}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 115  and name HA  ))
      2.600     0.900     0.900 peak   888 spectrum    1 weight  0.10000E+01 volume  0.33348E-02 ppm1      8.339 ppm2      4.534 CV     1
 ASSI {  892}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 114  and name HA  ))
      2.100     0.600     0.600 peak   892 spectrum    1 weight  0.10000E+01 volume  0.11227E-01 ppm1      8.339 ppm2      4.007 CV     1
 ASSI {  893}
   (( segid "T22D" and resid 115  and name HN  ))
   (  segid "T22D" and resid 114  and name HB% )
      2.900     1.100     1.100 peak   893 spectrum    1 weight  0.10000E+01 volume  0.40228E-02 ppm1      8.339 ppm2      1.273 CV     1
 ASSI {  894}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 115  and name HG1 ))
      2.900     1.000     1.000 peak   894 spectrum    1 weight  0.10000E+01 volume  0.23394E-02 ppm1      8.339 ppm2      1.462 CV     1
 OR {  894}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 115  and name HG2 ))
 ASSI {  895}
   (( segid "T22D" and resid 117  and name HN  ))
   (( segid "T22D" and resid 116  and name HB1 ))
      4.300     2.300     1.700 peak   895 spectrum    1 weight  0.10000E+01 volume  0.58536E-03 ppm1      8.549 ppm2      2.279 CV     1
 ASSI {  898}
   (( segid "T22D" and resid 117  and name HN  ))
   (( segid "T22D" and resid 116  and name HA  ))
      2.400     0.700     0.700 peak   898 spectrum    1 weight  0.10000E+01 volume  0.71964E-02 ppm1      8.548 ppm2      4.399 CV     1
 ASSI {  899}
   (( segid "T22D" and resid 118  and name HN  ))
   (( segid "T22D" and resid 117  and name HA  ))
      3.000     1.100     1.100 peak   899 spectrum    1 weight  0.10000E+01 volume  0.17798E-02 ppm1      8.252 ppm2      4.391 CV     1
 ASSI {  900}
   (( segid "T22D" and resid 119  and name HD22))
   (( segid "T22D" and resid 119  and name HD21))
      1.800     0.400     0.400 peak   900 spectrum    1 weight  0.10000E+01 volume  0.19992E-01 ppm1      6.911 ppm2      7.580 CV     1
 ASSI {  902}
   (( segid "T22D" and resid 120  and name HN  ))
   (( segid "T22D" and resid 120  and name HA  ))
      3.600     1.600     1.600 peak   902 spectrum    1 weight  0.10000E+01 volume  0.65888E-03 ppm1      8.092 ppm2      4.119 CV     1
 ASSI {  903}
   (( segid "T22D" and resid 120  and name HN  ))
   (( segid "T22D" and resid 120  and name HB  ))
      3.900     1.900     1.900 peak   903 spectrum    1 weight  0.10000E+01 volume  0.46931E-03 ppm1      8.087 ppm2      2.098 CV     1
 ASSI {  904}
   (( segid "T22D" and resid 120  and name HN  ))
   (  segid "T22D" and resid 120  and name HG1%)
      3.800     1.800     1.800 peak   904 spectrum    1 weight  0.10000E+01 volume  0.66826E-03 ppm1      8.094 ppm2      0.883 CV     1
 OR {  904}
   (( segid "T22D" and resid 120  and name HN  ))
   (  segid "T22D" and resid 120  and name HG2%)
 ASSI {  905}
   (( segid "T22D" and resid 121  and name HN  ))
   (( segid "T22D" and resid 120  and name HA  ))
      2.800     1.000     1.000 peak   905 spectrum    1 weight  0.10000E+01 volume  0.32924E-02 ppm1      8.017 ppm2      4.114 CV     1
 ASSI {  906}
   (( segid "T22D" and resid 121  and name HE22))
   (( segid "T22D" and resid 121  and name HE21))
      1.700     0.300     0.500 peak   906 spectrum    1 weight  0.10000E+01 volume  0.29963E-01 ppm1      6.819 ppm2      7.498 CV     1
 ASSI {    3}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "T22D" and resid 80   and name HB2 ))
      3.700     1.700     1.700 peak     3 spectrum    1 weight  0.10000E+01 volume  0.57994E-03 ppm1      0.775 ppm2      2.776 CV     1
 ASSI {    4}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "3T5T" and resid 6    and name H5' ))
      3.800     1.800     1.800 peak     4 spectrum    1 weight  0.10000E+01 volume  0.65742E-03 ppm1      0.769 ppm2      4.426 CV     1
 ASSI {    9}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "T22D" and resid 80   and name HB1 ))
      5.400     3.700     0.600 peak     9 spectrum    1 weight  0.10000E+01 volume  0.41505E-03 ppm1      0.762 ppm2      2.180 CV     1
 ASSI {   10}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "3T5T" and resid 6    and name H2' ))
      4.000     2.000     2.000 peak    10 spectrum    1 weight  0.10000E+01 volume  0.69612E-03 ppm1      0.760 ppm2      2.577 CV     1
 ASSI {   12}
   (  segid "T22D" and resid 67   and name HD1%)
   (  segid "T22D" and resid 80   and name HD% )
      2.600     0.800     0.800 peak    12 spectrum    1 weight  0.10000E+01 volume  0.29530E-02 ppm1      0.766 ppm2      6.610 CV     1
 ASSI {   13}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "T22D" and resid 79   and name HA2 ))
      4.100     2.100     1.900 peak    13 spectrum    1 weight  0.10000E+01 volume  0.88986E-03 ppm1      0.771 ppm2      3.948 CV     1
 ASSI {   14}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "T22D" and resid 67   and name HA  ))
      2.000     0.500     0.500 peak    14 spectrum    1 weight  0.10000E+01 volume  0.96413E-02 ppm1      0.767 ppm2      4.101 CV     1
 ASSI {   15}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "T22D" and resid 79   and name HA1 ))
      5.100     3.200     0.900 peak    15 spectrum    1 weight  0.10000E+01 volume  0.74324E-03 ppm1      0.766 ppm2      3.796 CV     1
 ASSI {   16}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "T22D" and resid 67   and name HG12))
      2.400     0.700     0.700 peak    16 spectrum    1 weight  0.10000E+01 volume  0.33814E-02 ppm1      0.771 ppm2      1.161 CV     1
 ASSI {   17}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "3T5T" and resid 6    and name H4' ))
      2.800     1.000     1.000 peak    17 spectrum    1 weight  0.10000E+01 volume  0.22954E-02 ppm1      0.767 ppm2      4.561 CV     1
 ASSI {   18}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "3T5T" and resid 6    and name H2''))
      4.200     2.200     1.800 peak    18 spectrum    1 weight  0.10000E+01 volume  0.69399E-03 ppm1      0.777 ppm2      2.658 CV     1
 ASSI {   19}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "3T5T" and resid 6    and name H1' ))
      2.300     0.700     0.700 peak    19 spectrum    1 weight  0.10000E+01 volume  0.72714E-02 ppm1      0.767 ppm2      6.370 CV     1
 ASSI {   21}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "T22D" and resid 66   and name HA  ))
      3.800     1.800     1.800 peak    21 spectrum    1 weight  0.10000E+01 volume  0.97160E-03 ppm1      0.768 ppm2      3.748 CV     1
 ASSI {   22}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "3T5T" and resid 6    and name H5''))
      4.300     2.300     1.700 peak    22 spectrum    1 weight  0.10000E+01 volume  0.90446E-03 ppm1      0.766 ppm2      4.237 CV     1
 ASSI {   23}
   (  segid "T22D" and resid 99   and name HD1%)
   (  segid "T22D" and resid 99   and name HG2%)
      2.000     0.500     0.500 peak    23 spectrum    1 weight  0.10000E+01 volume  0.20608E-01 ppm1      0.705 ppm2      0.555 CV     1
 ASSI {   24}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 104  and name HA  ))
      2.200     0.600     0.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.79149E-02 ppm1      0.708 ppm2      4.146 CV     1
 ASSI {   25}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 104  and name HB2 ))
      2.400     0.700     0.700 peak    25 spectrum    1 weight  0.10000E+01 volume  0.44345E-02 ppm1      0.709 ppm2      1.609 CV     1
 ASSI {   26}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 99   and name HG12))
      2.300     0.600     0.600 peak    26 spectrum    1 weight  0.10000E+01 volume  0.80337E-02 ppm1      0.706 ppm2      1.146 CV     1
 ASSI {   27}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 99   and name HG11))
      2.300     0.600     0.600 peak    27 spectrum    1 weight  0.10000E+01 volume  0.83081E-02 ppm1      0.711 ppm2      1.458 CV     1
 ASSI {   28}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 99   and name HB  ))
      3.100     1.200     1.200 peak    28 spectrum    1 weight  0.10000E+01 volume  0.51814E-02 ppm1      0.709 ppm2      1.800 CV     1
 ASSI {   30}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 104  and name HB1 ))
      3.600     1.700     1.700 peak    30 spectrum    1 weight  0.10000E+01 volume  0.27920E-02 ppm1      0.708 ppm2      1.671 CV     1
 ASSI {   33}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 103  and name HG1 ))
      3.600     3.600     2.400 peak    33 spectrum    1 weight  0.10000E+01 volume  0.14061E-02 ppm1      0.714 ppm2      1.399 CV     1
 ASSI {   37}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 98   and name HB1 ))
      4.600     2.700     1.400 peak    37 spectrum    1 weight  0.10000E+01 volume  0.58411E-03 ppm1      0.235 ppm2      2.116 CV     1
 ASSI {   38}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 54   and name HB2 ))
      4.000     2.000     2.000 peak    38 spectrum    1 weight  0.10000E+01 volume  0.62765E-03 ppm1      0.233 ppm2      3.227 CV     1
 ASSI {   39}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 98   and name HD2 ))
      4.500     2.500     1.500 peak    39 spectrum    1 weight  0.10000E+01 volume  0.46413E-03 ppm1      0.233 ppm2      3.163 CV     1
 ASSI {   41}
   (  segid "T22D" and resid 100  and name HD1%)
   (  segid "T22D" and resid 54   and name HD% )
      3.600     1.600     1.600 peak    41 spectrum    1 weight  0.10000E+01 volume  0.63019E-03 ppm1      0.233 ppm2      6.364 CV     1
 ASSI {   42}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 55   and name HZ  ))
      3.400     1.400     1.400 peak    42 spectrum    1 weight  0.10000E+01 volume  0.10166E-02 ppm1      0.237 ppm2      7.184 CV     1
 ASSI {   43}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 98   and name HD1 ))
      4.800     2.900     1.200 peak    43 spectrum    1 weight  0.10000E+01 volume  0.61643E-03 ppm1      0.246 ppm2      3.590 CV     1
 ASSI {   44}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 100  and name HG11))
      2.600     0.800     0.800 peak    44 spectrum    1 weight  0.10000E+01 volume  0.33891E-02 ppm1      0.240 ppm2      0.795 CV     1
 ASSI {   45}
   (  segid "T22D" and resid 100  and name HD1%)
   (  segid "T22D" and resid 55   and name HE% )
      2.800     1.000     1.000 peak    45 spectrum    1 weight  0.10000E+01 volume  0.18075E-02 ppm1      0.244 ppm2      7.316 CV     1
 ASSI {   46}
   (  segid "T22D" and resid 100  and name HD1%)
   (  segid "T22D" and resid 100  and name HG2%)
      2.200     0.600     0.600 peak    46 spectrum    1 weight  0.10000E+01 volume  0.97256E-02 ppm1      0.240 ppm2      0.449 CV     1
 ASSI {   47}
   (  segid "T22D" and resid 100  and name HD1%)
   (  segid "T22D" and resid 42   and name HD2%)
      2.200     0.600     0.600 peak    47 spectrum    1 weight  0.10000E+01 volume  0.78298E-02 ppm1      0.239 ppm2      0.678 CV     1
 ASSI {   48}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 100  and name HB  ))
      2.200     0.600     0.600 peak    48 spectrum    1 weight  0.10000E+01 volume  0.11588E-01 ppm1      0.241 ppm2      1.309 CV     1
 ASSI {   49}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 100  and name HG12))
      2.500     0.800     0.800 peak    49 spectrum    1 weight  0.10000E+01 volume  0.37554E-02 ppm1      0.243 ppm2     -0.507 CV     1
 ASSI {   50}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 98   and name HG2 ))
      3.200     1.300     1.300 peak    50 spectrum    1 weight  0.10000E+01 volume  0.10499E-02 ppm1      0.245 ppm2      1.979 CV     1
 OR {   50}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 98   and name HG1 ))
 ASSI {   51}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 100  and name HA  ))
      3.600     1.600     1.600 peak    51 spectrum    1 weight  0.10000E+01 volume  0.28988E-02 ppm1      0.244 ppm2      3.767 CV     1
 ASSI {   52}
   (  segid "T22D" and resid 100  and name HD1%)
   (  segid "T22D" and resid 54   and name HE% )
      3.200     1.300     1.300 peak    52 spectrum    1 weight  0.10000E+01 volume  0.16749E-02 ppm1      0.239 ppm2      6.455 CV     1
 ASSI {   53}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 54   and name HB1 ))
      3.300     1.300     1.300 peak    53 spectrum    1 weight  0.10000E+01 volume  0.84929E-03 ppm1      0.249 ppm2      2.894 CV     1
 ASSI {   54}
   (  segid "T22D" and resid 100  and name HD1%)
   (( segid "T22D" and resid 98   and name HB2 ))
      2.900     1.000     1.000 peak    54 spectrum    1 weight  0.10000E+01 volume  0.23055E-02 ppm1      0.241 ppm2      1.560 CV     1
 ASSI {   55}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 52   and name HD2 ))
      3.500     1.500     1.500 peak    55 spectrum    1 weight  0.10000E+01 volume  0.12372E-02 ppm1      0.306 ppm2      7.308 CV     1
 ASSI {   56}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 55   and name HA  ))
      3.600     1.600     1.600 peak    56 spectrum    1 weight  0.10000E+01 volume  0.13646E-02 ppm1      0.328 ppm2      4.312 CV     1
 ASSI {   57}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 52   and name HB1 ))
      3.800     1.800     1.800 peak    57 spectrum    1 weight  0.10000E+01 volume  0.14724E-02 ppm1      0.319 ppm2      3.596 CV     1
 OR {   57}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 52   and name HB2 ))
 ASSI {   58}
   (  segid "T22D" and resid 61   and name HD1%)
   (  segid "T22D" and resid 81   and name HG1%)
      2.700     0.900     0.900 peak    58 spectrum    1 weight  0.10000E+01 volume  0.38864E-02 ppm1      0.322 ppm2      0.531 CV     1
 ASSI {   59}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 61   and name HA  ))
      3.400     1.400     1.400 peak    59 spectrum    1 weight  0.10000E+01 volume  0.31063E-02 ppm1      0.319 ppm2      4.111 CV     1
 ASSI {   60}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 56   and name HA  ))
      2.400     0.700     0.700 peak    60 spectrum    1 weight  0.10000E+01 volume  0.73127E-02 ppm1      0.317 ppm2      4.403 CV     1
 ASSI {   61}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 61   and name HG11))
      2.200     0.600     0.600 peak    61 spectrum    1 weight  0.10000E+01 volume  0.65596E-02 ppm1      0.315 ppm2      1.534 CV     1
 ASSI {   62}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 56   and name HG1 ))
      3.800     1.800     1.800 peak    62 spectrum    1 weight  0.10000E+01 volume  0.20721E-02 ppm1      0.314 ppm2      2.427 CV     1
 ASSI {   63}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 54   and name HB1 ))
      2.200     2.200     3.800 peak    63 spectrum    1 weight  0.10000E+01 volume  0.36886E-02 ppm1      0.318 ppm2      2.868 CV     1
 ASSI {   65}
   (  segid "T22D" and resid 61   and name HD1%)
   (  segid "T22D" and resid 83   and name HE% )
      3.200     1.200     1.200 peak    65 spectrum    1 weight  0.10000E+01 volume  0.25919E-02 ppm1      0.315 ppm2      1.928 CV     1
 ASSI {   66}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 61   and name HB  ))
      2.300     0.600     0.600 peak    66 spectrum    1 weight  0.10000E+01 volume  0.65192E-02 ppm1      0.316 ppm2      1.474 CV     1
 ASSI {   67}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 61   and name HG12))
      2.200     0.600     0.600 peak    67 spectrum    1 weight  0.10000E+01 volume  0.57068E-02 ppm1      0.315 ppm2      0.920 CV     1
 ASSI {   68}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 57   and name HG2 ))
      2.200     2.200     3.800 peak    68 spectrum    1 weight  0.10000E+01 volume  0.39979E-02 ppm1      0.312 ppm2      0.054 CV     1
 ASSI {   69}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 56   and name HG2 ))
      3.300     1.400     1.400 peak    69 spectrum    1 weight  0.10000E+01 volume  0.19222E-02 ppm1      0.310 ppm2      2.620 CV     1
 ASSI {   70}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 52   and name HA  ))
      2.300     0.600     0.600 peak    70 spectrum    1 weight  0.10000E+01 volume  0.53807E-02 ppm1      0.315 ppm2      3.748 CV     1
 ASSI {   71}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 56   and name HB2 ))
      3.800     1.800     1.800 peak    71 spectrum    1 weight  0.10000E+01 volume  0.17234E-02 ppm1      0.315 ppm2      2.145 CV     1
 ASSI {   72}
   (  segid "T22D" and resid 61   and name HD1%)
   (( segid "T22D" and resid 56   and name HB1 ))
      2.500     0.800     0.800 peak    72 spectrum    1 weight  0.10000E+01 volume  0.23934E-02 ppm1      0.313 ppm2      2.064 CV     1
 ASSI {   73}
   (  segid "T22D" and resid 61   and name HD1%)
   (  segid "T22D" and resid 64   and name HB% )
      2.500     0.800     0.800 peak    73 spectrum    1 weight  0.10000E+01 volume  0.45100E-02 ppm1      0.324 ppm2      1.327 CV     1
 ASSI {   74}
   (  segid "T22D" and resid 61   and name HD1%)
   (  segid "T22D" and resid 61   and name HG2%)
      2.100     0.600     0.600 peak    74 spectrum    1 weight  0.10000E+01 volume  0.95233E-02 ppm1      0.328 ppm2      0.607 CV     1
 ASSI {   75}
   (  segid "T22D" and resid 100  and name HG2%)
   (  segid "T22D" and resid 54   and name HD% )
      4.000     2.000     2.000 peak    75 spectrum    1 weight  0.10000E+01 volume  0.48373E-03 ppm1      0.459 ppm2      6.328 CV     1
 ASSI {   76}
   (  segid "T22D" and resid 37   and name HD1%)
   (  segid "T22D" and resid 83   and name HE% )
      3.300     1.400     1.400 peak    76 spectrum    1 weight  0.10000E+01 volume  0.25519E-02 ppm1      0.706 ppm2      1.934 CV     1
 ASSI {   78}
   (  segid "T22D" and resid 37   and name HD1%)
   (  segid "T22D" and resid 81   and name HG2%)
      4.000     2.000     2.000 peak    78 spectrum    1 weight  0.10000E+01 volume  0.11693E-02 ppm1      0.716 ppm2      0.268 CV     1
 ASSI {   79}
   (  segid "T22D" and resid 37   and name HD1%)
   (  segid "T22D" and resid 55   and name HE% )
      3.400     1.400     1.400 peak    79 spectrum    1 weight  0.10000E+01 volume  0.10650E-02 ppm1      0.705 ppm2      7.296 CV     1
 ASSI {   83}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 54   and name HB2 ))
      3.000     1.100     1.100 peak    83 spectrum    1 weight  0.10000E+01 volume  0.15669E-02 ppm1      0.446 ppm2      3.229 CV     1
 ASSI {   85}
   (  segid "T22D" and resid 100  and name HG2%)
   (  segid "T22D" and resid 46   and name HG2%)
      2.800     1.000     1.000 peak    85 spectrum    1 weight  0.10000E+01 volume  0.25256E-02 ppm1      0.454 ppm2      1.141 CV     1
 ASSI {   86}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 51   and name HA  ))
      3.100     1.200     1.200 peak    86 spectrum    1 weight  0.10000E+01 volume  0.20213E-02 ppm1      0.448 ppm2      4.135 CV     1
 ASSI {   87}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 100  and name HA  ))
      2.300     0.700     0.700 peak    87 spectrum    1 weight  0.10000E+01 volume  0.82427E-02 ppm1      0.453 ppm2      3.768 CV     1
 ASSI {   88}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 101  and name HB1 ))
      3.200     1.300     1.300 peak    88 spectrum    1 weight  0.10000E+01 volume  0.25453E-02 ppm1      0.452 ppm2      2.239 CV     1
 ASSI {   89}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 101  and name HB2 ))
      3.000     1.100     1.100 peak    89 spectrum    1 weight  0.10000E+01 volume  0.16090E-02 ppm1      0.450 ppm2      3.004 CV     1
 ASSI {   90}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 54   and name HB1 ))
      3.400     1.400     1.400 peak    90 spectrum    1 weight  0.10000E+01 volume  0.11774E-02 ppm1      0.450 ppm2      2.894 CV     1
 ASSI {   91}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 100  and name HB  ))
      2.200     0.600     0.600 peak    91 spectrum    1 weight  0.10000E+01 volume  0.10126E-01 ppm1      0.452 ppm2      1.305 CV     1
 ASSI {   92}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 43   and name HD2 ))
      3.700     1.700     1.700 peak    92 spectrum    1 weight  0.10000E+01 volume  0.49241E-03 ppm1      0.457 ppm2      3.896 CV     1
 ASSI {   93}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 101  and name HA  ))
      3.800     1.800     1.800 peak    93 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      0.454 ppm2      4.218 CV     1
 ASSI {   94}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 100  and name HG12))
      2.700     0.900     0.900 peak    94 spectrum    1 weight  0.10000E+01 volume  0.24746E-02 ppm1      0.452 ppm2     -0.503 CV     1
 ASSI {   95}
   (  segid "T22D" and resid 100  and name HG2%)
   (  segid "T22D" and resid 42   and name HD2%)
      2.600     0.900     0.900 peak    95 spectrum    1 weight  0.10000E+01 volume  0.43048E-02 ppm1      0.452 ppm2      0.673 CV     1
 ASSI {   97}
   (  segid "T22D" and resid 100  and name HG2%)
   (( segid "T22D" and resid 42   and name HA  ))
      4.200     2.200     1.800 peak    97 spectrum    1 weight  0.10000E+01 volume  0.62765E-03 ppm1      0.443 ppm2      4.328 CV     1
 ASSI {   99}
   (  segid "T22D" and resid 100  and name HG2%)
   (  segid "T22D" and resid 54   and name HE% )
      4.100     2.100     1.900 peak    99 spectrum    1 weight  0.10000E+01 volume  0.71847E-03 ppm1      0.453 ppm2      6.455 CV     1
 ASSI {  100}
   (  segid "T22D" and resid 37   and name HD1%)
   (  segid "T22D" and resid 92   and name HB% )
      2.200     0.600     0.600 peak   100 spectrum    1 weight  0.10000E+01 volume  0.93198E-02 ppm1      0.708 ppm2      1.419 CV     1
 ASSI {  101}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 89   and name HA  ))
      2.100     0.600     0.600 peak   101 spectrum    1 weight  0.10000E+01 volume  0.54216E-02 ppm1      0.710 ppm2      4.106 CV     1
 ASSI {  102}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 55   and name HB1 ))
      4.000     2.000     2.000 peak   102 spectrum    1 weight  0.10000E+01 volume  0.54762E-03 ppm1      0.719 ppm2      2.873 CV     1
 ASSI {  103}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 83   and name HG1 ))
      3.100     1.200     1.200 peak   103 spectrum    1 weight  0.10000E+01 volume  0.22456E-02 ppm1      0.702 ppm2      2.252 CV     1
 ASSI {  105}
   (  segid "T22D" and resid 37   and name HD1%)
   (  segid "T22D" and resid 89   and name HB% )
      2.400     0.700     0.700 peak   105 spectrum    1 weight  0.10000E+01 volume  0.62660E-02 ppm1      0.706 ppm2      1.590 CV     1
 ASSI {  106}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 37   and name HB  ))
      2.500     0.800     0.800 peak   106 spectrum    1 weight  0.10000E+01 volume  0.42085E-02 ppm1      0.711 ppm2      1.897 CV     1
 ASSI {  108}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 37   and name HG12))
      2.100     0.500     0.500 peak   108 spectrum    1 weight  0.10000E+01 volume  0.90488E-02 ppm1      0.708 ppm2      0.525 CV     1
 ASSI {  109}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 37   and name HA  ))
      3.900     1.900     1.900 peak   109 spectrum    1 weight  0.10000E+01 volume  0.14026E-02 ppm1      0.710 ppm2      4.207 CV     1
 ASSI {  110}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 109  and name HA  ))
      4.200     2.200     1.800 peak   110 spectrum    1 weight  0.10000E+01 volume  0.89253E-03 ppm1      0.709 ppm2      4.478 CV     1
 ASSI {  111}
   (  segid "T22D" and resid 33   and name HE% )
   (( segid "T22D" and resid 34   and name HZ  ))
      4.100     2.100     1.900 peak   111 spectrum    1 weight  0.10000E+01 volume  0.93778E-03 ppm1      1.493 ppm2      7.248 CV     1
 ASSI {  112}
   (  segid "T22D" and resid 33   and name HE% )
   (( segid "T22D" and resid 111  and name HB1 ))
      3.700     1.700     1.700 peak   112 spectrum    1 weight  0.10000E+01 volume  0.12706E-02 ppm1      1.487 ppm2      2.927 CV     1
 ASSI {  113}
   (  segid "T22D" and resid 33   and name HE% )
   (  segid "T22D" and resid 111  and name HD% )
      2.900     1.000     1.000 peak   113 spectrum    1 weight  0.10000E+01 volume  0.26635E-02 ppm1      1.485 ppm2      7.098 CV     1
 ASSI {  114}
   (  segid "T22D" and resid 33   and name HE% )
   (  segid "T22D" and resid 34   and name HD% )
      3.200     1.300     1.300 peak   114 spectrum    1 weight  0.10000E+01 volume  0.17361E-02 ppm1      1.486 ppm2      7.210 CV     1
 ASSI {  115}
   (  segid "T22D" and resid 33   and name HE% )
   (( segid "T22D" and resid 111  and name HB2 ))
      3.600     1.600     1.600 peak   115 spectrum    1 weight  0.10000E+01 volume  0.10617E-02 ppm1      1.482 ppm2      3.220 CV     1
 ASSI {  116}
   (  segid "T22D" and resid 33   and name HE% )
   (( segid "T22D" and resid 33   and name HA  ))
      4.000     2.000     2.000 peak   116 spectrum    1 weight  0.10000E+01 volume  0.11065E-02 ppm1      1.489 ppm2      3.744 CV     1
 ASSI {  117}
   (  segid "T22D" and resid 33   and name HE% )
   (  segid "T22D" and resid 111  and name HE% )
      2.800     1.000     1.000 peak   117 spectrum    1 weight  0.10000E+01 volume  0.29632E-02 ppm1      1.484 ppm2      6.725 CV     1
 ASSI {  119}
   (  segid "T22D" and resid 33   and name HE% )
   (  segid "T22D" and resid 34   and name HE% )
      3.400     1.400     1.400 peak   119 spectrum    1 weight  0.10000E+01 volume  0.10172E-02 ppm1      1.496 ppm2      7.318 CV     1
 ASSI {  120}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 60   and name HA  ))
      3.100     1.200     1.200 peak   120 spectrum    1 weight  0.10000E+01 volume  0.24310E-02 ppm1      1.923 ppm2      4.720 CV     1
 ASSI {  121}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 89   and name HA  ))
      2.900     1.100     1.100 peak   121 spectrum    1 weight  0.10000E+01 volume  0.40690E-02 ppm1      1.930 ppm2      4.107 CV     1
 ASSI {  122}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 56   and name HA  ))
      3.100     1.200     1.200 peak   122 spectrum    1 weight  0.10000E+01 volume  0.15814E-02 ppm1      1.925 ppm2      4.401 CV     1
 ASSI {  123}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 88   and name HA  ))
      3.300     1.300     1.300 peak   123 spectrum    1 weight  0.10000E+01 volume  0.26575E-02 ppm1      1.923 ppm2      4.334 CV     1
 ASSI {  124}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 88   and name HB2 ))
      2.600     0.800     0.800 peak   124 spectrum    1 weight  0.10000E+01 volume  0.53444E-02 ppm1      1.929 ppm2      4.057 CV     1
 ASSI {  126}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 55   and name HB2 ))
      2.700     0.900     0.900 peak   126 spectrum    1 weight  0.10000E+01 volume  0.11110E-02 ppm1      1.932 ppm2      3.253 CV     1
 ASSI {  127}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 83   and name HG1 ))
      2.400     0.700     0.700 peak   127 spectrum    1 weight  0.10000E+01 volume  0.38959E-02 ppm1      1.925 ppm2      2.260 CV     1
 ASSI {  129}
   (  segid "T22D" and resid 83   and name HE% )
   (  segid "T22D" and resid 55   and name HE% )
      4.000     2.000     2.000 peak   129 spectrum    1 weight  0.10000E+01 volume  0.79036E-03 ppm1      1.928 ppm2      7.317 CV     1
 ASSI {  130}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 61   and name HG12))
      3.000     1.200     1.200 peak   130 spectrum    1 weight  0.10000E+01 volume  0.22084E-02 ppm1      1.931 ppm2      0.926 CV     1
 ASSI {  131}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 59   and name HA1 ))
      2.800     1.000     1.000 peak   131 spectrum    1 weight  0.10000E+01 volume  0.26871E-02 ppm1      1.922 ppm2      4.596 CV     1
 ASSI {  132}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 58   and name HB1 ))
      3.300     1.400     1.400 peak   132 spectrum    1 weight  0.10000E+01 volume  0.34983E-02 ppm1      1.926 ppm2      2.883 CV     1
 ASSI {  133}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 88   and name HB1 ))
      2.300     0.700     0.700 peak   133 spectrum    1 weight  0.10000E+01 volume  0.70029E-02 ppm1      1.927 ppm2      3.860 CV     1
 ASSI {  134}
   (  segid "T22D" and resid 83   and name HE% )
   (  segid "T22D" and resid 81   and name HG2%)
      2.400     2.400     3.600 peak   134 spectrum    1 weight  0.10000E+01 volume  0.19054E-02 ppm1      1.928 ppm2      0.286 CV     1
 ASSI {  136}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 58   and name HB2 ))
      2.600     0.800     0.800 peak   136 spectrum    1 weight  0.10000E+01 volume  0.30620E-02 ppm1      1.929 ppm2      3.669 CV     1
 ASSI {  137}
   (  segid "T22D" and resid 83   and name HE% )
   (  segid "T22D" and resid 92   and name HB% )
      2.700     0.900     0.900 peak   137 spectrum    1 weight  0.10000E+01 volume  0.44341E-02 ppm1      1.928 ppm2      1.417 CV     1
 ASSI {  139}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 61   and name HG11))
      2.400     0.700     0.700 peak   139 spectrum    1 weight  0.10000E+01 volume  0.38576E-02 ppm1      1.926 ppm2      1.533 CV     1
 ASSI {  140}
   (  segid "T22D" and resid 83   and name HE% )
   (  segid "T22D" and resid 81   and name HG1%)
      3.100     1.200     1.200 peak   140 spectrum    1 weight  0.10000E+01 volume  0.20521E-02 ppm1      1.929 ppm2      0.521 CV     1
 ASSI {  142}
   (  segid "T22D" and resid 83   and name HE% )
   (  segid "T22D" and resid 58   and name HD% )
      3.100     1.200     1.200 peak   142 spectrum    1 weight  0.10000E+01 volume  0.22975E-02 ppm1      1.928 ppm2      7.376 CV     1
 ASSI {  143}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 83   and name HA  ))
      2.900     1.100     1.100 peak   143 spectrum    1 weight  0.10000E+01 volume  0.30010E-02 ppm1      1.941 ppm2      5.090 CV     1
 ASSI {  144}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "3T5T" and resid 6    and name H3' ))
      4.100     2.100     1.900 peak   144 spectrum    1 weight  0.10000E+01 volume  0.13002E-02 ppm1      0.868 ppm2      5.023 CV     1
 ASSI {  145}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "3T5T" and resid 6    and name H5' ))
      3.300     1.400     1.400 peak   145 spectrum    1 weight  0.10000E+01 volume  0.64704E-03 ppm1      0.887 ppm2      4.422 CV     1
 ASSI {  146}
   (  segid "T22D" and resid 67   and name HG2%)
   (  segid "T22D" and resid 67   and name HD1%)
      2.100     0.600     0.600 peak   146 spectrum    1 weight  0.10000E+01 volume  0.13088E-01 ppm1      0.871 ppm2      0.759 CV     1
 ASSI {  147}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 67   and name HB  ))
      2.200     0.600     0.600 peak   147 spectrum    1 weight  0.10000E+01 volume  0.80934E-02 ppm1      0.873 ppm2      0.983 CV     1
 ASSI {  148}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 67   and name HA  ))
      2.300     0.700     0.700 peak   148 spectrum    1 weight  0.10000E+01 volume  0.64024E-02 ppm1      0.876 ppm2      4.101 CV     1
 ASSI {  149}
   (  segid "T22D" and resid 67   and name HG2%)
   (  segid "T22D" and resid 78   and name HE% )
      2.800     0.900     0.900 peak   149 spectrum    1 weight  0.10000E+01 volume  0.20797E-02 ppm1      0.874 ppm2      6.622 CV     1
 ASSI {  152}
   (  segid "T22D" and resid 99   and name HG2%)
   (( segid "T22D" and resid 100  and name HA  ))
      3.400     1.500     1.500 peak   152 spectrum    1 weight  0.10000E+01 volume  0.10302E-02 ppm1      0.552 ppm2      3.768 CV     1
 ASSI {  153}
   (  segid "T22D" and resid 99   and name HG2%)
   (  segid "T22D" and resid 100  and name HG2%)
      3.000     3.000     3.000 peak   153 spectrum    1 weight  0.10000E+01 volume  0.53665E-02 ppm1      0.546 ppm2      0.417 CV     1
 ASSI {  154}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 76   and name HD2 ))
      2.800     1.000     1.000 peak   154 spectrum    1 weight  0.10000E+01 volume  0.34293E-02 ppm1      0.876 ppm2      3.069 CV     1
 ASSI {  155}
   (  segid "T22D" and resid 67   and name HG2%)
   (  segid "T22D" and resid 80   and name HE% )
      3.800     1.800     1.800 peak   155 spectrum    1 weight  0.10000E+01 volume  0.88090E-03 ppm1      0.877 ppm2      7.136 CV     1
 ASSI {  156}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "3T5T" and resid 6    and name H1' ))
      3.400     1.400     1.400 peak   156 spectrum    1 weight  0.10000E+01 volume  0.21140E-02 ppm1      0.875 ppm2      6.370 CV     1
 ASSI {  157}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "3T5T" and resid 6    and name H5''))
      3.300     1.400     1.400 peak   157 spectrum    1 weight  0.10000E+01 volume  0.28148E-02 ppm1      0.878 ppm2      4.236 CV     1
 ASSI {  158}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "3T5T" and resid 6    and name H4' ))
      2.200     0.600     0.600 peak   158 spectrum    1 weight  0.10000E+01 volume  0.86363E-02 ppm1      0.878 ppm2      4.560 CV     1
 ASSI {  159}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 76   and name HG1 ))
      2.900     1.100     1.100 peak   159 spectrum    1 weight  0.10000E+01 volume  0.13337E-02 ppm1      0.883 ppm2      1.723 CV     1
 ASSI {  160}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 76   and name HD1 ))
      2.600     0.900     0.900 peak   160 spectrum    1 weight  0.10000E+01 volume  0.24184E-02 ppm1      0.879 ppm2      3.380 CV     1
 ASSI {  162}
   (  segid "T22D" and resid 99   and name HG2%)
   (( segid "T22D" and resid 99   and name HG12))
      3.200     1.200     1.200 peak   162 spectrum    1 weight  0.10000E+01 volume  0.54908E-02 ppm1      0.553 ppm2      1.143 CV     1
 ASSI {  163}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 76   and name HB2 ))
      3.100     1.200     1.200 peak   163 spectrum    1 weight  0.10000E+01 volume  0.11415E-02 ppm1      0.879 ppm2      2.297 CV     1
 ASSI {  164}
   (  segid "T22D" and resid 99   and name HG2%)
   (( segid "T22D" and resid 99   and name HB  ))
      2.100     0.500     0.500 peak   164 spectrum    1 weight  0.10000E+01 volume  0.15027E-01 ppm1      0.554 ppm2      1.803 CV     1
 ASSI {  165}
   (  segid "T22D" and resid 99   and name HG2%)
   (( segid "T22D" and resid 103  and name HA  ))
      3.300     1.400     1.400 peak   165 spectrum    1 weight  0.10000E+01 volume  0.12804E-02 ppm1      0.554 ppm2      4.613 CV     1
 ASSI {  166}
   (  segid "T22D" and resid 99   and name HG2%)
   (( segid "T22D" and resid 102  and name HA2 ))
      2.200     0.600     0.600 peak   166 spectrum    1 weight  0.10000E+01 volume  0.10262E-01 ppm1      0.553 ppm2      4.151 CV     1
 ASSI {  167}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 76   and name HG2 ))
      4.000     2.000     2.000 peak   167 spectrum    1 weight  0.10000E+01 volume  0.14644E-02 ppm1      0.874 ppm2      1.503 CV     1
 ASSI {  168}
   (  segid "T22D" and resid 99   and name HG2%)
   (( segid "T22D" and resid 102  and name HA1 ))
      3.500     1.500     1.500 peak   168 spectrum    1 weight  0.10000E+01 volume  0.44408E-02 ppm1      0.553 ppm2      3.446 CV     1
 ASSI {  169}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 66   and name HA  ))
      4.800     2.900     1.200 peak   169 spectrum    1 weight  0.10000E+01 volume  0.68811E-03 ppm1      0.870 ppm2      3.750 CV     1
 ASSI {  170}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 69   and name HA  ))
      3.200     1.300     1.300 peak   170 spectrum    1 weight  0.10000E+01 volume  0.13856E-02 ppm1      0.882 ppm2      4.606 CV     1
 ASSI {  171}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 67   and name HG12))
      3.300     1.400     1.400 peak   171 spectrum    1 weight  0.10000E+01 volume  0.26379E-02 ppm1      0.874 ppm2      1.162 CV     1
 ASSI {  172}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 79   and name HA2 ))
      4.800     2.800     1.200 peak   172 spectrum    1 weight  0.10000E+01 volume  0.76080E-03 ppm1      0.875 ppm2      3.949 CV     1
 ASSI {  174}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 36   and name HG1 ))
      3.500     1.500     1.500 peak   174 spectrum    1 weight  0.10000E+01 volume  0.30844E-02 ppm1      1.645 ppm2      0.941 CV     1
 ASSI {  175}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 36   and name HB1 ))
      2.600     0.800     0.800 peak   175 spectrum    1 weight  0.10000E+01 volume  0.34474E-02 ppm1      1.650 ppm2      1.782 CV     1
 ASSI {  176}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 111  and name HB1 ))
      4.000     2.000     2.000 peak   176 spectrum    1 weight  0.10000E+01 volume  0.65980E-03 ppm1      1.643 ppm2      2.912 CV     1
 ASSI {  177}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 37   and name HA  ))
      3.300     1.300     1.300 peak   177 spectrum    1 weight  0.10000E+01 volume  0.15828E-02 ppm1      1.649 ppm2      4.210 CV     1
 ASSI {  178}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 38   and name HA  ))
      3.400     1.500     1.500 peak   178 spectrum    1 weight  0.10000E+01 volume  0.12248E-02 ppm1      1.632 ppm2      4.586 CV     1
 ASSI {  179}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 111  and name HA  ))
      3.400     1.500     1.500 peak   179 spectrum    1 weight  0.10000E+01 volume  0.10862E-02 ppm1      1.638 ppm2      4.444 CV     1
 ASSI {  180}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 109  and name HA  ))
      4.300     2.300     1.700 peak   180 spectrum    1 weight  0.10000E+01 volume  0.10088E-02 ppm1      1.643 ppm2      4.473 CV     1
 ASSI {  181}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 38   and name HB1 ))
      3.300     1.400     1.400 peak   181 spectrum    1 weight  0.10000E+01 volume  0.33132E-02 ppm1      1.647 ppm2      2.626 CV     1
 ASSI {  182}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "3T5T" and resid 5    and name H1' ))
      3.400     1.500     1.500 peak   182 spectrum    1 weight  0.10000E+01 volume  0.18740E-02 ppm1      1.649 ppm2      6.576 CV     1
 ASSI {  183}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 36   and name HE1 ))
      3.200     1.300     1.300 peak   183 spectrum    1 weight  0.10000E+01 volume  0.43961E-02 ppm1      1.648 ppm2      2.787 CV     1
 ASSI {  184}
   (  segid "T22D" and resid 110  and name HB% )
   (  segid "T22D" and resid 80   and name HD% )
      3.100     1.200     1.200 peak   184 spectrum    1 weight  0.10000E+01 volume  0.19935E-02 ppm1      1.650 ppm2      6.609 CV     1
 ASSI {  185}
   (  segid "T22D" and resid 110  and name HB% )
   (  segid "T22D" and resid 80   and name HE% )
      2.900     1.100     1.100 peak   185 spectrum    1 weight  0.10000E+01 volume  0.17556E-02 ppm1      1.647 ppm2      7.144 CV     1
 ASSI {  186}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 110  and name HA  ))
      2.100     0.500     0.500 peak   186 spectrum    1 weight  0.10000E+01 volume  0.12145E-01 ppm1      1.648 ppm2      4.127 CV     1
 ASSI {  187}
   (  segid "T22D" and resid 110  and name HB% )
   (  segid "T22D" and resid 38   and name HD% )
      4.000     2.000     2.000 peak   187 spectrum    1 weight  0.10000E+01 volume  0.12151E-02 ppm1      1.649 ppm2      6.678 CV     1
 ASSI {  190}
   (  segid "T22D" and resid 110  and name HB% )
   (( segid "T22D" and resid 36   and name HE2 ))
      2.700     0.900     0.900 peak   190 spectrum    1 weight  0.10000E+01 volume  0.27264E-02 ppm1      1.649 ppm2      2.248 CV     1
 ASSI {  192}
   (  segid "T22D" and resid 87   and name HB% )
   (( segid "T22D" and resid 87   and name HA  ))
      1.900     0.500     0.500 peak   192 spectrum    1 weight  0.10000E+01 volume  0.27811E-01 ppm1      1.516 ppm2      4.236 CV     1
 ASSI {  193}
   (  segid "T22D" and resid 87   and name HB% )
   (( segid "T22D" and resid 88   and name HA  ))
      3.500     1.500     1.500 peak   193 spectrum    1 weight  0.10000E+01 volume  0.12847E-02 ppm1      1.518 ppm2      4.339 CV     1
 ASSI {  194}
   (  segid "T22D" and resid 87   and name HB% )
   (( segid "T22D" and resid 91   and name HG2 ))
      2.700     0.900     0.900 peak   194 spectrum    1 weight  0.10000E+01 volume  0.33877E-02 ppm1      1.520 ppm2      2.088 CV     1
 ASSI {  197}
   (  segid "T22D" and resid 61   and name HG2%)
   (  segid "T22D" and resid 81   and name HG2%)
      2.800     1.000     1.000 peak   197 spectrum    1 weight  0.10000E+01 volume  0.76005E-02 ppm1      0.602 ppm2      0.287 CV     1
 ASSI {  199}
   (  segid "T22D" and resid 61   and name HG2%)
   (  segid "T22D" and resid 83   and name HE% )
      4.100     2.100     1.900 peak   199 spectrum    1 weight  0.10000E+01 volume  0.11640E-02 ppm1      0.616 ppm2      1.935 CV     1
 ASSI {  200}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 83   and name HB2 ))
      2.500     0.800     0.800 peak   200 spectrum    1 weight  0.10000E+01 volume  0.25226E-02 ppm1      1.591 ppm2      1.992 CV     1
 ASSI {  201}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 61   and name HB  ))
      2.100     0.500     0.500 peak   201 spectrum    1 weight  0.10000E+01 volume  0.10562E-01 ppm1      0.605 ppm2      1.471 CV     1
 ASSI {  202}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 61   and name HA  ))
      2.300     0.700     0.700 peak   202 spectrum    1 weight  0.10000E+01 volume  0.71922E-02 ppm1      0.608 ppm2      4.111 CV     1
 ASSI {  203}
   (  segid "T22D" and resid 61   and name HG2%)
   (  segid "T22D" and resid 64   and name HB% )
      2.100     0.500     0.500 peak   203 spectrum    1 weight  0.10000E+01 volume  0.97510E-02 ppm1      0.605 ppm2      1.332 CV     1
 ASSI {  204}
   (  segid "T22D" and resid 37   and name HG2%)
   (  segid "T22D" and resid 89   and name HB% )
      4.200     2.200     1.800 peak   204 spectrum    1 weight  0.10000E+01 volume  0.15662E-02 ppm1      0.687 ppm2      1.588 CV     1
 ASSI {  205}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 107  and name HA  ))
      3.500     1.500     1.500 peak   205 spectrum    1 weight  0.10000E+01 volume  0.14162E-02 ppm1      0.681 ppm2      5.168 CV     1
 ASSI {  206}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 89   and name HA  ))
      4.600     2.700     1.400 peak   206 spectrum    1 weight  0.10000E+01 volume  0.13859E-02 ppm1      0.692 ppm2      4.111 CV     1
 ASSI {  208}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 52   and name HD2 ))
      2.900     1.000     1.000 peak   208 spectrum    1 weight  0.10000E+01 volume  0.17729E-02 ppm1      0.622 ppm2      7.303 CV     1
 ASSI {  209}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 63   and name HA  ))
      2.900     1.000     1.000 peak   209 spectrum    1 weight  0.10000E+01 volume  0.22936E-02 ppm1      0.609 ppm2      4.533 CV     1
 ASSI {  210}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 89   and name HA  ))
      2.100     0.500     0.500 peak   210 spectrum    1 weight  0.10000E+01 volume  0.97769E-02 ppm1      1.597 ppm2      4.109 CV     1
 ASSI {  211}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 80   and name HA  ))
      4.400     2.400     1.600 peak   211 spectrum    1 weight  0.10000E+01 volume  0.41698E-03 ppm1      0.680 ppm2      5.599 CV     1
 ASSI {  213}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 62   and name HA  ))
      3.300     1.400     1.400 peak   213 spectrum    1 weight  0.10000E+01 volume  0.15082E-02 ppm1      0.613 ppm2      4.401 CV     1
 ASSI {  214}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 61   and name HG11))
      3.200     1.300     1.300 peak   214 spectrum    1 weight  0.10000E+01 volume  0.35083E-02 ppm1      0.606 ppm2      1.529 CV     1
 ASSI {  215}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 64   and name HA  ))
      3.500     1.500     1.500 peak   215 spectrum    1 weight  0.10000E+01 volume  0.14315E-02 ppm1      0.608 ppm2      5.257 CV     1
 ASSI {  216}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 107  and name HB  ))
      4.000     2.000     2.000 peak   216 spectrum    1 weight  0.10000E+01 volume  0.17900E-02 ppm1      0.682 ppm2      2.010 CV     1
 ASSI {  217}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 37   and name HG12))
      2.900     1.100     1.100 peak   217 spectrum    1 weight  0.10000E+01 volume  0.15265E-02 ppm1      1.598 ppm2      0.528 CV     1
 ASSI {  219}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 109  and name HA  ))
      2.800     1.000     1.000 peak   219 spectrum    1 weight  0.10000E+01 volume  0.23007E-02 ppm1      0.693 ppm2      4.477 CV     1
 ASSI {  220}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 35   and name HB  ))
      3.500     1.500     1.500 peak   220 spectrum    1 weight  0.10000E+01 volume  0.23917E-02 ppm1      1.584 ppm2      4.583 CV     1
 ASSI {  222}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 86   and name HA  ))
      2.200     0.600     0.600 peak   222 spectrum    1 weight  0.10000E+01 volume  0.87819E-02 ppm1      1.590 ppm2      4.073 CV     1
 ASSI {  225}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 83   and name HA  ))
      3.300     1.400     1.400 peak   225 spectrum    1 weight  0.10000E+01 volume  0.23668E-02 ppm1      0.601 ppm2      5.090 CV     1
 ASSI {  226}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 83   and name HG2 ))
      2.700     0.900     0.900 peak   226 spectrum    1 weight  0.10000E+01 volume  0.58840E-02 ppm1      1.591 ppm2      2.559 CV     1
 OR {  226}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 83   and name HB1 ))
 ASSI {  228}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 35   and name HA  ))
      2.100     0.500     0.500 peak   228 spectrum    1 weight  0.10000E+01 volume  0.11695E-01 ppm1      1.590 ppm2      4.408 CV     1
 ASSI {  230}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 37   and name HG11))
      3.200     1.300     1.300 peak   230 spectrum    1 weight  0.10000E+01 volume  0.34491E-02 ppm1      0.685 ppm2      1.719 CV     1
 ASSI {  231}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 37   and name HB  ))
      2.300     0.700     0.700 peak   231 spectrum    1 weight  0.10000E+01 volume  0.57268E-02 ppm1      0.682 ppm2      1.890 CV     1
 ASSI {  232}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 88   and name HB1 ))
      2.900     2.900     3.100 peak   232 spectrum    1 weight  0.10000E+01 volume  0.64045E-03 ppm1      1.587 ppm2      3.859 CV     1
 ASSI {  233}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 37   and name HA  ))
      2.400     0.700     0.700 peak   233 spectrum    1 weight  0.10000E+01 volume  0.48177E-02 ppm1      0.680 ppm2      4.204 CV     1
 ASSI {  235}
   (  segid "T22D" and resid 26   and name HB% )
   (( segid "T22D" and resid 116  and name HD2 ))
      3.300     3.300     2.700 peak   235 spectrum    1 weight  0.10000E+01 volume  0.16720E-02 ppm1      1.359 ppm2      3.614 CV     1
 ASSI {  237}
   (  segid "T22D" and resid 26   and name HB% )
   (( segid "T22D" and resid 26   and name HA  ))
      2.500     0.800     0.800 peak   237 spectrum    1 weight  0.10000E+01 volume  0.68999E-02 ppm1      1.364 ppm2      4.315 CV     1
 ASSI {  238}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "3T5T" and resid 5    and name H2''))
      3.400     1.400     1.400 peak   238 spectrum    1 weight  0.10000E+01 volume  0.12552E-02 ppm1      1.282 ppm2      2.442 CV     1
 ASSI {  239}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "T22D" and resid 111  and name HA  ))
      2.300     0.700     0.700 peak   239 spectrum    1 weight  0.10000E+01 volume  0.79478E-02 ppm1      1.289 ppm2      4.435 CV     1
 ASSI {  241}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "3T5T" and resid 5    and name H1' ))
      3.700     1.700     1.700 peak   241 spectrum    1 weight  0.10000E+01 volume  0.75696E-03 ppm1      1.290 ppm2      6.573 CV     1
 ASSI {  242}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "T22D" and resid 114  and name HA  ))
      2.000     0.500     0.500 peak   242 spectrum    1 weight  0.10000E+01 volume  0.21425E-01 ppm1      1.286 ppm2      4.009 CV     1
 ASSI {  244}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "T22D" and resid 111  and name HB2 ))
      3.900     1.900     1.900 peak   244 spectrum    1 weight  0.10000E+01 volume  0.12660E-02 ppm1      1.293 ppm2      3.221 CV     1
 ASSI {  245}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "T22D" and resid 111  and name HB1 ))
      2.700     2.700     3.300 peak   245 spectrum    1 weight  0.10000E+01 volume  0.11757E-02 ppm1      1.288 ppm2      2.937 CV     1
 ASSI {  248}
   (  segid "T22D" and resid 92   and name HB% )
   (( segid "T22D" and resid 55   and name HB2 ))
      3.100     1.200     1.200 peak   248 spectrum    1 weight  0.10000E+01 volume  0.44991E-03 ppm1      1.426 ppm2      3.253 CV     1
 ASSI {  252}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 79   and name HA1 ))
      3.900     1.900     1.900 peak   252 spectrum    1 weight  0.10000E+01 volume  0.96764E-03 ppm1      0.942 ppm2      3.784 CV     1
 OR {  252}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 79   and name HA1 ))
 ASSI {  253}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 79   and name HA2 ))
      3.900     1.900     1.900 peak   253 spectrum    1 weight  0.10000E+01 volume  0.64533E-03 ppm1      0.932 ppm2      3.939 CV     1
 ASSI {  254}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 63   and name HB1 ))
      3.000     1.100     1.100 peak   254 spectrum    1 weight  0.10000E+01 volume  0.37862E-02 ppm1      0.939 ppm2      1.997 CV     1
 OR {  254}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 63   and name HB1 ))
 OR {  254}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 63   and name HB2 ))
 ASSI {  255}
   (  segid "T22D" and resid 92   and name HB% )
   (( segid "T22D" and resid 92   and name HA  ))
      2.100     0.600     0.600 peak   255 spectrum    1 weight  0.10000E+01 volume  0.13701E-01 ppm1      1.415 ppm2      1.923 CV     1
 ASSI {  256}
   (  segid "T22D" and resid 92   and name HB% )
   (( segid "T22D" and resid 89   and name HA  ))
      2.500     0.800     0.800 peak   256 spectrum    1 weight  0.10000E+01 volume  0.45905E-02 ppm1      1.421 ppm2      4.107 CV     1
 ASSI {  257}
   (  segid "T22D" and resid 92   and name HB% )
   (  segid "T22D" and resid 55   and name HD% )
      2.500     0.800     0.800 peak   257 spectrum    1 weight  0.10000E+01 volume  0.39250E-02 ppm1      1.419 ppm2      7.779 CV     1
 ASSI {  258}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 80   and name HB1 ))
      3.200     1.300     1.300 peak   258 spectrum    1 weight  0.10000E+01 volume  0.41429E-02 ppm1      0.942 ppm2      2.174 CV     1
 OR {  258}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 80   and name HB1 ))
 ASSI {  259}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 64   and name HA  ))
      3.200     1.300     1.300 peak   259 spectrum    1 weight  0.10000E+01 volume  0.30664E-02 ppm1      0.943 ppm2      5.264 CV     1
 OR {  259}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 64   and name HA  ))
 ASSI {  260}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 80   and name HB2 ))
      2.600     0.900     0.900 peak   260 spectrum    1 weight  0.10000E+01 volume  0.32233E-02 ppm1      0.938 ppm2      2.773 CV     1
 OR {  260}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 80   and name HB2 ))
 ASSI {  261}
   (  segid "T22D" and resid 92   and name HB% )
   (  segid "T22D" and resid 58   and name HD% )
      2.800     1.000     1.000 peak   261 spectrum    1 weight  0.10000E+01 volume  0.29618E-02 ppm1      1.422 ppm2      7.357 CV     1
 ASSI {  263}
   (  segid "T22D" and resid 92   and name HB% )
   (( segid "T22D" and resid 58   and name HB1 ))
      3.100     1.200     1.200 peak   263 spectrum    1 weight  0.10000E+01 volume  0.25436E-02 ppm1      1.419 ppm2      2.886 CV     1
 ASSI {  264}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 80   and name HA  ))
      3.900     1.900     1.900 peak   264 spectrum    1 weight  0.10000E+01 volume  0.11005E-02 ppm1      0.942 ppm2      5.586 CV     1
 OR {  264}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 80   and name HA  ))
 ASSI {  265}
   (  segid "T22D" and resid 92   and name HB% )
   (( segid "T22D" and resid 58   and name HB2 ))
      2.800     1.000     1.000 peak   265 spectrum    1 weight  0.10000E+01 volume  0.20353E-02 ppm1      1.420 ppm2      3.668 CV     1
 ASSI {  266}
   (  segid "T22D" and resid 92   and name HB% )
   (  segid "T22D" and resid 55   and name HE% )
      2.800     1.000     1.000 peak   266 spectrum    1 weight  0.10000E+01 volume  0.30580E-02 ppm1      1.414 ppm2      7.309 CV     1
 ASSI {  267}
   (  segid "T22D" and resid 65   and name HG2%)
   (  segid "T22D" and resid 80   and name HD% )
      3.200     1.300     1.300 peak   267 spectrum    1 weight  0.10000E+01 volume  0.24900E-02 ppm1      0.939 ppm2      6.606 CV     1
 OR {  267}
   (  segid "T22D" and resid 65   and name HG1%)
   (  segid "T22D" and resid 80   and name HD% )
 ASSI {  269}
   (  segid "T22D" and resid 92   and name HB% )
   (  segid "T22D" and resid 58   and name HE% )
      3.700     1.700     1.700 peak   269 spectrum    1 weight  0.10000E+01 volume  0.83515E-03 ppm1      1.421 ppm2      6.962 CV     1
 ASSI {  270}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 48   and name HB1 ))
      3.600     1.600     1.600 peak   270 spectrum    1 weight  0.10000E+01 volume  0.85058E-03 ppm1      0.938 ppm2      2.990 CV     1
 OR {  270}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 48   and name HB1 ))
 ASSI {  271}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 65   and name HB  ))
      1.900     0.500     0.500 peak   271 spectrum    1 weight  0.10000E+01 volume  0.24053E-01 ppm1      0.942 ppm2      1.927 CV     1
 OR {  271}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 65   and name HB  ))
 ASSI {  272}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 65   and name HA  ))
      2.400     0.700     0.700 peak   272 spectrum    1 weight  0.10000E+01 volume  0.72752E-02 ppm1      0.945 ppm2      4.746 CV     1
 OR {  272}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 65   and name HA  ))
 ASSI {  273}
   (  segid "T22D" and resid 65   and name HG2%)
   (  segid "T22D" and resid 80   and name HE% )
      4.700     2.800     1.300 peak   273 spectrum    1 weight  0.10000E+01 volume  0.42965E-03 ppm1      0.937 ppm2      7.162 CV     1
 OR {  273}
   (  segid "T22D" and resid 65   and name HG1%)
   (  segid "T22D" and resid 80   and name HE% )
 ASSI {  277}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 63   and name HG2 ))
      2.900     1.000     1.000 peak   277 spectrum    1 weight  0.10000E+01 volume  0.30344E-02 ppm1      0.944 ppm2      2.356 CV     1
 OR {  277}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 63   and name HG2 ))
 ASSI {  278}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 66   and name HA  ))
      3.400     1.400     1.400 peak   278 spectrum    1 weight  0.10000E+01 volume  0.13831E-02 ppm1      0.941 ppm2      3.748 CV     1
 OR {  278}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "T22D" and resid 66   and name HA  ))
 ASSI {  279}
   (  segid "T22D" and resid 65   and name HG2%)
   (  segid "T22D" and resid 67   and name HD1%)
      2.100     0.500     0.500 peak   279 spectrum    1 weight  0.10000E+01 volume  0.14578E-01 ppm1      0.937 ppm2      0.762 CV     1
 ASSI {  281}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 52   and name HD2 ))
      2.700     0.900     0.900 peak   281 spectrum    1 weight  0.10000E+01 volume  0.30853E-02 ppm1      1.337 ppm2      7.306 CV     1
 ASSI {  282}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 64   and name HA  ))
      2.200     0.600     0.600 peak   282 spectrum    1 weight  0.10000E+01 volume  0.79929E-02 ppm1      1.334 ppm2      5.261 CV     1
 ASSI {  284}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 52   and name HA  ))
      2.300     0.700     0.700 peak   284 spectrum    1 weight  0.10000E+01 volume  0.65221E-02 ppm1      1.333 ppm2      3.748 CV     1
 ASSI {  285}
   (  segid "T22D" and resid 64   and name HB% )
   (  segid "T22D" and resid 81   and name HG1%)
      2.500     0.800     0.800 peak   285 spectrum    1 weight  0.10000E+01 volume  0.86980E-02 ppm1      1.332 ppm2      0.531 CV     1
 ASSI {  287}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 52   and name HB1 ))
      2.200     0.600     0.600 peak   287 spectrum    1 weight  0.10000E+01 volume  0.62885E-02 ppm1      1.331 ppm2      3.591 CV     1
 OR {  287}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 52   and name HB2 ))
 ASSI {  288}
   (  segid "T22D" and resid 64   and name HB% )
   (  segid "T22D" and resid 81   and name HG2%)
      2.200     0.600     0.600 peak   288 spectrum    1 weight  0.10000E+01 volume  0.98882E-02 ppm1      1.331 ppm2      0.269 CV     1
 ASSI {  289}
   (  segid "T22D" and resid 120  and name HG2%)
   (( segid "T22D" and resid 120  and name HA  ))
      2.800     0.900     0.900 peak   289 spectrum    1 weight  0.10000E+01 volume  0.37386E-02 ppm1      0.927 ppm2      4.118 CV     1
 ASSI {  290}
   (  segid "T22D" and resid 66   and name HG1%)
   (( segid "T22D" and resid 79   and name HA1 ))
      3.800     1.800     1.800 peak   290 spectrum    1 weight  0.10000E+01 volume  0.91926E-03 ppm1      0.715 ppm2      3.804 CV     1
 ASSI {  291}
   (  segid "T22D" and resid 66   and name HG1%)
   (( segid "T22D" and resid 79   and name HA2 ))
      4.000     2.000     2.000 peak   291 spectrum    1 weight  0.10000E+01 volume  0.96784E-03 ppm1      0.715 ppm2      3.950 CV     1
 ASSI {  292}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 35   and name HB  ))
      2.600     0.800     0.800 peak   292 spectrum    1 weight  0.10000E+01 volume  0.38680E-02 ppm1      1.159 ppm2      4.585 CV     1
 ASSI {  293}
   (  segid "T22D" and resid 66   and name HG1%)
   (( segid "T22D" and resid 75   and name HB2 ))
      2.700     0.900     0.900 peak   293 spectrum    1 weight  0.10000E+01 volume  0.43457E-02 ppm1      0.716 ppm2      4.209 CV     1
 ASSI {  295}
   (  segid "T22D" and resid 66   and name HG1%)
   (( segid "T22D" and resid 75   and name HA  ))
      2.600     0.800     0.800 peak   295 spectrum    1 weight  0.10000E+01 volume  0.42598E-02 ppm1      0.717 ppm2      4.186 CV     1
 ASSI {  296}
   (  segid "T22D" and resid 120  and name HG2%)
   (( segid "T22D" and resid 120  and name HB  ))
      2.500     0.800     0.800 peak   296 spectrum    1 weight  0.10000E+01 volume  0.58307E-02 ppm1      0.933 ppm2      2.090 CV     1
 ASSI {  297}
   (  segid "T22D" and resid 66   and name HG1%)
   (( segid "T22D" and resid 46   and name HB  ))
      2.400     0.700     0.700 peak   297 spectrum    1 weight  0.10000E+01 volume  0.62339E-02 ppm1      0.719 ppm2      3.746 CV     1
 ASSI {  298}
   (  segid "T22D" and resid 66   and name HG1%)
   (( segid "T22D" and resid 66   and name HB  ))
      2.200     0.600     0.600 peak   298 spectrum    1 weight  0.10000E+01 volume  0.10815E-01 ppm1      0.719 ppm2      1.859 CV     1
 ASSI {  299}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 62   and name HB2 ))
      2.900     1.000     1.000 peak   299 spectrum    1 weight  0.10000E+01 volume  0.36917E-02 ppm1      1.154 ppm2      1.814 CV     1
 ASSI {  300}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 62   and name HB1 ))
      2.600     0.900     0.900 peak   300 spectrum    1 weight  0.10000E+01 volume  0.41818E-02 ppm1      1.159 ppm2      1.699 CV     1
 ASSI {  301}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 36   and name HD2 ))
      2.300     2.300     3.700 peak   301 spectrum    1 weight  0.10000E+01 volume  0.27067E-02 ppm1      1.166 ppm2      1.605 CV     1
 ASSI {  302}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 83   and name HA  ))
      3.500     1.500     1.500 peak   302 spectrum    1 weight  0.10000E+01 volume  0.12235E-02 ppm1      1.175 ppm2      5.095 CV     1
 ASSI {  303}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 36   and name HA  ))
      2.600     0.800     0.800 peak   303 spectrum    1 weight  0.10000E+01 volume  0.43228E-02 ppm1      1.166 ppm2      4.956 CV     1
 ASSI {  306}
   (  segid "T22D" and resid 64   and name HB% )
   (  segid "T22D" and resid 55   and name HD% )
      4.200     2.200     1.800 peak   306 spectrum    1 weight  0.10000E+01 volume  0.65492E-03 ppm1      1.339 ppm2      7.784 CV     1
 ASSI {  307}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 62   and name HG2 ))
      2.900     1.100     1.100 peak   307 spectrum    1 weight  0.10000E+01 volume  0.53223E-02 ppm1      1.161 ppm2      2.102 CV     1
 OR {  307}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 62   and name HG1 ))
 ASSI {  309}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 63   and name HG1 ))
      2.400     2.400     3.600 peak   309 spectrum    1 weight  0.10000E+01 volume  0.23006E-02 ppm1      1.174 ppm2      2.010 CV     1
 ASSI {  310}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 36   and name HB1 ))
      2.600     2.600     3.400 peak   310 spectrum    1 weight  0.10000E+01 volume  0.13377E-02 ppm1      1.152 ppm2      1.763 CV     1
 ASSI {  311}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 36   and name HG2 ))
      2.500     2.500     3.500 peak   311 spectrum    1 weight  0.10000E+01 volume  0.18146E-02 ppm1      1.163 ppm2      1.412 CV     1
 ASSI {  312}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 36   and name HD1 ))
      2.200     2.200     3.800 peak   312 spectrum    1 weight  0.10000E+01 volume  0.35692E-02 ppm1      1.163 ppm2      1.498 CV     1
 ASSI {  313}
   (  segid "T22D" and resid 32   and name HG2%)
   (( segid "T22D" and resid 32   and name HA  ))
      2.000     0.500     0.500 peak   313 spectrum    1 weight  0.10000E+01 volume  0.23443E-01 ppm1      1.075 ppm2      4.659 CV     1
 ASSI {  314}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 82   and name HB  ))
      2.100     0.600     0.600 peak   314 spectrum    1 weight  0.10000E+01 volume  0.12054E-01 ppm1      1.161 ppm2      3.912 CV     1
 ASSI {  316}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 82   and name HA  ))
      2.400     0.700     0.700 peak   316 spectrum    1 weight  0.10000E+01 volume  0.64562E-02 ppm1      1.162 ppm2      5.241 CV     1
 ASSI {  320}
   (  segid "T22D" and resid 81   and name HG2%)
   (  segid "T22D" and resid 39   and name HG2%)
      2.300     0.700     0.700 peak   320 spectrum    1 weight  0.10000E+01 volume  0.75734E-02 ppm1      0.273 ppm2      0.594 CV     1
 ASSI {  321}
   (  segid "T22D" and resid 105  and name HB% )
   (  segid "T22D" and resid 100  and name HD1%)
      2.400     0.700     0.700 peak   321 spectrum    1 weight  0.10000E+01 volume  0.61301E-02 ppm1      1.312 ppm2      0.241 CV     1
 ASSI {  322}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 100  and name HG12))
      2.800     1.000     1.000 peak   322 spectrum    1 weight  0.10000E+01 volume  0.92435E-03 ppm1      1.315 ppm2     -0.499 CV     1
 ASSI {  323}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 98   and name HG2 ))
      3.100     1.200     1.200 peak   323 spectrum    1 weight  0.10000E+01 volume  0.12986E-02 ppm1      1.313 ppm2      1.988 CV     1
 OR {  323}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 98   and name HG1 ))
 ASSI {  324}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 106  and name HA  ))
      3.600     1.700     1.700 peak   324 spectrum    1 weight  0.10000E+01 volume  0.10978E-02 ppm1      1.321 ppm2      5.432 CV     1
 ASSI {  325}
   (  segid "T22D" and resid 72   and name HG2%)
   (( segid "T22D" and resid 71   and name HB2 ))
      2.600     0.800     0.800 peak   325 spectrum    1 weight  0.10000E+01 volume  0.44941E-02 ppm1      1.178 ppm2      2.856 CV     1
 ASSI {  327}
   (  segid "T22D" and resid 81   and name HG2%)
   (( segid "T22D" and resid 51   and name HB1 ))
      2.700     0.900     0.900 peak   327 spectrum    1 weight  0.10000E+01 volume  0.18069E-02 ppm1      0.273 ppm2      1.913 CV     1
 ASSI {  328}
   (  segid "T22D" and resid 81   and name HG2%)
   (  segid "T22D" and resid 81   and name HG1%)
      2.000     0.500     0.500 peak   328 spectrum    1 weight  0.10000E+01 volume  0.18510E-01 ppm1      0.273 ppm2      0.528 CV     1
 ASSI {  329}
   (  segid "T22D" and resid 81   and name HG2%)
   (  segid "T22D" and resid 55   and name HD% )
      2.900     1.000     1.000 peak   329 spectrum    1 weight  0.10000E+01 volume  0.23283E-02 ppm1      0.274 ppm2      7.787 CV     1
 ASSI {  330}
   (  segid "T22D" and resid 72   and name HG2%)
   (( segid "T22D" and resid 72   and name HA  ))
      2.100     0.500     0.500 peak   330 spectrum    1 weight  0.10000E+01 volume  0.20537E-01 ppm1      1.178 ppm2      4.364 CV     1
 ASSI {  332}
   (  segid "T22D" and resid 81   and name HG2%)
   (  segid "T22D" and resid 55   and name HE% )
      3.200     1.300     1.300 peak   332 spectrum    1 weight  0.10000E+01 volume  0.12778E-02 ppm1      0.274 ppm2      7.302 CV     1
 ASSI {  333}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 75   and name HB1 ))
      3.700     1.700     1.700 peak   333 spectrum    1 weight  0.10000E+01 volume  0.15808E-02 ppm1      0.968 ppm2      4.049 CV     1
 ASSI {  334}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 73   and name HB2 ))
      3.200     1.300     1.300 peak   334 spectrum    1 weight  0.10000E+01 volume  0.20517E-02 ppm1      0.964 ppm2      2.377 CV     1
 OR {  334}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 73   and name HB1 ))
 ASSI {  335}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 66   and name HB  ))
      3.000     1.100     1.100 peak   335 spectrum    1 weight  0.10000E+01 volume  0.16693E-02 ppm1      0.951 ppm2      1.861 CV     1
 ASSI {  336}
   (  segid "T22D" and resid 81   and name HG2%)
   (( segid "T22D" and resid 64   and name HA  ))
      2.700     0.900     0.900 peak   336 spectrum    1 weight  0.10000E+01 volume  0.39282E-02 ppm1      0.276 ppm2      5.260 CV     1
 ASSI {  337}
   (  segid "T22D" and resid 72   and name HG2%)
   (( segid "T22D" and resid 72   and name HB  ))
      1.900     0.400     0.400 peak   337 spectrum    1 weight  0.10000E+01 volume  0.25478E-01 ppm1      1.176 ppm2      4.325 CV     1
 ASSI {  338}
   (  segid "T22D" and resid 81   and name HG2%)
   (( segid "T22D" and resid 81   and name HB  ))
      2.300     0.600     0.600 peak   338 spectrum    1 weight  0.10000E+01 volume  0.68978E-02 ppm1      0.273 ppm2      1.088 CV     1
 ASSI {  339}
   (  segid "T22D" and resid 72   and name HG2%)
   (( segid "T22D" and resid 71   and name HB1 ))
      2.900     1.000     1.000 peak   339 spectrum    1 weight  0.10000E+01 volume  0.44662E-02 ppm1      1.179 ppm2      3.005 CV     1
 ASSI {  342}
   (  segid "T22D" and resid 72   and name HG2%)
   (( segid "T22D" and resid 69   and name HB1 ))
      3.700     1.700     1.700 peak   342 spectrum    1 weight  0.10000E+01 volume  0.11902E-02 ppm1      1.183 ppm2      2.504 CV     1
 ASSI {  345}
   (  segid "T22D" and resid 81   and name HG2%)
   (( segid "T22D" and resid 51   and name HA  ))
      3.700     1.700     1.700 peak   345 spectrum    1 weight  0.10000E+01 volume  0.11271E-02 ppm1      0.263 ppm2      4.129 CV     1
 ASSI {  346}
   (  segid "T22D" and resid 81   and name HG2%)
   (( segid "T22D" and resid 80   and name HA  ))
      3.500     1.500     1.500 peak   346 spectrum    1 weight  0.10000E+01 volume  0.13839E-02 ppm1      0.270 ppm2      5.580 CV     1
 ASSI {  348}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 41   and name HA1 ))
      3.200     1.300     1.300 peak   348 spectrum    1 weight  0.10000E+01 volume  0.26362E-02 ppm1      1.291 ppm2      4.006 CV     1
 ASSI {  349}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 68   and name HB  ))
      1.900     0.500     0.500 peak   349 spectrum    1 weight  0.10000E+01 volume  0.19183E-01 ppm1      0.969 ppm2      3.673 CV     1
 ASSI {  350}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 75   and name HA  ))
      2.000     0.500     0.500 peak   350 spectrum    1 weight  0.10000E+01 volume  0.10560E-01 ppm1      0.970 ppm2      4.181 CV     1
 ASSI {  351}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 73   and name HA  ))
      3.100     1.200     1.200 peak   351 spectrum    1 weight  0.10000E+01 volume  0.43720E-02 ppm1      0.971 ppm2      3.977 CV     1
 ASSI {  356}
   (  segid "T22D" and resid 105  and name HB% )
   (  segid "T22D" and resid 39   and name HG1%)
      2.400     0.700     0.700 peak   356 spectrum    1 weight  0.10000E+01 volume  0.58891E-02 ppm1      1.309 ppm2      0.681 CV     1
 ASSI {  358}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 97   and name HA  ))
      3.900     1.900     1.900 peak   358 spectrum    1 weight  0.10000E+01 volume  0.83857E-03 ppm1      1.322 ppm2      6.040 CV     1
 ASSI {  360}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 98   and name HD2 ))
      3.000     1.100     1.100 peak   360 spectrum    1 weight  0.10000E+01 volume  0.14495E-02 ppm1      1.311 ppm2      3.172 CV     1
 ASSI {  361}
   (  segid "T22D" and resid 39   and name HG2%)
   (( segid "T22D" and resid 39   and name HA  ))
      2.700     0.900     0.900 peak   361 spectrum    1 weight  0.10000E+01 volume  0.30546E-02 ppm1      0.614 ppm2      4.376 CV     1
 ASSI {  363}
   (  segid "T22D" and resid 39   and name HG2%)
   (( segid "T22D" and resid 55   and name HZ  ))
      2.700     0.900     0.900 peak   363 spectrum    1 weight  0.10000E+01 volume  0.23440E-02 ppm1      0.602 ppm2      7.181 CV     1
 ASSI {  364}
   (  segid "T22D" and resid 118  and name HG2%)
   (( segid "T22D" and resid 118  and name HB  ))
      2.200     0.600     0.600 peak   364 spectrum    1 weight  0.10000E+01 volume  0.13713E-01 ppm1      1.187 ppm2      4.202 CV     1
 ASSI {  365}
   (  segid "T22D" and resid 81   and name HG1%)
   (( segid "T22D" and resid 83   and name HG1 ))
      4.000     2.000     2.000 peak   365 spectrum    1 weight  0.10000E+01 volume  0.70475E-03 ppm1      0.526 ppm2      2.257 CV     1
 ASSI {  366}
   (  segid "T22D" and resid 81   and name HG1%)
   (( segid "T22D" and resid 61   and name HG11))
      4.500     2.600     1.500 peak   366 spectrum    1 weight  0.10000E+01 volume  0.61226E-03 ppm1      0.532 ppm2      1.536 CV     1
 ASSI {  368}
   (  segid "T22D" and resid 39   and name HG2%)
   (  segid "T22D" and resid 55   and name HE% )
      2.800     1.000     1.000 peak   368 spectrum    1 weight  0.10000E+01 volume  0.25025E-02 ppm1      0.600 ppm2      7.303 CV     1
 ASSI {  370}
   (  segid "T22D" and resid 39   and name HG2%)
   (( segid "T22D" and resid 39   and name HB  ))
      2.100     0.600     0.600 peak   370 spectrum    1 weight  0.10000E+01 volume  0.92322E-02 ppm1      0.603 ppm2      1.445 CV     1
 ASSI {  371}
   (  segid "T22D" and resid 81   and name HG1%)
   (( segid "T22D" and resid 81   and name HB  ))
      2.200     0.600     0.600 peak   371 spectrum    1 weight  0.10000E+01 volume  0.72502E-02 ppm1      0.534 ppm2      1.089 CV     1
 ASSI {  372}
   (  segid "T22D" and resid 81   and name HG1%)
   (( segid "T22D" and resid 55   and name HB2 ))
      3.100     1.200     1.200 peak   372 spectrum    1 weight  0.10000E+01 volume  0.23987E-02 ppm1      0.533 ppm2      3.257 CV     1
 ASSI {  374}
   (  segid "T22D" and resid 81   and name HG1%)
   (( segid "T22D" and resid 55   and name HB1 ))
      2.600     0.900     0.900 peak   374 spectrum    1 weight  0.10000E+01 volume  0.19789E-02 ppm1      0.528 ppm2      2.869 CV     1
 ASSI {  376}
   (  segid "T22D" and resid 81   and name HG1%)
   (( segid "T22D" and resid 64   and name HA  ))
      3.200     1.300     1.300 peak   376 spectrum    1 weight  0.10000E+01 volume  0.26241E-02 ppm1      0.529 ppm2      5.256 CV     1
 ASSI {  377}
   (  segid "T22D" and resid 81   and name HG1%)
   (  segid "T22D" and resid 55   and name HD% )
      2.900     1.100     1.100 peak   377 spectrum    1 weight  0.10000E+01 volume  0.21294E-02 ppm1      0.530 ppm2      7.790 CV     1
 ASSI {  378}
   (  segid "T22D" and resid 39   and name HG1%)
   (( segid "T22D" and resid 39   and name HB  ))
      2.100     0.600     0.600 peak   378 spectrum    1 weight  0.10000E+01 volume  0.76217E-02 ppm1      0.684 ppm2      1.445 CV     1
 ASSI {  379}
   (  segid "T22D" and resid 39   and name HG1%)
   (( segid "T22D" and resid 39   and name HA  ))
      2.500     0.800     0.800 peak   379 spectrum    1 weight  0.10000E+01 volume  0.38836E-02 ppm1      0.682 ppm2      4.375 CV     1
 ASSI {  380}
   (  segid "T22D" and resid 66   and name HG2%)
   (( segid "T22D" and resid 48   and name HB2 ))
      4.700     2.800     1.300 peak   380 spectrum    1 weight  0.10000E+01 volume  0.49287E-03 ppm1      0.606 ppm2      2.757 CV     1
 ASSI {  381}
   (  segid "T22D" and resid 66   and name HG2%)
   (( segid "T22D" and resid 48   and name HB1 ))
      4.700     2.800     1.300 peak   381 spectrum    1 weight  0.10000E+01 volume  0.42444E-03 ppm1      0.604 ppm2      2.987 CV     1
 ASSI {  382}
   (  segid "T22D" and resid 39   and name HG1%)
   (  segid "T22D" and resid 55   and name HE% )
      3.200     1.300     1.300 peak   382 spectrum    1 weight  0.10000E+01 volume  0.14647E-02 ppm1      0.672 ppm2      7.303 CV     1
 ASSI {  383}
   (  segid "T22D" and resid 66   and name HG2%)
   (( segid "T22D" and resid 48   and name HA  ))
      2.300     0.700     0.700 peak   383 spectrum    1 weight  0.10000E+01 volume  0.53899E-02 ppm1      0.592 ppm2      4.055 CV     1
 ASSI {  384}
   (  segid "T22D" and resid 66   and name HG2%)
   (( segid "T22D" and resid 66   and name HB  ))
      2.200     0.600     0.600 peak   384 spectrum    1 weight  0.10000E+01 volume  0.98611E-02 ppm1      0.597 ppm2      1.859 CV     1
 ASSI {  385}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HB2 ))
      3.100     1.200     1.200 peak   385 spectrum    1 weight  0.10000E+01 volume  0.23676E-02 ppm1      0.799 ppm2      1.843 CV     1
 OR {  385}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HB1 ))
 OR {  385}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HG2 ))
 ASSI {  386}
   (  segid "T22D" and resid 66   and name HG2%)
   (( segid "T22D" and resid 66   and name HA  ))
      2.300     0.700     0.700 peak   386 spectrum    1 weight  0.10000E+01 volume  0.60717E-02 ppm1      0.596 ppm2      3.736 CV     1
 ASSI {  388}
   (  segid "T22D" and resid 35   and name HG2%)
   (  segid "T22D" and resid 89   and name HB% )
      2.900     1.000     1.000 peak   388 spectrum    1 weight  0.10000E+01 volume  0.61355E-02 ppm1      0.799 ppm2      1.596 CV     1
 ASSI {  389}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 35   and name HA  ))
      2.200     0.600     0.600 peak   389 spectrum    1 weight  0.10000E+01 volume  0.12784E-01 ppm1      0.802 ppm2      4.408 CV     1
 ASSI {  390}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HB2 ))
      2.900     1.100     1.100 peak   390 spectrum    1 weight  0.10000E+01 volume  0.28634E-02 ppm1      0.805 ppm2      1.922 CV     1
 OR {  390}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HB1 ))
 ASSI {  391}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HA  ))
      2.300     0.600     0.600 peak   391 spectrum    1 weight  0.10000E+01 volume  0.96905E-02 ppm1      0.802 ppm2      4.069 CV     1
 ASSI {  392}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 34   and name HB1 ))
      3.100     1.200     1.200 peak   392 spectrum    1 weight  0.10000E+01 volume  0.24104E-02 ppm1      0.802 ppm2      2.743 CV     1
 ASSI {  393}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 35   and name HB  ))
      2.100     0.500     0.500 peak   393 spectrum    1 weight  0.10000E+01 volume  0.14463E-01 ppm1      0.802 ppm2      4.583 CV     1
 ASSI {  394}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 83   and name HB1 ))
      3.800     1.800     1.800 peak   394 spectrum    1 weight  0.10000E+01 volume  0.15536E-02 ppm1      0.806 ppm2      2.560 CV     1
 OR {  394}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 83   and name HG2 ))
 ASSI {  395}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 34   and name HB2 ))
      3.500     1.500     1.500 peak   395 spectrum    1 weight  0.10000E+01 volume  0.86171E-03 ppm1      0.804 ppm2      3.524 CV     1
 ASSI {  397}
   (  segid "T22D" and resid 107  and name HG1%)
   (  segid "T22D" and resid 55   and name HE% )
      2.600     0.900     0.900 peak   397 spectrum    1 weight  0.10000E+01 volume  0.26699E-02 ppm1      1.037 ppm2      7.304 CV     1
 OR {  397}
   (  segid "T22D" and resid 107  and name HG2%)
   (  segid "T22D" and resid 55   and name HE% )
 ASSI {  398}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 96   and name HA  ))
      2.900     1.100     1.100 peak   398 spectrum    1 weight  0.10000E+01 volume  0.36453E-02 ppm1      1.034 ppm2      4.703 CV     1
 ASSI {  399}
   (  segid "T22D" and resid 107  and name HG1%)
   (( segid "T22D" and resid 38   and name HA  ))
      3.300     3.300     2.700 peak   399 spectrum    1 weight  0.10000E+01 volume  0.20211E-02 ppm1      1.061 ppm2      4.638 CV     1
 ASSI {  400}
   (  segid "T22D" and resid 107  and name HG2%)
   (  segid "T22D" and resid 100  and name HD1%)
      3.100     1.200     1.200 peak   400 spectrum    1 weight  0.10000E+01 volume  0.22694E-02 ppm1      1.034 ppm2      0.242 CV     1
 ASSI {  401}
   (  segid "T22D" and resid 112  and name HD2%)
   (( segid "T22D" and resid 112  and name HB2 ))
      3.000     1.100     1.100 peak   401 spectrum    1 weight  0.10000E+01 volume  0.67981E-02 ppm1      0.641 ppm2      1.366 CV     1
 ASSI {  404}
   (  segid "T22D" and resid 107  and name HG1%)
   (( segid "T22D" and resid 93   and name HA  ))
      2.300     0.600     0.600 peak   404 spectrum    1 weight  0.10000E+01 volume  0.78052E-02 ppm1      1.048 ppm2      4.259 CV     1
 OR {  404}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 93   and name HA  ))
 ASSI {  406}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 101  and name HB1 ))
      3.200     1.300     1.300 peak   406 spectrum    1 weight  0.10000E+01 volume  0.31547E-02 ppm1      1.273 ppm2      2.247 CV     1
 ASSI {  407}
   (  segid "T22D" and resid 112  and name HD2%)
   (  segid "T22D" and resid 111  and name HD% )
      3.300     1.400     1.400 peak   407 spectrum    1 weight  0.10000E+01 volume  0.22578E-02 ppm1      0.635 ppm2      7.096 CV     1
 ASSI {  409}
   (  segid "T22D" and resid 112  and name HD2%)
   (  segid "T22D" and resid 111  and name HE% )
      2.400     0.700     0.700 peak   409 spectrum    1 weight  0.10000E+01 volume  0.66201E-02 ppm1      0.634 ppm2      6.728 CV     1
 ASSI {  410}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 50   and name HB  ))
      2.000     0.500     0.500 peak   410 spectrum    1 weight  0.10000E+01 volume  0.17916E-01 ppm1      1.269 ppm2      4.489 CV     1
 ASSI {  411}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 42   and name HG  ))
      2.300     0.700     0.700 peak   411 spectrum    1 weight  0.10000E+01 volume  0.43970E-02 ppm1      0.668 ppm2      1.269 CV     1
 ASSI {  412}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 42   and name HB2 ))
      2.300     0.700     0.700 peak   412 spectrum    1 weight  0.10000E+01 volume  0.26836E-01 ppm1      0.640 ppm2      0.951 CV     1
 ASSI {  413}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 53   and name HG2 ))
      3.700     3.700     2.300 peak   413 spectrum    1 weight  0.10000E+01 volume  0.12686E-02 ppm1      1.273 ppm2      2.665 CV     1
 ASSI {  414}
   (  segid "T22D" and resid 50   and name HG2%)
   (  segid "T22D" and resid 100  and name HG2%)
      2.600     0.900     0.900 peak   414 spectrum    1 weight  0.10000E+01 volume  0.36907E-02 ppm1      1.272 ppm2      0.427 CV     1
 ASSI {  415}
   (  segid "T22D" and resid 107  and name HG1%)
   (( segid "T22D" and resid 93   and name HB1 ))
      3.600     1.700     1.700 peak   415 spectrum    1 weight  0.10000E+01 volume  0.12847E-02 ppm1      1.050 ppm2      3.039 CV     1
 ASSI {  416}
   (  segid "T22D" and resid 112  and name HD2%)
   (( segid "T22D" and resid 112  and name HB1 ))
      2.300     0.600     0.600 peak   416 spectrum    1 weight  0.10000E+01 volume  0.88849E-02 ppm1      0.633 ppm2      1.495 CV     1
 ASSI {  417}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 50   and name HA  ))
      2.200     0.600     0.600 peak   417 spectrum    1 weight  0.10000E+01 volume  0.12724E-01 ppm1      1.270 ppm2      4.178 CV     1
 ASSI {  419}
   (  segid "T22D" and resid 107  and name HG1%)
   (  segid "T22D" and resid 37   and name HG2%)
      1.800     0.400     0.400 peak   419 spectrum    1 weight  0.10000E+01 volume  0.23723E-01 ppm1      1.047 ppm2      0.680 CV     1
 ASSI {  420}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 46   and name HB  ))
      4.400     2.400     1.600 peak   420 spectrum    1 weight  0.10000E+01 volume  0.11043E-02 ppm1      1.274 ppm2      3.746 CV     1
 ASSI {  421}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 101  and name HB2 ))
      2.900     1.100     1.100 peak   421 spectrum    1 weight  0.10000E+01 volume  0.20550E-02 ppm1      1.270 ppm2      3.003 CV     1
 ASSI {  422}
   (  segid "T22D" and resid 112  and name HD2%)
   (( segid "T22D" and resid 112  and name HA  ))
      2.000     0.500     0.500 peak   422 spectrum    1 weight  0.10000E+01 volume  0.16707E-01 ppm1      0.635 ppm2      3.668 CV     1
 ASSI {  423}
   (  segid "T22D" and resid 107  and name HG1%)
   (( segid "T22D" and resid 107  and name HA  ))
      2.200     0.600     0.600 peak   423 spectrum    1 weight  0.10000E+01 volume  0.87097E-02 ppm1      1.041 ppm2      5.168 CV     1
 ASSI {  425}
   (  segid "T22D" and resid 107  and name HG1%)
   (( segid "T22D" and resid 93   and name HB2 ))
      3.600     1.600     1.600 peak   425 spectrum    1 weight  0.10000E+01 volume  0.20579E-02 ppm1      1.046 ppm2      2.799 CV     1
 ASSI {  426}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 55   and name HZ  ))
      2.500     0.800     0.800 peak   426 spectrum    1 weight  0.10000E+01 volume  0.39589E-02 ppm1      1.038 ppm2      7.182 CV     1
 OR {  426}
   (  segid "T22D" and resid 107  and name HG1%)
   (( segid "T22D" and resid 55   and name HZ  ))
 ASSI {  427}
   (  segid "T22D" and resid 107  and name HG1%)
   (( segid "T22D" and resid 107  and name HB  ))
      2.000     0.500     0.500 peak   427 spectrum    1 weight  0.10000E+01 volume  0.15756E-01 ppm1      1.038 ppm2      2.008 CV     1
 OR {  427}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 107  and name HB  ))
 ASSI {  428}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 39   and name HA  ))
      2.900     1.000     1.000 peak   428 spectrum    1 weight  0.10000E+01 volume  0.26107E-02 ppm1      1.037 ppm2      4.376 CV     1
 ASSI {  429}
   (  segid "T22D" and resid 107  and name HG2%)
   (  segid "T22D" and resid 54   and name HE% )
      2.700     2.700     3.300 peak   429 spectrum    1 weight  0.10000E+01 volume  0.11791E-02 ppm1      1.033 ppm2      6.456 CV     1
 OR {  429}
   (  segid "T22D" and resid 107  and name HG1%)
   (  segid "T22D" and resid 54   and name HE% )
 ASSI {  431}
   (  segid "T22D" and resid 107  and name HG1%)
   (  segid "T22D" and resid 92   and name HB% )
      2.900     1.100     1.100 peak   431 spectrum    1 weight  0.10000E+01 volume  0.16124E-02 ppm1      1.042 ppm2      1.433 CV     1
 ASSI {  433}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 46   and name HA  ))
      2.200     0.600     0.600 peak   433 spectrum    1 weight  0.10000E+01 volume  0.11235E-01 ppm1      1.143 ppm2      4.022 CV     1
 ASSI {  434}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 46   and name HA  ))
      3.000     1.100     1.100 peak   434 spectrum    1 weight  0.10000E+01 volume  0.33861E-02 ppm1      1.266 ppm2      4.017 CV     1
 ASSI {  435}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 43   and name HD1 ))
      3.400     1.400     1.400 peak   435 spectrum    1 weight  0.10000E+01 volume  0.33257E-02 ppm1      0.661 ppm2      3.787 CV     1
 ASSI {  438}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 50   and name HB  ))
      2.300     0.700     0.700 peak   438 spectrum    1 weight  0.10000E+01 volume  0.56301E-02 ppm1      1.141 ppm2      4.488 CV     1
 ASSI {  440}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 101  and name HB1 ))
      3.600     1.600     1.600 peak   440 spectrum    1 weight  0.10000E+01 volume  0.13030E-02 ppm1      1.140 ppm2      2.236 CV     1
 ASSI {  441}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 98   and name HB1 ))
      3.800     1.800     1.800 peak   441 spectrum    1 weight  0.10000E+01 volume  0.14708E-02 ppm1      1.029 ppm2      2.118 CV     1
 ASSI {  442}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 46   and name HB  ))
      2.100     0.500     0.500 peak   442 spectrum    1 weight  0.10000E+01 volume  0.11720E-01 ppm1      1.142 ppm2      3.737 CV     1
 ASSI {  444}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 42   and name HA  ))
      2.200     0.600     0.600 peak   444 spectrum    1 weight  0.10000E+01 volume  0.54562E-02 ppm1      0.668 ppm2      4.316 CV     1
 ASSI {  445}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 97   and name HA  ))
      2.600     2.600     3.400 peak   445 spectrum    1 weight  0.10000E+01 volume  0.14304E-02 ppm1      1.024 ppm2      6.046 CV     1
 ASSI {  446}
   (  segid "T22D" and resid 109  and name HD2%)
   (  segid "T22D" and resid 111  and name HE% )
      3.900     1.900     1.900 peak   446 spectrum    1 weight  0.10000E+01 volume  0.22575E-02 ppm1      0.887 ppm2      6.726 CV     1
 ASSI {  447}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 96   and name HB1 ))
      4.100     2.100     1.900 peak   447 spectrum    1 weight  0.10000E+01 volume  0.67264E-03 ppm1      1.043 ppm2      2.508 CV     1
 ASSI {  448}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 98   and name HD1 ))
      2.800     0.900     0.900 peak   448 spectrum    1 weight  0.10000E+01 volume  0.34019E-02 ppm1      1.023 ppm2      3.590 CV     1
 ASSI {  449}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 106  and name HA  ))
      3.500     1.600     1.600 peak   449 spectrum    1 weight  0.10000E+01 volume  0.13983E-02 ppm1      1.022 ppm2      5.431 CV     1
 ASSI {  450}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 98   and name HB2 ))
      2.200     2.200     3.800 peak   450 spectrum    1 weight  0.10000E+01 volume  0.41238E-02 ppm1      1.029 ppm2      1.565 CV     1
 ASSI {  451}
   (  segid "T22D" and resid 107  and name HG2%)
   (( segid "T22D" and resid 98   and name HD2 ))
      2.800     1.000     1.000 peak   451 spectrum    1 weight  0.10000E+01 volume  0.34436E-02 ppm1      1.028 ppm2      3.174 CV     1
 ASSI {  452}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 108  and name HA  ))
      3.000     3.000     3.000 peak   452 spectrum    1 weight  0.10000E+01 volume  0.57118E-02 ppm1      0.884 ppm2      4.962 CV     1
 ASSI {  453}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 43   and name HD2 ))
      3.000     1.100     1.100 peak   453 spectrum    1 weight  0.10000E+01 volume  0.19922E-02 ppm1      0.668 ppm2      3.893 CV     1
 ASSI {  454}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 109  and name HB1 ))
      2.300     0.700     0.700 peak   454 spectrum    1 weight  0.10000E+01 volume  0.55934E-02 ppm1      0.888 ppm2      1.801 CV     1
 ASSI {  455}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 101  and name HB2 ))
      3.300     1.300     1.300 peak   455 spectrum    1 weight  0.10000E+01 volume  0.13499E-02 ppm1      1.150 ppm2      3.008 CV     1
 ASSI {  456}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 109  and name HB2 ))
      2.900     1.100     1.100 peak   456 spectrum    1 weight  0.10000E+01 volume  0.50246E-02 ppm1      0.889 ppm2      1.888 CV     1
 ASSI {  459}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 34   and name HB1 ))
      3.500     1.600     1.600 peak   459 spectrum    1 weight  0.10000E+01 volume  0.66422E-03 ppm1      0.883 ppm2      2.736 CV     1
 ASSI {  461}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 34   and name HB2 ))
      2.900     2.900     3.100 peak   461 spectrum    1 weight  0.10000E+01 volume  0.75650E-03 ppm1      0.882 ppm2      3.527 CV     1
 ASSI {  462}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 109  and name HA  ))
      2.000     0.500     0.500 peak   462 spectrum    1 weight  0.10000E+01 volume  0.10521E-01 ppm1      0.890 ppm2      4.476 CV     1
 ASSI {  463}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 43   and name HD2 ))
      3.300     1.300     1.300 peak   463 spectrum    1 weight  0.10000E+01 volume  0.15601E-02 ppm1      1.156 ppm2      3.911 CV     1
 ASSI {  464}
   (  segid "T22D" and resid 109  and name HD2%)
   (  segid "T22D" and resid 89   and name HB% )
      2.300     0.700     0.700 peak   464 spectrum    1 weight  0.10000E+01 volume  0.65984E-02 ppm1      0.886 ppm2      1.589 CV     1
 ASSI {  465}
   (  segid "T22D" and resid 109  and name HD2%)
   (  segid "T22D" and resid 109  and name HD1%)
      2.000     0.500     0.500 peak   465 spectrum    1 weight  0.10000E+01 volume  0.15650E-01 ppm1      0.889 ppm2      1.341 CV     1
 ASSI {  466}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 42   and name HA  ))
      3.400     1.400     1.400 peak   466 spectrum    1 weight  0.10000E+01 volume  0.32610E-02 ppm1      1.169 ppm2      4.322 CV     1
 ASSI {  467}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 37   and name HA  ))
      3.100     1.200     1.200 peak   467 spectrum    1 weight  0.10000E+01 volume  0.31126E-02 ppm1      0.894 ppm2      4.203 CV     1
 ASSI {  468}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 109  and name HG  ))
      2.100     0.500     0.500 peak   468 spectrum    1 weight  0.10000E+01 volume  0.10453E-01 ppm1      0.892 ppm2      2.084 CV     1
 ASSI {  469}
   (  segid "T22D" and resid 109  and name HD2%)
   (  segid "T22D" and resid 34   and name HD% )
      3.500     1.500     1.500 peak   469 spectrum    1 weight  0.10000E+01 volume  0.10608E-02 ppm1      0.881 ppm2      7.223 CV     1
 ASSI {  470}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 37   and name HG11))
      3.200     1.300     1.300 peak   470 spectrum    1 weight  0.10000E+01 volume  0.38615E-02 ppm1      0.891 ppm2      1.734 CV     1
 ASSI {  472}
   (  segid "T22D" and resid 109  and name HD2%)
   (  segid "T22D" and resid 111  and name HD% )
      4.000     2.000     2.000 peak   472 spectrum    1 weight  0.10000E+01 volume  0.15949E-02 ppm1      0.891 ppm2      7.099 CV     1
 ASSI {  478}
   (( segid "T22D" and resid 49   and name HG1 ))
   (( segid "T22D" and resid 49   and name HB2 ))
      2.900     1.000     1.000 peak   478 spectrum    1 weight  0.10000E+01 volume  0.16151E-02 ppm1      1.342 ppm2      1.913 CV     1
 ASSI {  479}
   (( segid "T22D" and resid 94   and name HG1 ))
   (( segid "T22D" and resid 94   and name HB2 ))
      2.300     0.700     0.700 peak   479 spectrum    1 weight  0.10000E+01 volume  0.77531E-02 ppm1      1.550 ppm2      1.899 CV     1
 OR {  479}
   (( segid "T22D" and resid 94   and name HG2 ))
   (( segid "T22D" and resid 94   and name HB2 ))
 ASSI {  480}
   (( segid "T22D" and resid 94   and name HG2 ))
   (( segid "T22D" and resid 94   and name HB1 ))
      2.300     0.600     0.600 peak   480 spectrum    1 weight  0.10000E+01 volume  0.80604E-02 ppm1      1.545 ppm2      1.812 CV     1
 OR {  480}
   (( segid "T22D" and resid 94   and name HG1 ))
   (( segid "T22D" and resid 94   and name HB1 ))
 ASSI {  481}
   (( segid "T22D" and resid 94   and name HG1 ))
   (( segid "T22D" and resid 94   and name HE1 ))
      2.600     0.800     0.800 peak   481 spectrum    1 weight  0.10000E+01 volume  0.59691E-02 ppm1      1.539 ppm2      3.002 CV     1
 OR {  481}
   (( segid "T22D" and resid 94   and name HG1 ))
   (( segid "T22D" and resid 94   and name HE2 ))
 OR {  481}
   (( segid "T22D" and resid 94   and name HG2 ))
   (( segid "T22D" and resid 94   and name HE2 ))
 OR {  481}
   (( segid "T22D" and resid 94   and name HG2 ))
   (( segid "T22D" and resid 94   and name HE1 ))
 ASSI {  482}
   (( segid "T22D" and resid 49   and name HG1 ))
   (( segid "T22D" and resid 52   and name HB2 ))
      3.800     1.800     1.800 peak   482 spectrum    1 weight  0.10000E+01 volume  0.95350E-03 ppm1      1.354 ppm2      3.598 CV     1
 OR {  482}
   (( segid "T22D" and resid 49   and name HG1 ))
   (( segid "T22D" and resid 52   and name HB1 ))
 ASSI {  483}
   (( segid "T22D" and resid 94   and name HG2 ))
   (( segid "T22D" and resid 94   and name HA  ))
      2.500     0.800     0.800 peak   483 spectrum    1 weight  0.10000E+01 volume  0.76493E-02 ppm1      1.564 ppm2      3.880 CV     1
 OR {  483}
   (( segid "T22D" and resid 94   and name HG1 ))
   (( segid "T22D" and resid 94   and name HA  ))
 ASSI {  484}
   (( segid "T22D" and resid 49   and name HG1 ))
   (( segid "T22D" and resid 49   and name HA  ))
      2.400     0.700     0.700 peak   484 spectrum    1 weight  0.10000E+01 volume  0.60842E-02 ppm1      1.340 ppm2      4.147 CV     1
 ASSI {  485}
   (( segid "T22D" and resid 104  and name HG1 ))
   (( segid "T22D" and resid 97   and name HA  ))
      3.000     1.100     1.100 peak   485 spectrum    1 weight  0.10000E+01 volume  0.10519E-02 ppm1      1.340 ppm2      6.044 CV     1
 ASSI {  486}
   (( segid "T22D" and resid 49   and name HG2 ))
   (( segid "T22D" and resid 49   and name HA  ))
      2.600     0.900     0.900 peak   486 spectrum    1 weight  0.10000E+01 volume  0.46155E-02 ppm1      1.455 ppm2      4.154 CV     1
 ASSI {  487}
   (( segid "T22D" and resid 104  and name HG2 ))
   (( segid "T22D" and resid 104  and name HE1 ))
      3.100     1.200     1.200 peak   487 spectrum    1 weight  0.10000E+01 volume  0.25536E-02 ppm1      1.323 ppm2      2.874 CV     1
 OR {  487}
   (( segid "T22D" and resid 104  and name HG2 ))
   (( segid "T22D" and resid 104  and name HE2 ))
 OR {  487}
   (( segid "T22D" and resid 104  and name HG1 ))
   (( segid "T22D" and resid 104  and name HE2 ))
 OR {  487}
   (( segid "T22D" and resid 104  and name HG1 ))
   (( segid "T22D" and resid 104  and name HE1 ))
 ASSI {  488}
   (( segid "T22D" and resid 104  and name HG2 ))
   (  segid "T22D" and resid 99   and name HD1%)
      2.800     1.000     1.000 peak   488 spectrum    1 weight  0.10000E+01 volume  0.34170E-02 ppm1      1.335 ppm2      0.705 CV     1
 OR {  488}
   (( segid "T22D" and resid 104  and name HG1 ))
   (  segid "T22D" and resid 99   and name HD1%)
 ASSI {  489}
   (( segid "T22D" and resid 94   and name HG1 ))
   (( segid "T22D" and resid 91   and name HA  ))
      3.300     1.400     1.400 peak   489 spectrum    1 weight  0.10000E+01 volume  0.29781E-02 ppm1      1.560 ppm2      3.977 CV     1
 OR {  489}
   (( segid "T22D" and resid 94   and name HG2 ))
   (( segid "T22D" and resid 91   and name HA  ))
 ASSI {  490}
   (( segid "T22D" and resid 115  and name HG1 ))
   (( segid "T22D" and resid 115  and name HE2 ))
      2.600     0.800     0.800 peak   490 spectrum    1 weight  0.10000E+01 volume  0.61101E-02 ppm1      1.459 ppm2      2.988 CV     1
 OR {  490}
   (( segid "T22D" and resid 115  and name HG2 ))
   (( segid "T22D" and resid 115  and name HE2 ))
 OR {  490}
   (( segid "T22D" and resid 115  and name HG1 ))
   (( segid "T22D" and resid 115  and name HE1 ))
 OR {  490}
   (( segid "T22D" and resid 115  and name HG2 ))
   (( segid "T22D" and resid 115  and name HE1 ))
 ASSI {  491}
   (( segid "T22D" and resid 104  and name HG2 ))
   (( segid "T22D" and resid 97   and name HB1 ))
      2.900     1.000     1.000 peak   491 spectrum    1 weight  0.10000E+01 volume  0.22624E-02 ppm1      1.322 ppm2      2.427 CV     1
 OR {  491}
   (( segid "T22D" and resid 104  and name HG1 ))
   (( segid "T22D" and resid 97   and name HB1 ))
 ASSI {  492}
   (( segid "T22D" and resid 104  and name HG2 ))
   (( segid "T22D" and resid 97   and name HB2 ))
      3.500     1.500     1.500 peak   492 spectrum    1 weight  0.10000E+01 volume  0.36342E-02 ppm1      1.329 ppm2      2.807 CV     1
 OR {  492}
   (( segid "T22D" and resid 104  and name HG1 ))
   (( segid "T22D" and resid 97   and name HB2 ))
 ASSI {  493}
   (( segid "T22D" and resid 49   and name HG2 ))
   (( segid "T22D" and resid 52   and name HB2 ))
      3.500     1.500     1.500 peak   493 spectrum    1 weight  0.10000E+01 volume  0.14066E-02 ppm1      1.463 ppm2      3.608 CV     1
 OR {  493}
   (( segid "T22D" and resid 49   and name HG2 ))
   (( segid "T22D" and resid 52   and name HB1 ))
 ASSI {  496}
   (( segid "T22D" and resid 115  and name HG2 ))
   (( segid "T22D" and resid 115  and name HA  ))
      2.600     0.900     0.900 peak   496 spectrum    1 weight  0.10000E+01 volume  0.38155E-02 ppm1      1.433 ppm2      4.544 CV     1
 OR {  496}
   (( segid "T22D" and resid 115  and name HG1 ))
   (( segid "T22D" and resid 115  and name HA  ))
 ASSI {  497}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 55   and name HZ  ))
      3.900     1.900     1.900 peak   497 spectrum    1 weight  0.10000E+01 volume  0.89057E-03 ppm1      0.931 ppm2      7.185 CV     1
 ASSI {  499}
   (  segid "T22D" and resid 51   and name HD2%)
   (  segid "T22D" and resid 55   and name HE% )
      2.500     0.800     0.800 peak   499 spectrum    1 weight  0.10000E+01 volume  0.31302E-02 ppm1      0.933 ppm2      7.300 CV     1
 ASSI {  501}
   (  segid "T22D" and resid 51   and name HD2%)
   (  segid "T22D" and resid 81   and name HG2%)
      2.600     0.800     0.800 peak   501 spectrum    1 weight  0.10000E+01 volume  0.60809E-02 ppm1      0.930 ppm2      0.266 CV     1
 ASSI {  502}
   (  segid "T22D" and resid 51   and name HD2%)
   (  segid "T22D" and resid 39   and name HG2%)
      2.400     0.700     0.700 peak   502 spectrum    1 weight  0.10000E+01 volume  0.73002E-02 ppm1      0.923 ppm2      0.592 CV     1
 ASSI {  503}
   (  segid "T22D" and resid 51   and name HD2%)
   (  segid "T22D" and resid 100  and name HD1%)
      2.700     0.900     0.900 peak   503 spectrum    1 weight  0.10000E+01 volume  0.30695E-02 ppm1      0.922 ppm2      0.231 CV     1
 ASSI {  504}
   (  segid "T22D" and resid 51   and name HD2%)
   (  segid "T22D" and resid 100  and name HG2%)
      2.300     0.700     0.700 peak   504 spectrum    1 weight  0.10000E+01 volume  0.76092E-02 ppm1      0.931 ppm2      0.445 CV     1
 ASSI {  505}
   (  segid "T22D" and resid 51   and name HD2%)
   (  segid "T22D" and resid 55   and name HD% )
      3.100     1.200     1.200 peak   505 spectrum    1 weight  0.10000E+01 volume  0.25195E-02 ppm1      0.935 ppm2      7.779 CV     1
 ASSI {  507}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 51   and name HA  ))
      2.100     0.500     0.500 peak   507 spectrum    1 weight  0.10000E+01 volume  0.84362E-02 ppm1      0.930 ppm2      4.134 CV     1
 ASSI {  508}
   (  segid "T22D" and resid 51   and name HD2%)
   (  segid "T22D" and resid 39   and name HG1%)
      2.300     0.700     0.700 peak   508 spectrum    1 weight  0.10000E+01 volume  0.82969E-02 ppm1      0.924 ppm2      0.679 CV     1
 ASSI {  509}
   (  segid "T22D" and resid 51   and name HD2%)
   (  segid "T22D" and resid 51   and name HD1%)
      2.100     0.600     0.600 peak   509 spectrum    1 weight  0.10000E+01 volume  0.12186E-01 ppm1      0.930 ppm2      0.536 CV     1
 ASSI {  511}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 51   and name HG  ))
      2.300     0.600     0.600 peak   511 spectrum    1 weight  0.10000E+01 volume  0.52122E-02 ppm1      0.931 ppm2      1.456 CV     1
 ASSI {  512}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 51   and name HB1 ))
      2.400     0.700     0.700 peak   512 spectrum    1 weight  0.10000E+01 volume  0.43044E-02 ppm1      0.936 ppm2      1.926 CV     1
 ASSI {  514}
   (( segid "T22D" and resid 74   and name HG2 ))
   (( segid "T22D" and resid 74   and name HE1 ))
      3.000     1.100     1.100 peak   514 spectrum    1 weight  0.10000E+01 volume  0.22918E-02 ppm1      1.383 ppm2      2.730 CV     1
 OR {  514}
   (( segid "T22D" and resid 74   and name HG1 ))
   (( segid "T22D" and resid 74   and name HE1 ))
 ASSI {  515}
   (( segid "T22D" and resid 74   and name HG2 ))
   (( segid "T22D" and resid 74   and name HE2 ))
      2.800     1.000     1.000 peak   515 spectrum    1 weight  0.10000E+01 volume  0.29666E-02 ppm1      1.378 ppm2      2.832 CV     1
 OR {  515}
   (( segid "T22D" and resid 74   and name HG1 ))
   (( segid "T22D" and resid 74   and name HE2 ))
 ASSI {  516}
   (( segid "T22D" and resid 36   and name HG2 ))
   (( segid "T22D" and resid 82   and name HA  ))
      4.300     2.300     1.700 peak   516 spectrum    1 weight  0.10000E+01 volume  0.77406E-03 ppm1      1.365 ppm2      5.243 CV     1
 ASSI {  517}
   (( segid "T22D" and resid 36   and name HG1 ))
   (( segid "T22D" and resid 82   and name HA  ))
      4.100     2.100     1.900 peak   517 spectrum    1 weight  0.10000E+01 volume  0.62877E-03 ppm1      0.936 ppm2      5.253 CV     1
 ASSI {  518}
   (( segid "T22D" and resid 36   and name HG1 ))
   (( segid "T22D" and resid 36   and name HE2 ))
      3.400     1.400     1.400 peak   518 spectrum    1 weight  0.10000E+01 volume  0.98206E-03 ppm1      0.949 ppm2      2.249 CV     1
 ASSI {  519}
   (( segid "T22D" and resid 100  and name HG12))
   (  segid "T22D" and resid 42   and name HD2%)
      4.700     2.800     1.300 peak   519 spectrum    1 weight  0.10000E+01 volume  0.46243E-03 ppm1     -0.519 ppm2      0.660 CV     1
 ASSI {  520}
   (( segid "T22D" and resid 100  and name HG11))
   (  segid "T22D" and resid 54   and name HE% )
      4.100     2.100     1.900 peak   520 spectrum    1 weight  0.10000E+01 volume  0.53549E-03 ppm1      0.777 ppm2      6.446 CV     1
 ASSI {  522}
   (( segid "T22D" and resid 100  and name HG11))
   (( segid "T22D" and resid 100  and name HG12))
      2.300     0.700     0.700 peak   522 spectrum    1 weight  0.10000E+01 volume  0.22380E-02 ppm1      0.785 ppm2     -0.512 CV     1
 ASSI {  524}
   (( segid "T22D" and resid 100  and name HG11))
   (  segid "T22D" and resid 100  and name HG2%)
      3.700     1.700     1.700 peak   524 spectrum    1 weight  0.10000E+01 volume  0.17849E-02 ppm1      0.796 ppm2      0.446 CV     1
 ASSI {  525}
   (( segid "T22D" and resid 100  and name HG11))
   (( segid "T22D" and resid 98   and name HB2 ))
      3.000     1.100     1.100 peak   525 spectrum    1 weight  0.10000E+01 volume  0.82176E-03 ppm1      0.787 ppm2      1.578 CV     1
 ASSI {  526}
   (( segid "T22D" and resid 100  and name HG11))
   (( segid "T22D" and resid 98   and name HG2 ))
      3.700     1.700     1.700 peak   526 spectrum    1 weight  0.10000E+01 volume  0.44203E-03 ppm1      0.787 ppm2      2.007 CV     1
 OR {  526}
   (( segid "T22D" and resid 100  and name HG11))
   (( segid "T22D" and resid 98   and name HG1 ))
 ASSI {  527}
   (( segid "T22D" and resid 100  and name HG11))
   (( segid "T22D" and resid 100  and name HB  ))
      2.600     0.900     0.900 peak   527 spectrum    1 weight  0.10000E+01 volume  0.25202E-02 ppm1      0.786 ppm2      1.309 CV     1
 ASSI {  528}
   (( segid "T22D" and resid 100  and name HG12))
   (( segid "T22D" and resid 100  and name HA  ))
      2.800     1.000     1.000 peak   528 spectrum    1 weight  0.10000E+01 volume  0.18220E-02 ppm1     -0.495 ppm2      3.771 CV     1
 ASSI {  529}
   (( segid "T22D" and resid 100  and name HG12))
   (( segid "T22D" and resid 100  and name HB  ))
      3.300     1.400     1.400 peak   529 spectrum    1 weight  0.10000E+01 volume  0.16522E-02 ppm1     -0.503 ppm2      1.313 CV     1
 ASSI {  533}
   (( segid "T22D" and resid 100  and name HG11))
   (( segid "T22D" and resid 100  and name HA  ))
      3.100     1.200     1.200 peak   533 spectrum    1 weight  0.10000E+01 volume  0.18059E-02 ppm1      0.784 ppm2      3.769 CV     1
 ASSI {  537}
   (( segid "T22D" and resid 100  and name HG12))
   (( segid "T22D" and resid 98   and name HB2 ))
      3.500     1.600     1.600 peak   537 spectrum    1 weight  0.10000E+01 volume  0.75116E-03 ppm1     -0.493 ppm2      1.578 CV     1
 ASSI {  538}
   (( segid "T22D" and resid 100  and name HG12))
   (  segid "T22D" and resid 54   and name HE% )
      3.600     1.600     1.600 peak   538 spectrum    1 weight  0.10000E+01 volume  0.58728E-03 ppm1     -0.524 ppm2      6.456 CV     1
 ASSI {  540}
   (  segid "T22D" and resid 112  and name HD1%)
   (( segid "T22D" and resid 109  and name HB1 ))
      3.700     1.700     1.700 peak   540 spectrum    1 weight  0.10000E+01 volume  0.29261E-02 ppm1      0.956 ppm2      1.799 CV     1
 ASSI {  541}
   (  segid "T22D" and resid 112  and name HD1%)
   (( segid "T22D" and resid 108  and name HB2 ))
      2.400     0.700     0.700 peak   541 spectrum    1 weight  0.10000E+01 volume  0.39544E-02 ppm1      0.960 ppm2      2.784 CV     1
 ASSI {  542}
   (  segid "T22D" and resid 42   and name HD1%)
   (  segid "T22D" and resid 42   and name HD2%)
      2.200     0.600     0.600 peak   542 spectrum    1 weight  0.10000E+01 volume  0.76705E-02 ppm1      0.446 ppm2      0.671 CV     1
 ASSI {  543}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 42   and name HB2 ))
      2.300     0.700     0.700 peak   543 spectrum    1 weight  0.10000E+01 volume  0.56997E-02 ppm1      0.446 ppm2      0.936 CV     1
 ASSI {  544}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 78   and name HA  ))
      2.700     0.900     0.900 peak   544 spectrum    1 weight  0.10000E+01 volume  0.20718E-02 ppm1      0.450 ppm2      4.992 CV     1
 ASSI {  545}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 51   and name HA  ))
      5.100     3.200     0.900 peak   545 spectrum    1 weight  0.10000E+01 volume  0.82423E-03 ppm1      0.440 ppm2      4.141 CV     1
 ASSI {  546}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 39   and name HB  ))
      2.700     0.900     0.900 peak   546 spectrum    1 weight  0.10000E+01 volume  0.15709E-02 ppm1      0.434 ppm2      1.446 CV     1
 ASSI {  549}
   (  segid "T22D" and resid 112  and name HD1%)
   (  segid "T22D" and resid 109  and name HD1%)
      2.600     0.800     0.800 peak   549 spectrum    1 weight  0.10000E+01 volume  0.89262E-02 ppm1      0.956 ppm2      1.369 CV     1
 ASSI {  550}
   (  segid "T22D" and resid 51   and name HD1%)
   (  segid "T22D" and resid 55   and name HD% )
      4.300     2.300     1.700 peak   550 spectrum    1 weight  0.10000E+01 volume  0.66818E-03 ppm1      0.533 ppm2      7.780 CV     1
 ASSI {  551}
   (  segid "T22D" and resid 51   and name HD1%)
   (  segid "T22D" and resid 55   and name HE% )
      4.500     2.600     1.500 peak   551 spectrum    1 weight  0.10000E+01 volume  0.47393E-03 ppm1      0.551 ppm2      7.316 CV     1
 ASSI {  552}
   (  segid "T22D" and resid 112  and name HD1%)
   (( segid "T22D" and resid 109  and name HG  ))
      3.000     1.100     1.100 peak   552 spectrum    1 weight  0.10000E+01 volume  0.33444E-02 ppm1      0.950 ppm2      2.081 CV     1
 ASSI {  553}
   (  segid "T22D" and resid 112  and name HD1%)
   (( segid "T22D" and resid 112  and name HG  ))
      2.000     0.500     0.500 peak   553 spectrum    1 weight  0.10000E+01 volume  0.14161E-01 ppm1      0.951 ppm2      0.777 CV     1
 ASSI {  555}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 42   and name HG  ))
      2.300     0.700     0.700 peak   555 spectrum    1 weight  0.10000E+01 volume  0.46818E-02 ppm1      0.449 ppm2      1.259 CV     1
 ASSI {  556}
   (  segid "T22D" and resid 112  and name HD1%)
   (( segid "T22D" and resid 108  and name HB1 ))
      4.000     2.000     2.000 peak   556 spectrum    1 weight  0.10000E+01 volume  0.22243E-02 ppm1      0.960 ppm2      3.001 CV     1
 ASSI {  557}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 46   and name HB  ))
      2.800     1.000     1.000 peak   557 spectrum    1 weight  0.10000E+01 volume  0.32834E-02 ppm1      0.459 ppm2      3.744 CV     1
 ASSI {  558}
   (  segid "T22D" and resid 112  and name HD1%)
   (( segid "T22D" and resid 112  and name HB1 ))
      2.300     0.700     0.700 peak   558 spectrum    1 weight  0.10000E+01 volume  0.95033E-02 ppm1      0.958 ppm2      1.500 CV     1
 ASSI {  559}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 42   and name HA  ))
      3.800     1.800     1.800 peak   559 spectrum    1 weight  0.10000E+01 volume  0.17184E-02 ppm1      0.442 ppm2      4.314 CV     1
 ASSI {  560}
   (  segid "T22D" and resid 112  and name HD1%)
   (  segid "T22D" and resid 111  and name HE% )
      3.500     1.500     1.500 peak   560 spectrum    1 weight  0.10000E+01 volume  0.18876E-02 ppm1      0.959 ppm2      6.723 CV     1
 ASSI {  561}
   (  segid "T22D" and resid 112  and name HD1%)
   (( segid "T22D" and resid 109  and name HB2 ))
      2.500     0.800     0.800 peak   561 spectrum    1 weight  0.10000E+01 volume  0.36572E-02 ppm1      0.954 ppm2      1.891 CV     1
 ASSI {  562}
   (  segid "T22D" and resid 112  and name HD1%)
   (  segid "T22D" and resid 112  and name HD2%)
      2.100     0.500     0.500 peak   562 spectrum    1 weight  0.10000E+01 volume  0.17085E-01 ppm1      0.956 ppm2      0.632 CV     1
 ASSI {  563}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 60   and name HB1 ))
      3.700     1.700     1.700 peak   563 spectrum    1 weight  0.10000E+01 volume  0.23120E-02 ppm1      1.382 ppm2      2.533 CV     1
 OR {  563}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 60   and name HB1 ))
 ASSI {  565}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 60   and name HB2 ))
      3.600     1.600     1.600 peak   565 spectrum    1 weight  0.10000E+01 volume  0.21883E-02 ppm1      1.381 ppm2      2.600 CV     1
 OR {  565}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 60   and name HB2 ))
 ASSI {  566}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 84   and name HE2 ))
      2.600     0.800     0.800 peak   566 spectrum    1 weight  0.10000E+01 volume  0.44579E-02 ppm1      1.364 ppm2      2.966 CV     1
 OR {  566}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 84   and name HE2 ))
 ASSI {  567}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 84   and name HE2 ))
      2.800     1.000     1.000 peak   567 spectrum    1 weight  0.10000E+01 volume  0.35432E-02 ppm1      1.374 ppm2      2.920 CV     1
 OR {  567}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 84   and name HE1 ))
 OR {  567}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 84   and name HE2 ))
 OR {  567}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 84   and name HE1 ))
 ASSI {  568}
   (( segid "T22D" and resid 73   and name HB2 ))
   (( segid "T22D" and resid 68   and name HB  ))
      3.700     1.700     1.700 peak   568 spectrum    1 weight  0.10000E+01 volume  0.10003E-02 ppm1      2.362 ppm2      3.672 CV     1
 OR {  568}
   (( segid "T22D" and resid 73   and name HB1 ))
   (( segid "T22D" and resid 68   and name HB  ))
 ASSI {  569}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 84   and name HA  ))
      2.300     0.700     0.700 peak   569 spectrum    1 weight  0.10000E+01 volume  0.81013E-02 ppm1      1.368 ppm2      4.097 CV     1
 OR {  569}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 84   and name HA  ))
 ASSI {  570}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 84   and name HD1 ))
      2.000     0.500     0.500 peak   570 spectrum    1 weight  0.10000E+01 volume  0.17188E-01 ppm1      1.376 ppm2      1.710 CV     1
 OR {  570}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 84   and name HD2 ))
 OR {  570}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 84   and name HD1 ))
 OR {  570}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 84   and name HD2 ))
 ASSI {  571}
   (( segid "T22D" and resid 73   and name HB1 ))
   (( segid "T22D" and resid 73   and name HG1 ))
      2.000     0.500     0.500 peak   571 spectrum    1 weight  0.10000E+01 volume  0.25141E-01 ppm1      2.384 ppm2      2.289 CV     1
 OR {  571}
   (( segid "T22D" and resid 73   and name HB2 ))
   (( segid "T22D" and resid 73   and name HG2 ))
 OR {  571}
   (( segid "T22D" and resid 73   and name HB2 ))
   (( segid "T22D" and resid 73   and name HG1 ))
 OR {  571}
   (( segid "T22D" and resid 73   and name HB1 ))
   (( segid "T22D" and resid 73   and name HG2 ))
 ASSI {  572}
   (  segid "T22D" and resid 112  and name HD1%)
   (  segid "T22D" and resid 111  and name HD% )
      4.500     2.500     1.500 peak   572 spectrum    1 weight  0.10000E+01 volume  0.10071E-02 ppm1      0.949 ppm2      7.099 CV     1
 ASSI {  573}
   (( segid "T22D" and resid 73   and name HB2 ))
   (( segid "T22D" and resid 73   and name HA  ))
      2.200     0.600     0.600 peak   573 spectrum    1 weight  0.10000E+01 volume  0.98440E-02 ppm1      2.377 ppm2      3.975 CV     1
 OR {  573}
   (( segid "T22D" and resid 73   and name HB1 ))
   (( segid "T22D" and resid 73   and name HA  ))
 ASSI {  574}
   (  segid "T22D" and resid 51   and name HD1%)
   (( segid "T22D" and resid 51   and name HA  ))
      3.700     1.700     1.700 peak   574 spectrum    1 weight  0.10000E+01 volume  0.25680E-02 ppm1      0.542 ppm2      4.137 CV     1
 ASSI {  575}
   (( segid "T22D" and resid 73   and name HB1 ))
   (( segid "T22D" and resid 72   and name HA  ))
      3.600     1.600     1.600 peak   575 spectrum    1 weight  0.10000E+01 volume  0.92539E-03 ppm1      2.368 ppm2      4.367 CV     1
 OR {  575}
   (( segid "T22D" and resid 73   and name HB2 ))
   (( segid "T22D" and resid 72   and name HA  ))
 ASSI {  576}
   (  segid "T22D" and resid 112  and name HD1%)
   (( segid "T22D" and resid 112  and name HA  ))
      3.600     1.600     1.600 peak   576 spectrum    1 weight  0.10000E+01 volume  0.39615E-02 ppm1      0.957 ppm2      3.668 CV     1
 ASSI {  577}
   (  segid "T22D" and resid 51   and name HD1%)
   (( segid "T22D" and resid 48   and name HA  ))
      3.100     1.200     1.200 peak   577 spectrum    1 weight  0.10000E+01 volume  0.20047E-02 ppm1      0.543 ppm2      4.055 CV     1
 ASSI {  578}
   (  segid "T22D" and resid 51   and name HD1%)
   (( segid "T22D" and resid 51   and name HG  ))
      2.300     0.600     0.600 peak   578 spectrum    1 weight  0.10000E+01 volume  0.61230E-02 ppm1      0.543 ppm2      1.462 CV     1
 ASSI {  579}
   (  segid "T22D" and resid 51   and name HD1%)
   (( segid "T22D" and resid 51   and name HB2 ))
      2.300     0.600     0.600 peak   579 spectrum    1 weight  0.10000E+01 volume  0.71918E-02 ppm1      0.541 ppm2      1.324 CV     1
 ASSI {  581}
   (  segid "T22D" and resid 51   and name HD1%)
   (( segid "T22D" and resid 51   and name HB1 ))
      2.500     0.800     0.800 peak   581 spectrum    1 weight  0.10000E+01 volume  0.48077E-02 ppm1      0.543 ppm2      1.930 CV     1
 ASSI {  582}
   (  segid "T22D" and resid 51   and name HD1%)
   (  segid "T22D" and resid 81   and name HG2%)
      2.400     0.700     0.700 peak   582 spectrum    1 weight  0.10000E+01 volume  0.74324E-02 ppm1      0.543 ppm2      0.268 CV     1
 ASSI {  584}
   (  segid "T22D" and resid 51   and name HD1%)
   (( segid "T22D" and resid 64   and name HA  ))
      3.300     1.400     1.400 peak   584 spectrum    1 weight  0.10000E+01 volume  0.16525E-02 ppm1      0.539 ppm2      5.261 CV     1
 ASSI {  585}
   (( segid "T22D" and resid 96   and name HG2 ))
   (( segid "T22D" and resid 96   and name HB2 ))
      2.300     0.600     0.600 peak   585 spectrum    1 weight  0.10000E+01 volume  0.78765E-02 ppm1      2.086 ppm2      2.151 CV     1
 OR {  585}
   (( segid "T22D" and resid 96   and name HG1 ))
   (( segid "T22D" and resid 96   and name HB2 ))
 ASSI {  586}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 109  and name HB2 ))
      2.000     0.500     0.500 peak   586 spectrum    1 weight  0.10000E+01 volume  0.12254E-01 ppm1      1.361 ppm2      1.897 CV     1
 ASSI {  588}
   (( segid "T22D" and resid 96   and name HG2 ))
   (( segid "T22D" and resid 95   and name HA  ))
      3.900     1.900     1.900 peak   588 spectrum    1 weight  0.10000E+01 volume  0.30449E-02 ppm1      2.090 ppm2      5.138 CV     1
 OR {  588}
   (( segid "T22D" and resid 96   and name HG1 ))
   (( segid "T22D" and resid 95   and name HA  ))
 ASSI {  589}
   (( segid "T22D" and resid 96   and name HG1 ))
   (( segid "T22D" and resid 96   and name HB1 ))
      2.400     0.700     0.700 peak   589 spectrum    1 weight  0.10000E+01 volume  0.64649E-02 ppm1      2.089 ppm2      2.502 CV     1
 OR {  589}
   (( segid "T22D" and resid 96   and name HG2 ))
   (( segid "T22D" and resid 96   and name HB1 ))
 ASSI {  590}
   (( segid "T22D" and resid 96   and name HG2 ))
   (( segid "T22D" and resid 96   and name HD2 ))
      2.400     0.700     0.700 peak   590 spectrum    1 weight  0.10000E+01 volume  0.56468E-02 ppm1      2.085 ppm2      4.106 CV     1
 OR {  590}
   (( segid "T22D" and resid 96   and name HG1 ))
   (( segid "T22D" and resid 96   and name HD2 ))
 ASSI {  591}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 34   and name HB1 ))
      3.300     1.400     1.400 peak   591 spectrum    1 weight  0.10000E+01 volume  0.12809E-02 ppm1      1.360 ppm2      2.735 CV     1
 ASSI {  593}
   (( segid "T22D" and resid 96   and name HG1 ))
   (( segid "T22D" and resid 96   and name HD1 ))
      2.400     0.700     0.700 peak   593 spectrum    1 weight  0.10000E+01 volume  0.58586E-02 ppm1      2.084 ppm2      4.009 CV     1
 OR {  593}
   (( segid "T22D" and resid 96   and name HG2 ))
   (( segid "T22D" and resid 96   and name HD1 ))
 ASSI {  594}
   (  segid "T22D" and resid 51   and name HD1%)
   (  segid "T22D" and resid 46   and name HG2%)
      3.400     1.500     1.500 peak   594 spectrum    1 weight  0.10000E+01 volume  0.15634E-02 ppm1      0.546 ppm2      1.153 CV     1
 ASSI {  595}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 109  and name HB1 ))
      2.400     0.700     0.700 peak   595 spectrum    1 weight  0.10000E+01 volume  0.54875E-02 ppm1      1.350 ppm2      1.802 CV     1
 ASSI {  596}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 34   and name HA  ))
      2.400     0.700     0.700 peak   596 spectrum    1 weight  0.10000E+01 volume  0.53436E-02 ppm1      1.352 ppm2      4.964 CV     1
 ASSI {  597}
   (  segid "T22D" and resid 109  and name HD1%)
   (  segid "T22D" and resid 34   and name HE% )
      3.300     1.300     1.300 peak   597 spectrum    1 weight  0.10000E+01 volume  0.11718E-02 ppm1      1.337 ppm2      7.304 CV     1
 ASSI {  598}
   (  segid "T22D" and resid 109  and name HD1%)
   (  segid "T22D" and resid 34   and name HD% )
      2.700     0.900     0.900 peak   598 spectrum    1 weight  0.10000E+01 volume  0.24798E-02 ppm1      1.343 ppm2      7.225 CV     1
 ASSI {  599}
   (  segid "T22D" and resid 109  and name HD1%)
   (  segid "T22D" and resid 111  and name HD% )
      3.300     1.400     1.400 peak   599 spectrum    1 weight  0.10000E+01 volume  0.28826E-02 ppm1      1.344 ppm2      7.096 CV     1
 ASSI {  600}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 109  and name HG  ))
      2.100     0.600     0.600 peak   600 spectrum    1 weight  0.10000E+01 volume  0.92510E-02 ppm1      1.346 ppm2      2.086 CV     1
 ASSI {  602}
   (  segid "T22D" and resid 109  and name HD1%)
   (  segid "T22D" and resid 111  and name HE% )
      2.100     0.600     0.600 peak   602 spectrum    1 weight  0.10000E+01 volume  0.92723E-02 ppm1      1.344 ppm2      6.726 CV     1
 ASSI {  603}
   (( segid "T22D" and resid 98   and name HG1 ))
   (( segid "T22D" and resid 98   and name HD1 ))
      2.800     1.000     1.000 peak   603 spectrum    1 weight  0.10000E+01 volume  0.19014E-02 ppm1      1.984 ppm2      3.601 CV     1
 OR {  603}
   (( segid "T22D" and resid 98   and name HG2 ))
   (( segid "T22D" and resid 98   and name HD1 ))
 ASSI {  605}
   (( segid "T22D" and resid 98   and name HG2 ))
   (( segid "T22D" and resid 98   and name HB2 ))
      2.600     0.800     0.800 peak   605 spectrum    1 weight  0.10000E+01 volume  0.28400E-02 ppm1      1.978 ppm2      1.572 CV     1
 OR {  605}
   (( segid "T22D" and resid 98   and name HG1 ))
   (( segid "T22D" and resid 98   and name HB2 ))
 ASSI {  607}
   (( segid "T22D" and resid 98   and name HG1 ))
   (  segid "T22D" and resid 107  and name HG2%)
      3.300     1.400     1.400 peak   607 spectrum    1 weight  0.10000E+01 volume  0.63240E-03 ppm1      1.966 ppm2      1.027 CV     1
 OR {  607}
   (( segid "T22D" and resid 98   and name HG2 ))
   (  segid "T22D" and resid 107  and name HG2%)
 ASSI {  608}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 109  and name HA  ))
      3.700     1.700     1.700 peak   608 spectrum    1 weight  0.10000E+01 volume  0.23364E-02 ppm1      1.337 ppm2      4.479 CV     1
 ASSI {  611}
   (( segid "T22D" and resid 86   and name HG2 ))
   (( segid "T22D" and resid 86   and name HG1 ))
      1.800     0.400     0.400 peak   611 spectrum    1 weight  0.10000E+01 volume  0.97510E-02 ppm1      1.810 ppm2      1.641 CV     1
 ASSI {  614}
   (( segid "T22D" and resid 86   and name HG2 ))
   (( segid "T22D" and resid 34   and name HB1 ))
      4.200     2.200     1.800 peak   614 spectrum    1 weight  0.10000E+01 volume  0.12392E-02 ppm1      1.813 ppm2      2.743 CV     1
 ASSI {  615}
   (( segid "T22D" and resid 86   and name HG1 ))
   (( segid "T22D" and resid 34   and name HB1 ))
      2.600     0.800     0.800 peak   615 spectrum    1 weight  0.10000E+01 volume  0.11811E-02 ppm1      1.652 ppm2      2.746 CV     1
 ASSI {  616}
   (( segid "T22D" and resid 86   and name HG2 ))
   (  segid "T22D" and resid 35   and name HG2%)
      4.400     2.400     1.600 peak   616 spectrum    1 weight  0.10000E+01 volume  0.83265E-03 ppm1      1.813 ppm2      0.797 CV     1
 ASSI {  617}
   (( segid "T22D" and resid 86   and name HG1 ))
   (  segid "T22D" and resid 35   and name HG2%)
      3.700     1.700     1.700 peak   617 spectrum    1 weight  0.10000E+01 volume  0.12665E-02 ppm1      1.632 ppm2      0.801 CV     1
 ASSI {  618}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 34   and name HB2 ))
      2.900     2.900     3.100 peak   618 spectrum    1 weight  0.10000E+01 volume  0.63077E-03 ppm1      1.350 ppm2      3.526 CV     1
 ASSI {  622}
   (( segid "T22D" and resid 112  and name HG  ))
   (  segid "T22D" and resid 112  and name HD2%)
      2.200     0.600     0.600 peak   622 spectrum    1 weight  0.10000E+01 volume  0.82331E-02 ppm1      0.756 ppm2      0.639 CV     1
 ASSI {  624}
   (( segid "T22D" and resid 86   and name HG2 ))
   (( segid "T22D" and resid 34   and name HB2 ))
      4.600     2.700     1.400 peak   624 spectrum    1 weight  0.10000E+01 volume  0.16317E-02 ppm1      1.814 ppm2      3.527 CV     1
 ASSI {  625}
   (( segid "T22D" and resid 51   and name HG  ))
   (  segid "T22D" and resid 55   and name HD% )
      4.300     2.300     1.700 peak   625 spectrum    1 weight  0.10000E+01 volume  0.74808E-03 ppm1      1.481 ppm2      7.781 CV     1
 ASSI {  626}
   (( segid "T22D" and resid 51   and name HG  ))
   (( segid "T22D" and resid 51   and name HB1 ))
      2.900     1.100     1.100 peak   626 spectrum    1 weight  0.10000E+01 volume  0.30216E-02 ppm1      1.472 ppm2      1.921 CV     1
 ASSI {  629}
   (( segid "T22D" and resid 86   and name HG1 ))
   (( segid "T22D" and resid 86   and name HD1 ))
      2.800     1.000     1.000 peak   629 spectrum    1 weight  0.10000E+01 volume  0.31012E-02 ppm1      1.641 ppm2      2.953 CV     1
 ASSI {  630}
   (( segid "T22D" and resid 86   and name HG1 ))
   (( segid "T22D" and resid 86   and name HD2 ))
      2.400     0.700     0.700 peak   630 spectrum    1 weight  0.10000E+01 volume  0.42727E-02 ppm1      1.645 ppm2      3.031 CV     1
 ASSI {  631}
   (( segid "T22D" and resid 51   and name HG  ))
   (( segid "T22D" and resid 48   and name HA  ))
      3.700     1.700     1.700 peak   631 spectrum    1 weight  0.10000E+01 volume  0.70091E-03 ppm1      1.457 ppm2      4.051 CV     1
 ASSI {  632}
   (( segid "T22D" and resid 86   and name HG1 ))
   (( segid "T22D" and resid 34   and name HB2 ))
      3.500     1.500     1.500 peak   632 spectrum    1 weight  0.10000E+01 volume  0.12431E-02 ppm1      1.654 ppm2      3.522 CV     1
 ASSI {  633}
   (( segid "T22D" and resid 112  and name HG  ))
   (  segid "T22D" and resid 111  and name HE% )
      3.100     1.200     1.200 peak   633 spectrum    1 weight  0.10000E+01 volume  0.10645E-02 ppm1      0.774 ppm2      6.724 CV     1
 ASSI {  634}
   (( segid "T22D" and resid 112  and name HG  ))
   (( segid "T22D" and resid 112  and name HA  ))
      2.900     1.100     1.100 peak   634 spectrum    1 weight  0.10000E+01 volume  0.22527E-02 ppm1      0.774 ppm2      3.666 CV     1
 ASSI {  635}
   (( segid "T22D" and resid 112  and name HG  ))
   (( segid "T22D" and resid 112  and name HB1 ))
      3.000     1.100     1.100 peak   635 spectrum    1 weight  0.10000E+01 volume  0.26201E-02 ppm1      0.778 ppm2      1.501 CV     1
 ASSI {  636}
   (( segid "T22D" and resid 112  and name HG  ))
   (( segid "T22D" and resid 112  and name HB2 ))
      2.700     0.900     0.900 peak   636 spectrum    1 weight  0.10000E+01 volume  0.16397E-02 ppm1      0.774 ppm2      1.365 CV     1
 ASSI {  638}
   (( segid "T22D" and resid 30   and name HG2 ))
   (( segid "T22D" and resid 30   and name HD2 ))
      2.100     0.500     0.500 peak   638 spectrum    1 weight  0.10000E+01 volume  0.14774E-01 ppm1      1.609 ppm2      3.187 CV     1
 OR {  638}
   (( segid "T22D" and resid 30   and name HG1 ))
   (( segid "T22D" and resid 30   and name HD1 ))
 OR {  638}
   (( segid "T22D" and resid 30   and name HG1 ))
   (( segid "T22D" and resid 30   and name HD2 ))
 OR {  638}
   (( segid "T22D" and resid 30   and name HG2 ))
   (( segid "T22D" and resid 30   and name HD1 ))
 ASSI {  639}
   (( segid "T22D" and resid 98   and name HG2 ))
   (( segid "T22D" and resid 97   and name HA  ))
      4.500     2.500     1.500 peak   639 spectrum    1 weight  0.10000E+01 volume  0.60292E-03 ppm1      1.990 ppm2      6.033 CV     1
 OR {  639}
   (( segid "T22D" and resid 98   and name HG1 ))
   (( segid "T22D" and resid 97   and name HA  ))
 ASSI {  640}
   (( segid "T22D" and resid 70   and name HG1 ))
   (( segid "T22D" and resid 71   and name HB2 ))
      3.600     3.600     2.400 peak   640 spectrum    1 weight  0.10000E+01 volume  0.84257E-03 ppm1      1.703 ppm2      2.840 CV     1
 ASSI {  641}
   (( segid "T22D" and resid 70   and name HG2 ))
   (( segid "T22D" and resid 70   and name HD2 ))
      1.900     0.500     0.500 peak   641 spectrum    1 weight  0.10000E+01 volume  0.24884E-01 ppm1      1.675 ppm2      3.207 CV     1
 OR {  641}
   (( segid "T22D" and resid 70   and name HG1 ))
   (( segid "T22D" and resid 70   and name HD1 ))
 OR {  641}
   (( segid "T22D" and resid 70   and name HG1 ))
   (( segid "T22D" and resid 70   and name HD2 ))
 OR {  641}
   (( segid "T22D" and resid 70   and name HG2 ))
   (( segid "T22D" and resid 70   and name HD1 ))
 ASSI {  642}
   (( segid "T22D" and resid 99   and name HG11))
   (( segid "T22D" and resid 99   and name HA  ))
      3.200     1.300     1.300 peak   642 spectrum    1 weight  0.10000E+01 volume  0.35642E-02 ppm1      1.470 ppm2      4.147 CV     1
 ASSI {  643}
   (( segid "T22D" and resid 70   and name HG2 ))
   (( segid "T22D" and resid 70   and name HA  ))
      2.500     0.800     0.800 peak   643 spectrum    1 weight  0.10000E+01 volume  0.95471E-02 ppm1      1.695 ppm2      4.060 CV     1
 OR {  643}
   (( segid "T22D" and resid 70   and name HG1 ))
   (( segid "T22D" and resid 70   and name HA  ))
 ASSI {  644}
   (( segid "T22D" and resid 109  and name HG  ))
   (( segid "T22D" and resid 109  and name HA  ))
      2.900     1.100     1.100 peak   644 spectrum    1 weight  0.10000E+01 volume  0.22551E-02 ppm1      2.073 ppm2      4.474 CV     1
 ASSI {  645}
   (( segid "T22D" and resid 117  and name HG2 ))
   (( segid "T22D" and resid 117  and name HA  ))
      2.700     0.900     0.900 peak   645 spectrum    1 weight  0.10000E+01 volume  0.53469E-02 ppm1      1.656 ppm2      4.406 CV     1
 OR {  645}
   (( segid "T22D" and resid 117  and name HG1 ))
   (( segid "T22D" and resid 117  and name HA  ))
 ASSI {  646}
   (( segid "T22D" and resid 30   and name HG1 ))
   (( segid "T22D" and resid 30   and name HA  ))
      2.700     0.900     0.900 peak   646 spectrum    1 weight  0.10000E+01 volume  0.57210E-02 ppm1      1.614 ppm2      4.296 CV     1
 OR {  646}
   (( segid "T22D" and resid 30   and name HG2 ))
   (( segid "T22D" and resid 30   and name HA  ))
 ASSI {  647}
   (( segid "T22D" and resid 99   and name HG11))
   (  segid "T22D" and resid 99   and name HG2%)
      2.300     0.700     0.700 peak   647 spectrum    1 weight  0.10000E+01 volume  0.81930E-02 ppm1      1.465 ppm2      0.545 CV     1
 ASSI {  650}
   (( segid "T22D" and resid 109  and name HG  ))
   (  segid "T22D" and resid 111  and name HE% )
      4.500     2.500     1.500 peak   650 spectrum    1 weight  0.10000E+01 volume  0.69900E-03 ppm1      2.071 ppm2      6.729 CV     1
 ASSI {  651}
   (( segid "T22D" and resid 61   and name HG11))
   (  segid "T22D" and resid 81   and name HG2%)
      3.900     1.900     1.900 peak   651 spectrum    1 weight  0.10000E+01 volume  0.19973E-02 ppm1      1.526 ppm2      0.271 CV     1
 ASSI {  653}
   (( segid "T22D" and resid 61   and name HG12))
   (  segid "T22D" and resid 61   and name HG2%)
      2.300     0.600     0.600 peak   653 spectrum    1 weight  0.10000E+01 volume  0.58473E-02 ppm1      0.926 ppm2      0.607 CV     1
 ASSI {  654}
   (( segid "T22D" and resid 61   and name HG12))
   (( segid "T22D" and resid 61   and name HG11))
      1.900     0.400     0.400 peak   654 spectrum    1 weight  0.10000E+01 volume  0.60237E-02 ppm1      0.934 ppm2      1.530 CV     1
 ASSI {  655}
   (( segid "T22D" and resid 61   and name HG12))
   (  segid "T22D" and resid 81   and name HG1%)
      2.400     0.700     0.700 peak   655 spectrum    1 weight  0.10000E+01 volume  0.30284E-02 ppm1      0.921 ppm2      0.532 CV     1
 ASSI {  658}
   (( segid "T22D" and resid 61   and name HG12))
   (( segid "T22D" and resid 61   and name HA  ))
      2.400     0.700     0.700 peak   658 spectrum    1 weight  0.10000E+01 volume  0.31288E-02 ppm1      0.923 ppm2      4.114 CV     1
 ASSI {  659}
   (( segid "T22D" and resid 61   and name HG12))
   (  segid "T22D" and resid 81   and name HG2%)
      3.300     1.400     1.400 peak   659 spectrum    1 weight  0.10000E+01 volume  0.23861E-02 ppm1      0.926 ppm2      0.284 CV     1
 ASSI {  665}
   (( segid "T22D" and resid 61   and name HG11))
   (( segid "T22D" and resid 61   and name HA  ))
      2.700     0.900     0.900 peak   665 spectrum    1 weight  0.10000E+01 volume  0.25259E-02 ppm1      1.532 ppm2      4.109 CV     1
 ASSI {  666}
   (( segid "T22D" and resid 116  and name HG2 ))
   (( segid "T22D" and resid 116  and name HB2 ))
      2.000     0.500     0.500 peak   666 spectrum    1 weight  0.10000E+01 volume  0.18042E-01 ppm1      2.018 ppm2      1.873 CV     1
 OR {  666}
   (( segid "T22D" and resid 116  and name HG1 ))
   (( segid "T22D" and resid 116  and name HB2 ))
 ASSI {  667}
   (( segid "T22D" and resid 116  and name HG1 ))
   (( segid "T22D" and resid 116  and name HB1 ))
      2.200     0.600     0.600 peak   667 spectrum    1 weight  0.10000E+01 volume  0.81280E-02 ppm1      2.011 ppm2      2.295 CV     1
 ASSI {  668}
   (( segid "T22D" and resid 99   and name HG11))
   (( segid "T22D" and resid 99   and name HG12))
      1.700     0.400     0.500 peak   668 spectrum    1 weight  0.10000E+01 volume  0.15221E-01 ppm1      1.459 ppm2      1.143 CV     1
 ASSI {  674}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 99   and name HB  ))
      2.500     0.800     0.800 peak   674 spectrum    1 weight  0.10000E+01 volume  0.40708E-02 ppm1      1.146 ppm2      1.801 CV     1
 ASSI {  675}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 99   and name HA  ))
      2.900     1.100     1.100 peak   675 spectrum    1 weight  0.10000E+01 volume  0.23242E-02 ppm1      1.148 ppm2      4.152 CV     1
 ASSI {  677}
   (( segid "T22D" and resid 116  and name HG2 ))
   (( segid "T22D" and resid 116  and name HD2 ))
      2.100     0.500     0.500 peak   677 spectrum    1 weight  0.10000E+01 volume  0.98161E-02 ppm1      2.015 ppm2      3.614 CV     1
 ASSI {  678}
   (( segid "T22D" and resid 116  and name HG1 ))
   (( segid "T22D" and resid 116  and name HD1 ))
      2.000     0.500     0.500 peak   678 spectrum    1 weight  0.10000E+01 volume  0.10241E-01 ppm1      2.010 ppm2      3.796 CV     1
 ASSI {  679}
   (( segid "T22D" and resid 116  and name HG1 ))
   (( segid "T22D" and resid 116  and name HA  ))
      3.200     1.300     1.300 peak   679 spectrum    1 weight  0.10000E+01 volume  0.38299E-02 ppm1      2.002 ppm2      4.402 CV     1
 ASSI {  681}
   (( segid "T22D" and resid 109  and name HG  ))
   (( segid "T22D" and resid 90   and name HA  ))
      3.100     1.200     1.200 peak   681 spectrum    1 weight  0.10000E+01 volume  0.16851E-02 ppm1      2.095 ppm2      4.050 CV     1
 ASSI {  685}
   (( segid "T22D" and resid 76   and name HG1 ))
   (( segid "T22D" and resid 76   and name HB2 ))
      2.600     0.900     0.900 peak   685 spectrum    1 weight  0.10000E+01 volume  0.19854E-02 ppm1      1.728 ppm2      2.293 CV     1
 ASSI {  686}
   (( segid "T22D" and resid 76   and name HG1 ))
   (( segid "T22D" and resid 76   and name HG2 ))
      1.900     0.500     0.500 peak   686 spectrum    1 weight  0.10000E+01 volume  0.56455E-02 ppm1      1.738 ppm2      1.508 CV     1
 ASSI {  690}
   (( segid "T22D" and resid 76   and name HG1 ))
   (( segid "T22D" and resid 76   and name HD2 ))
      2.700     0.900     0.900 peak   690 spectrum    1 weight  0.10000E+01 volume  0.19731E-02 ppm1      1.735 ppm2      3.072 CV     1
 ASSI {  692}
   (( segid "T22D" and resid 37   and name HG12))
   (( segid "T22D" and resid 81   and name HB  ))
      4.800     2.900     1.200 peak   692 spectrum    1 weight  0.10000E+01 volume  0.48957E-03 ppm1      0.525 ppm2      1.091 CV     1
 ASSI {  695}
   (( segid "T22D" and resid 76   and name HG2 ))
   (( segid "T22D" and resid 76   and name HB2 ))
      3.300     1.400     1.400 peak   695 spectrum    1 weight  0.10000E+01 volume  0.18094E-02 ppm1      1.515 ppm2      2.299 CV     1
 ASSI {  697}
   (( segid "T22D" and resid 76   and name HG2 ))
   (( segid "T22D" and resid 76   and name HD2 ))
      2.900     1.000     1.000 peak   697 spectrum    1 weight  0.10000E+01 volume  0.16843E-02 ppm1      1.507 ppm2      3.071 CV     1
 ASSI {  698}
   (( segid "T22D" and resid 43   and name HG1 ))
   (( segid "T22D" and resid 43   and name HD1 ))
      2.700     0.900     0.900 peak   698 spectrum    1 weight  0.10000E+01 volume  0.14830E-02 ppm1      2.224 ppm2      3.793 CV     1
 ASSI {  699}
   (( segid "T22D" and resid 43   and name HG2 ))
   (( segid "T22D" and resid 43   and name HG1 ))
      2.100     0.500     0.500 peak   699 spectrum    1 weight  0.10000E+01 volume  0.38847E-02 ppm1      1.809 ppm2      2.225 CV     1
 ASSI {  700}
   (( segid "T22D" and resid 43   and name HG2 ))
   (( segid "T22D" and resid 43   and name HD1 ))
      3.800     1.800     1.800 peak   700 spectrum    1 weight  0.10000E+01 volume  0.68298E-03 ppm1      1.810 ppm2      3.786 CV     1
 ASSI {  703}
   (( segid "T22D" and resid 43   and name HG1 ))
   (( segid "T22D" and resid 42   and name HA  ))
      4.800     2.800     1.200 peak   703 spectrum    1 weight  0.10000E+01 volume  0.71230E-03 ppm1      2.215 ppm2      4.321 CV     1
 ASSI {  706}
   (( segid "T22D" and resid 37   and name HG11))
   (( segid "T22D" and resid 37   and name HG12))
      2.100     0.500     0.500 peak   706 spectrum    1 weight  0.10000E+01 volume  0.35673E-02 ppm1      1.724 ppm2      0.525 CV     1
 ASSI {  707}
   (( segid "T22D" and resid 37   and name HG11))
   (( segid "T22D" and resid 37   and name HA  ))
      3.300     1.400     1.400 peak   707 spectrum    1 weight  0.10000E+01 volume  0.93277E-03 ppm1      1.730 ppm2      4.201 CV     1
 ASSI {  708}
   (( segid "T22D" and resid 37   and name HG12))
   (  segid "T22D" and resid 109  and name HD2%)
      3.000     1.100     1.100 peak   708 spectrum    1 weight  0.10000E+01 volume  0.89770E-03 ppm1      0.529 ppm2      0.884 CV     1
 ASSI {  711}
   (( segid "T22D" and resid 57   and name HB1 ))
   (( segid "T22D" and resid 57   and name HA  ))
      2.500     0.800     0.800 peak   711 spectrum    1 weight  0.10000E+01 volume  0.61217E-02 ppm1      1.577 ppm2      4.079 CV     1
 OR {  711}
   (( segid "T22D" and resid 57   and name HB2 ))
   (( segid "T22D" and resid 57   and name HA  ))
 ASSI {  712}
   (( segid "T22D" and resid 43   and name HG1 ))
   (( segid "T22D" and resid 101  and name HB2 ))
      3.300     1.300     1.300 peak   712 spectrum    1 weight  0.10000E+01 volume  0.16722E-02 ppm1      2.235 ppm2      3.003 CV     1
 ASSI {  713}
   (( segid "T22D" and resid 57   and name HB2 ))
   (( segid "T22D" and resid 57   and name HG2 ))
      2.900     1.100     1.100 peak   713 spectrum    1 weight  0.10000E+01 volume  0.25282E-02 ppm1      1.587 ppm2      0.045 CV     1
 OR {  713}
   (( segid "T22D" and resid 57   and name HB1 ))
   (( segid "T22D" and resid 57   and name HG2 ))
 ASSI {  714}
   (( segid "T22D" and resid 43   and name HG1 ))
   (( segid "T22D" and resid 43   and name HB2 ))
      3.000     1.100     1.100 peak   714 spectrum    1 weight  0.10000E+01 volume  0.22142E-02 ppm1      2.224 ppm2      1.617 CV     1
 ASSI {  715}
   (( segid "T22D" and resid 103  and name HG1 ))
   (( segid "T22D" and resid 103  and name HD1 ))
      3.800     1.800     1.800 peak   715 spectrum    1 weight  0.10000E+01 volume  0.88102E-03 ppm1      1.435 ppm2      2.735 CV     1
 ASSI {  718}
   (( segid "T22D" and resid 103  and name HG2 ))
   (( segid "T22D" and resid 103  and name HD1 ))
      2.800     1.000     1.000 peak   718 spectrum    1 weight  0.10000E+01 volume  0.16058E-02 ppm1      1.798 ppm2      2.732 CV     1
 ASSI {  720}
   (( segid "T22D" and resid 93   and name HB1 ))
   (( segid "T22D" and resid 93   and name HB2 ))
      1.900     0.500     0.500 peak   720 spectrum    1 weight  0.10000E+01 volume  0.78807E-02 ppm1      3.040 ppm2      2.800 CV     1
 ASSI {  721}
   (( segid "T22D" and resid 56   and name HB1 ))
   (  segid "T22D" and resid 81   and name HG2%)
      4.600     2.700     1.400 peak   721 spectrum    1 weight  0.10000E+01 volume  0.84053E-03 ppm1      2.067 ppm2      0.291 CV     1
 ASSI {  726}
   (( segid "T22D" and resid 93   and name HB2 ))
   (( segid "T22D" and resid 93   and name HA  ))
      3.000     1.100     1.100 peak   726 spectrum    1 weight  0.10000E+01 volume  0.26987E-02 ppm1      2.803 ppm2      4.260 CV     1
 ASSI {  729}
   (( segid "T22D" and resid 56   and name HB1 ))
   (( segid "T22D" and resid 56   and name HA  ))
      2.500     0.800     0.800 peak   729 spectrum    1 weight  0.10000E+01 volume  0.36751E-02 ppm1      2.057 ppm2      4.404 CV     1
 ASSI {  730}
   (( segid "T22D" and resid 94   and name HD2 ))
   (( segid "T22D" and resid 94   and name HA  ))
      2.600     0.800     0.800 peak   730 spectrum    1 weight  0.10000E+01 volume  0.54091E-02 ppm1      1.756 ppm2      3.881 CV     1
 OR {  730}
   (( segid "T22D" and resid 94   and name HD1 ))
   (( segid "T22D" and resid 94   and name HA  ))
 ASSI {  731}
   (( segid "T22D" and resid 103  and name HG2 ))
   (( segid "T22D" and resid 103  and name HD2 ))
      3.300     1.400     1.400 peak   731 spectrum    1 weight  0.10000E+01 volume  0.17142E-02 ppm1      1.788 ppm2      2.895 CV     1
 ASSI {  732}
   (( segid "T22D" and resid 56   and name HB2 ))
   (( segid "T22D" and resid 56   and name HA  ))
      2.500     0.800     0.800 peak   732 spectrum    1 weight  0.10000E+01 volume  0.37591E-02 ppm1      2.147 ppm2      4.404 CV     1
 ASSI {  733}
   (( segid "T22D" and resid 56   and name HB2 ))
   (( segid "T22D" and resid 56   and name HG2 ))
      3.100     1.200     1.200 peak   733 spectrum    1 weight  0.10000E+01 volume  0.24443E-02 ppm1      2.133 ppm2      2.621 CV     1
 ASSI {  734}
   (( segid "T22D" and resid 103  and name HG1 ))
   (( segid "T22D" and resid 103  and name HD2 ))
      3.000     1.100     1.100 peak   734 spectrum    1 weight  0.10000E+01 volume  0.11053E-02 ppm1      1.442 ppm2      2.897 CV     1
 ASSI {  735}
   (( segid "T22D" and resid 103  and name HG1 ))
   (( segid "3T5T" and resid 3    and name H73 ))
      3.900     1.900     1.900 peak   735 spectrum    1 weight  0.10000E+01 volume  0.73140E-03 ppm1      1.412 ppm2      1.906 CV     1
 OR {  735}
   (( segid "T22D" and resid 103  and name HG1 ))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {  735}
   (( segid "T22D" and resid 103  and name HG1 ))
   (( segid "3T5T" and resid 3    and name H72 ))
 ASSI {  737}
   (( segid "T22D" and resid 56   and name HB2 ))
   (( segid "T22D" and resid 56   and name HG1 ))
      2.700     0.900     0.900 peak   737 spectrum    1 weight  0.10000E+01 volume  0.26897E-02 ppm1      2.134 ppm2      2.427 CV     1
 ASSI {  738}
   (( segid "T22D" and resid 74   and name HD2 ))
   (( segid "T22D" and resid 74   and name HE1 ))
      2.500     0.800     0.800 peak   738 spectrum    1 weight  0.10000E+01 volume  0.44679E-02 ppm1      1.547 ppm2      2.729 CV     1
 OR {  738}
   (( segid "T22D" and resid 74   and name HD1 ))
   (( segid "T22D" and resid 74   and name HE1 ))
 ASSI {  739}
   (( segid "T22D" and resid 74   and name HD1 ))
   (( segid "T22D" and resid 74   and name HE2 ))
      2.500     0.800     0.800 peak   739 spectrum    1 weight  0.10000E+01 volume  0.52952E-02 ppm1      1.557 ppm2      2.836 CV     1
 OR {  739}
   (( segid "T22D" and resid 74   and name HD2 ))
   (( segid "T22D" and resid 74   and name HE2 ))
 ASSI {  740}
   (( segid "T22D" and resid 74   and name HD2 ))
   (( segid "T22D" and resid 74   and name HA  ))
      2.400     0.700     0.700 peak   740 spectrum    1 weight  0.10000E+01 volume  0.47556E-02 ppm1      1.544 ppm2      4.364 CV     1
 OR {  740}
   (( segid "T22D" and resid 74   and name HD1 ))
   (( segid "T22D" and resid 74   and name HA  ))
 ASSI {  741}
   (( segid "T22D" and resid 74   and name HD2 ))
   (( segid "T22D" and resid 72   and name HB  ))
      3.600     1.700     1.700 peak   741 spectrum    1 weight  0.10000E+01 volume  0.24464E-02 ppm1      1.554 ppm2      4.320 CV     1
 OR {  741}
   (( segid "T22D" and resid 74   and name HD1 ))
   (( segid "T22D" and resid 72   and name HB  ))
 ASSI {  747}
   (( segid "T22D" and resid 52   and name HB2 ))
   (( segid "T22D" and resid 53   and name HG2 ))
      4.000     2.000     2.000 peak   747 spectrum    1 weight  0.10000E+01 volume  0.55317E-03 ppm1      3.588 ppm2      2.650 CV     1
 OR {  747}
   (( segid "T22D" and resid 52   and name HB1 ))
   (( segid "T22D" and resid 53   and name HG2 ))
 ASSI {  749}
   (( segid "T22D" and resid 90   and name HB2 ))
   (( segid "T22D" and resid 90   and name HA  ))
      2.300     0.700     0.700 peak   749 spectrum    1 weight  0.10000E+01 volume  0.55613E-02 ppm1      2.226 ppm2      4.052 CV     1
 ASSI {  752}
   (( segid "T22D" and resid 91   and name HG2 ))
   (( segid "T22D" and resid 91   and name HG1 ))
      1.900     0.400     0.400 peak   752 spectrum    1 weight  0.10000E+01 volume  0.75992E-02 ppm1      2.086 ppm2      1.710 CV     1
 ASSI {  753}
   (( segid "T22D" and resid 84   and name HD2 ))
   (( segid "T22D" and resid 60   and name HB1 ))
      2.600     0.900     0.900 peak   753 spectrum    1 weight  0.10000E+01 volume  0.42406E-02 ppm1      1.710 ppm2      2.538 CV     1
 OR {  753}
   (( segid "T22D" and resid 84   and name HD1 ))
   (( segid "T22D" and resid 60   and name HB1 ))
 ASSI {  754}
   (( segid "T22D" and resid 84   and name HD2 ))
   (( segid "T22D" and resid 84   and name HE1 ))
      2.400     0.700     0.700 peak   754 spectrum    1 weight  0.10000E+01 volume  0.60033E-02 ppm1      1.708 ppm2      2.919 CV     1
 OR {  754}
   (( segid "T22D" and resid 84   and name HD1 ))
   (( segid "T22D" and resid 84   and name HE2 ))
 OR {  754}
   (( segid "T22D" and resid 84   and name HD2 ))
   (( segid "T22D" and resid 84   and name HE2 ))
 OR {  754}
   (( segid "T22D" and resid 84   and name HD1 ))
   (( segid "T22D" and resid 84   and name HE1 ))
 ASSI {  755}
   (( segid "T22D" and resid 84   and name HD2 ))
   (( segid "T22D" and resid 60   and name HB2 ))
      2.800     1.000     1.000 peak   755 spectrum    1 weight  0.10000E+01 volume  0.40401E-02 ppm1      1.706 ppm2      2.598 CV     1
 OR {  755}
   (( segid "T22D" and resid 84   and name HD1 ))
   (( segid "T22D" and resid 60   and name HB2 ))
 ASSI {  759}
   (( segid "T22D" and resid 90   and name HB2 ))
   (  segid "T22D" and resid 87   and name HB% )
      4.100     2.100     1.900 peak   759 spectrum    1 weight  0.10000E+01 volume  0.11922E-02 ppm1      2.216 ppm2      1.518 CV     1
 ASSI {  761}
   (( segid "T22D" and resid 90   and name HB2 ))
   (( segid "T22D" and resid 90   and name HG2 ))
      2.700     0.900     0.900 peak   761 spectrum    1 weight  0.10000E+01 volume  0.52443E-02 ppm1      2.232 ppm2      2.555 CV     1
 ASSI {  763}
   (( segid "T22D" and resid 90   and name HB2 ))
   (( segid "T22D" and resid 87   and name HA  ))
      2.900     1.000     1.000 peak   763 spectrum    1 weight  0.10000E+01 volume  0.29551E-02 ppm1      2.208 ppm2      4.243 CV     1
 ASSI {  764}
   (( segid "T22D" and resid 56   and name HB1 ))
   (( segid "T22D" and resid 56   and name HG2 ))
      2.500     0.800     0.800 peak   764 spectrum    1 weight  0.10000E+01 volume  0.28391E-02 ppm1      2.072 ppm2      2.628 CV     1
 ASSI {  766}
   (( segid "T22D" and resid 104  and name HD2 ))
   (  segid "T22D" and resid 99   and name HD1%)
      3.200     1.300     1.300 peak   766 spectrum    1 weight  0.10000E+01 volume  0.19608E-02 ppm1      1.611 ppm2      0.705 CV     1
 OR {  766}
   (( segid "T22D" and resid 104  and name HD1 ))
   (  segid "T22D" and resid 99   and name HD1%)
 ASSI {  767}
   (( segid "T22D" and resid 52   and name HB1 ))
   (( segid "T22D" and resid 52   and name HD2 ))
      3.100     1.200     1.200 peak   767 spectrum    1 weight  0.10000E+01 volume  0.13535E-02 ppm1      3.590 ppm2      7.299 CV     1
 OR {  767}
   (( segid "T22D" and resid 52   and name HB2 ))
   (( segid "T22D" and resid 52   and name HD2 ))
 ASSI {  768}
   (( segid "T22D" and resid 52   and name HB1 ))
   (  segid "T22D" and resid 61   and name HG2%)
      5.100     3.300     0.900 peak   768 spectrum    1 weight  0.10000E+01 volume  0.45404E-03 ppm1      3.592 ppm2      0.601 CV     1
 OR {  768}
   (( segid "T22D" and resid 52   and name HB2 ))
   (  segid "T22D" and resid 61   and name HG2%)
 ASSI {  770}
   (( segid "T22D" and resid 104  and name HD2 ))
   (( segid "T22D" and resid 97   and name HA  ))
      3.600     1.600     1.600 peak   770 spectrum    1 weight  0.10000E+01 volume  0.78361E-03 ppm1      1.628 ppm2      6.045 CV     1
 OR {  770}
   (( segid "T22D" and resid 104  and name HD1 ))
   (( segid "T22D" and resid 97   and name HA  ))
 ASSI {  771}
   (( segid "T22D" and resid 91   and name HG1 ))
   (( segid "T22D" and resid 91   and name HA  ))
      3.100     1.200     1.200 peak   771 spectrum    1 weight  0.10000E+01 volume  0.40579E-02 ppm1      1.727 ppm2      3.980 CV     1
 ASSI {  773}
   (( segid "T22D" and resid 91   and name HG1 ))
   (( segid "T22D" and resid 91   and name HD2 ))
      2.600     0.800     0.800 peak   773 spectrum    1 weight  0.10000E+01 volume  0.38540E-02 ppm1      1.711 ppm2      3.599 CV     1
 ASSI {  774}
   (( segid "T22D" and resid 104  and name HD2 ))
   (( segid "T22D" and resid 97   and name HB1 ))
      2.800     1.000     1.000 peak   774 spectrum    1 weight  0.10000E+01 volume  0.21443E-02 ppm1      1.620 ppm2      2.426 CV     1
 OR {  774}
   (( segid "T22D" and resid 104  and name HD1 ))
   (( segid "T22D" and resid 97   and name HB1 ))
 ASSI {  775}
   (( segid "T22D" and resid 91   and name HG2 ))
   (( segid "T22D" and resid 91   and name HA  ))
      2.700     0.900     0.900 peak   775 spectrum    1 weight  0.10000E+01 volume  0.30030E-02 ppm1      2.101 ppm2      3.977 CV     1
 ASSI {  778}
   (( segid "T22D" and resid 91   and name HG2 ))
   (( segid "T22D" and resid 91   and name HD2 ))
      2.800     0.900     0.900 peak   778 spectrum    1 weight  0.10000E+01 volume  0.31213E-02 ppm1      2.095 ppm2      3.597 CV     1
 ASSI {  780}
   (( segid "T22D" and resid 104  and name HD1 ))
   (( segid "T22D" and resid 97   and name HB2 ))
      3.200     1.300     1.300 peak   780 spectrum    1 weight  0.10000E+01 volume  0.32688E-02 ppm1      1.618 ppm2      2.799 CV     1
 ASSI {  782}
   (( segid "T22D" and resid 53   and name HB1 ))
   (( segid "T22D" and resid 53   and name HA  ))
      2.300     0.600     0.600 peak   782 spectrum    1 weight  0.10000E+01 volume  0.79624E-02 ppm1      2.070 ppm2      4.060 CV     1
 ASSI {  784}
   (( segid "T22D" and resid 52   and name HB2 ))
   (( segid "T22D" and resid 53   and name HB2 ))
      4.700     2.800     1.300 peak   784 spectrum    1 weight  0.10000E+01 volume  0.48632E-03 ppm1      3.589 ppm2      2.271 CV     1
 OR {  784}
   (( segid "T22D" and resid 52   and name HB1 ))
   (( segid "T22D" and resid 53   and name HB2 ))
 ASSI {  785}
   (( segid "T22D" and resid 53   and name HB2 ))
   (( segid "T22D" and resid 50   and name HA  ))
      2.600     0.800     0.800 peak   785 spectrum    1 weight  0.10000E+01 volume  0.37421E-02 ppm1      2.267 ppm2      4.178 CV     1
 ASSI {  787}
   (( segid "T22D" and resid 53   and name HB2 ))
   (( segid "T22D" and resid 53   and name HG2 ))
      2.600     0.800     0.800 peak   787 spectrum    1 weight  0.10000E+01 volume  0.39429E-02 ppm1      2.275 ppm2      2.652 CV     1
 ASSI {  791}
   (( segid "T22D" and resid 45   and name HB1 ))
   (( segid "T22D" and resid 45   and name HB2 ))
      2.100     0.500     0.500 peak   791 spectrum    1 weight  0.10000E+01 volume  0.74420E-02 ppm1      3.064 ppm2      3.439 CV     1
 ASSI {  793}
   (( segid "T22D" and resid 45   and name HB1 ))
   (( segid "T22D" and resid 45   and name HD2 ))
      3.400     1.400     1.400 peak   793 spectrum    1 weight  0.10000E+01 volume  0.11465E-02 ppm1      3.051 ppm2      7.126 CV     1
 ASSI {  795}
   (( segid "T22D" and resid 36   and name HD1 ))
   (( segid "T22D" and resid 36   and name HB2 ))
      3.100     1.200     1.200 peak   795 spectrum    1 weight  0.10000E+01 volume  0.19376E-02 ppm1      1.510 ppm2      2.050 CV     1
 ASSI {  796}
   (( segid "T22D" and resid 36   and name HD1 ))
   (( segid "T22D" and resid 36   and name HE1 ))
      3.100     1.200     1.200 peak   796 spectrum    1 weight  0.10000E+01 volume  0.20827E-02 ppm1      1.517 ppm2      2.773 CV     1
 ASSI {  797}
   (( segid "T22D" and resid 36   and name HD1 ))
   (( segid "T22D" and resid 36   and name HG1 ))
      3.300     1.400     1.400 peak   797 spectrum    1 weight  0.10000E+01 volume  0.16047E-02 ppm1      1.515 ppm2      0.964 CV     1
 ASSI {  799}
   (( segid "T22D" and resid 36   and name HD2 ))
   (( segid "T22D" and resid 36   and name HG1 ))
      2.900     1.000     1.000 peak   799 spectrum    1 weight  0.10000E+01 volume  0.11881E-02 ppm1      1.623 ppm2      0.928 CV     1
 ASSI {  801}
   (( segid "T22D" and resid 70   and name HB2 ))
   (( segid "T22D" and resid 70   and name HA  ))
      2.000     0.500     0.500 peak   801 spectrum    1 weight  0.10000E+01 volume  0.20328E-01 ppm1      1.859 ppm2      4.061 CV     1
 OR {  801}
   (( segid "T22D" and resid 70   and name HB1 ))
   (( segid "T22D" and resid 70   and name HA  ))
 ASSI {  802}
   (( segid "T22D" and resid 70   and name HB2 ))
   (( segid "T22D" and resid 69   and name HA  ))
      4.400     2.400     1.600 peak   802 spectrum    1 weight  0.10000E+01 volume  0.12271E-02 ppm1      1.854 ppm2      4.608 CV     1
 OR {  802}
   (( segid "T22D" and resid 70   and name HB1 ))
   (( segid "T22D" and resid 69   and name HA  ))
 ASSI {  803}
   (( segid "T22D" and resid 36   and name HD1 ))
   (( segid "T22D" and resid 36   and name HE2 ))
      2.700     0.900     0.900 peak   803 spectrum    1 weight  0.10000E+01 volume  0.21018E-02 ppm1      1.520 ppm2      2.247 CV     1
 ASSI {  804}
   (( segid "T22D" and resid 86   and name HB2 ))
   (( segid "T22D" and resid 34   and name HB1 ))
      3.500     1.600     1.600 peak   804 spectrum    1 weight  0.10000E+01 volume  0.78536E-03 ppm1      1.916 ppm2      2.735 CV     1
 ASSI {  806}
   (( segid "T22D" and resid 86   and name HB1 ))
   (( segid "T22D" and resid 86   and name HD2 ))
      2.800     1.000     1.000 peak   806 spectrum    1 weight  0.10000E+01 volume  0.31400E-02 ppm1      1.842 ppm2      3.031 CV     1
 ASSI {  807}
   (( segid "T22D" and resid 86   and name HB2 ))
   (( segid "T22D" and resid 34   and name HB2 ))
      3.200     1.300     1.300 peak   807 spectrum    1 weight  0.10000E+01 volume  0.10908E-02 ppm1      1.925 ppm2      3.525 CV     1
 ASSI {  808}
   (( segid "T22D" and resid 86   and name HB1 ))
   (( segid "T22D" and resid 34   and name HB2 ))
      4.400     2.400     1.600 peak   808 spectrum    1 weight  0.10000E+01 volume  0.11406E-02 ppm1      1.847 ppm2      3.521 CV     1
 ASSI {  810}
   (( segid "T22D" and resid 86   and name HB2 ))
   (( segid "T22D" and resid 86   and name HD2 ))
      2.600     2.600     3.400 peak   810 spectrum    1 weight  0.10000E+01 volume  0.30660E-02 ppm1      1.925 ppm2      3.034 CV     1
 ASSI {  811}
   (( segid "T22D" and resid 86   and name HB1 ))
   (( segid "T22D" and resid 86   and name HD1 ))
      2.600     0.800     0.800 peak   811 spectrum    1 weight  0.10000E+01 volume  0.33411E-02 ppm1      1.856 ppm2      2.956 CV     1
 ASSI {  812}
   (( segid "T22D" and resid 30   and name HB1 ))
   (( segid "T22D" and resid 30   and name HD1 ))
      2.300     0.700     0.700 peak   812 spectrum    1 weight  0.10000E+01 volume  0.10881E-01 ppm1      1.862 ppm2      3.196 CV     1
 OR {  812}
   (( segid "T22D" and resid 30   and name HB1 ))
   (( segid "T22D" and resid 30   and name HD2 ))
 ASSI {  815}
   (( segid "T22D" and resid 30   and name HB1 ))
   (( segid "T22D" and resid 30   and name HA  ))
      2.300     0.700     0.700 peak   815 spectrum    1 weight  0.10000E+01 volume  0.84954E-02 ppm1      1.860 ppm2      4.296 CV     1
 ASSI {  816}
   (( segid "T22D" and resid 30   and name HB2 ))
   (( segid "T22D" and resid 30   and name HA  ))
      2.400     0.700     0.700 peak   816 spectrum    1 weight  0.10000E+01 volume  0.65483E-02 ppm1      1.779 ppm2      4.296 CV     1
 ASSI {  819}
   (( segid "T22D" and resid 62   and name HB2 ))
   (  segid "T22D" and resid 61   and name HG2%)
      4.900     3.000     1.100 peak   819 spectrum    1 weight  0.10000E+01 volume  0.45062E-03 ppm1      1.821 ppm2      0.604 CV     1
 ASSI {  821}
   (( segid "T22D" and resid 62   and name HB1 ))
   (( segid "T22D" and resid 82   and name HB  ))
      2.700     0.900     0.900 peak   821 spectrum    1 weight  0.10000E+01 volume  0.19151E-02 ppm1      1.702 ppm2      3.909 CV     1
 ASSI {  823}
   (( segid "T22D" and resid 30   and name HB2 ))
   (( segid "T22D" and resid 30   and name HD2 ))
      2.500     0.800     0.800 peak   823 spectrum    1 weight  0.10000E+01 volume  0.78607E-02 ppm1      1.762 ppm2      3.191 CV     1
 OR {  823}
   (( segid "T22D" and resid 30   and name HB2 ))
   (( segid "T22D" and resid 30   and name HD1 ))
 ASSI {  824}
   (( segid "T22D" and resid 117  and name HB2 ))
   (( segid "T22D" and resid 117  and name HA  ))
      2.400     0.700     0.700 peak   824 spectrum    1 weight  0.10000E+01 volume  0.80788E-02 ppm1      1.844 ppm2      4.400 CV     1
 OR {  824}
   (( segid "T22D" and resid 117  and name HB1 ))
   (( segid "T22D" and resid 117  and name HA  ))
 ASSI {  825}
   (( segid "T22D" and resid 62   and name HB1 ))
   (( segid "T22D" and resid 62   and name HA  ))
      2.500     0.800     0.800 peak   825 spectrum    1 weight  0.10000E+01 volume  0.74149E-02 ppm1      1.722 ppm2      4.402 CV     1
 ASSI {  826}
   (( segid "T22D" and resid 62   and name HB1 ))
   (  segid "T22D" and resid 81   and name HG1%)
      4.300     2.400     1.700 peak   826 spectrum    1 weight  0.10000E+01 volume  0.55938E-03 ppm1      1.701 ppm2      0.515 CV     1
 ASSI {  827}
   (( segid "T22D" and resid 62   and name HB2 ))
   (( segid "T22D" and resid 82   and name HB  ))
      3.500     1.500     1.500 peak   827 spectrum    1 weight  0.10000E+01 volume  0.25631E-02 ppm1      1.821 ppm2      3.916 CV     1
 ASSI {  830}
   (( segid "T22D" and resid 33   and name HG2 ))
   (( segid "T22D" and resid 33   and name HB2 ))
      3.000     1.100     1.100 peak   830 spectrum    1 weight  0.10000E+01 volume  0.38743E-02 ppm1      1.258 ppm2      1.793 CV     1
 ASSI {  831}
   (( segid "T22D" and resid 33   and name HG2 ))
   (  segid "T22D" and resid 111  and name HD% )
      3.100     1.200     1.200 peak   831 spectrum    1 weight  0.10000E+01 volume  0.12870E-02 ppm1      1.262 ppm2      7.096 CV     1
 ASSI {  832}
   (( segid "T22D" and resid 33   and name HG1 ))
   (( segid "T22D" and resid 33   and name HA  ))
      2.900     1.100     1.100 peak   832 spectrum    1 weight  0.10000E+01 volume  0.21005E-02 ppm1      0.905 ppm2      3.744 CV     1
 ASSI {  833}
   (( segid "T22D" and resid 62   and name HB1 ))
   (  segid "T22D" and resid 61   and name HG2%)
      4.400     2.400     1.600 peak   833 spectrum    1 weight  0.10000E+01 volume  0.70133E-03 ppm1      1.707 ppm2      0.592 CV     1
 ASSI {  834}
   (( segid "T22D" and resid 33   and name HG2 ))
   (  segid "T22D" and resid 34   and name HD% )
      3.700     1.700     1.700 peak   834 spectrum    1 weight  0.10000E+01 volume  0.41947E-03 ppm1      1.253 ppm2      7.204 CV     1
 ASSI {  835}
   (( segid "T22D" and resid 33   and name HG2 ))
   (( segid "T22D" and resid 33   and name HA  ))
      2.700     0.900     0.900 peak   835 spectrum    1 weight  0.10000E+01 volume  0.37602E-02 ppm1      1.259 ppm2      3.744 CV     1
 ASSI {  837}
   (( segid "T22D" and resid 33   and name HG1 ))
   (  segid "T22D" and resid 111  and name HD% )
      3.500     1.500     1.500 peak   837 spectrum    1 weight  0.10000E+01 volume  0.83573E-03 ppm1      0.907 ppm2      7.101 CV     1
 ASSI {  838}
   (( segid "T22D" and resid 33   and name HG1 ))
   (( segid "T22D" and resid 33   and name HG2 ))
      1.800     0.400     0.400 peak   838 spectrum    1 weight  0.10000E+01 volume  0.14133E-01 ppm1      0.902 ppm2      1.263 CV     1
 ASSI {  839}
   (( segid "T22D" and resid 33   and name HG2 ))
   (  segid "T22D" and resid 33   and name HE% )
      3.400     1.400     1.400 peak   839 spectrum    1 weight  0.10000E+01 volume  0.86776E-03 ppm1      1.261 ppm2      1.489 CV     1
 ASSI {  840}
   (( segid "T22D" and resid 33   and name HG1 ))
   (  segid "T22D" and resid 33   and name HE% )
      3.600     1.600     1.600 peak   840 spectrum    1 weight  0.10000E+01 volume  0.91438E-03 ppm1      0.910 ppm2      1.492 CV     1
 ASSI {  841}
   (( segid "T22D" and resid 33   and name HG1 ))
   (( segid "T22D" and resid 33   and name HB2 ))
      2.500     0.800     0.800 peak   841 spectrum    1 weight  0.10000E+01 volume  0.32371E-02 ppm1      0.906 ppm2      1.793 CV     1
 ASSI {  842}
   (( segid "T22D" and resid 57   and name HG1 ))
   (( segid "T22D" and resid 57   and name HG2 ))
      2.100     0.500     0.500 peak   842 spectrum    1 weight  0.10000E+01 volume  0.55283E-02 ppm1      1.475 ppm2      0.047 CV     1
 ASSI {  844}
   (( segid "T22D" and resid 33   and name HG2 ))
   (  segid "T22D" and resid 111  and name HE% )
      3.600     1.600     1.600 peak   844 spectrum    1 weight  0.10000E+01 volume  0.67544E-03 ppm1      1.281 ppm2      6.727 CV     1
 ASSI {  845}
   (( segid "T22D" and resid 33   and name HG2 ))
   (( segid "T22D" and resid 111  and name HB2 ))
      3.900     1.900     1.900 peak   845 spectrum    1 weight  0.10000E+01 volume  0.58261E-03 ppm1      1.255 ppm2      3.228 CV     1
 ASSI {  847}
   (( segid "T22D" and resid 91   and name HB1 ))
   (( segid "T22D" and resid 58   and name HB1 ))
      3.900     1.900     1.900 peak   847 spectrum    1 weight  0.10000E+01 volume  0.52790E-03 ppm1      2.383 ppm2      2.891 CV     1
 ASSI {  848}
   (( segid "T22D" and resid 33   and name HG1 ))
   (( segid "T22D" and resid 111  and name HB2 ))
      3.900     1.900     1.900 peak   848 spectrum    1 weight  0.10000E+01 volume  0.50062E-03 ppm1      0.893 ppm2      3.229 CV     1
 ASSI {  849}
   (( segid "T22D" and resid 57   and name HG2 ))
   (( segid "T22D" and resid 57   and name HA  ))
      3.200     1.300     1.300 peak   849 spectrum    1 weight  0.10000E+01 volume  0.11217E-02 ppm1      0.052 ppm2      4.077 CV     1
 ASSI {  854}
   (( segid "T22D" and resid 33   and name HG1 ))
   (  segid "T22D" and resid 111  and name HE% )
      3.700     3.700     2.300 peak   854 spectrum    1 weight  0.10000E+01 volume  0.10588E-02 ppm1      0.903 ppm2      6.726 CV     1
 ASSI {  857}
   (( segid "T22D" and resid 76   and name HB1 ))
   (( segid "T22D" and resid 75   and name HA  ))
      4.900     3.000     1.100 peak   857 spectrum    1 weight  0.10000E+01 volume  0.69991E-03 ppm1      1.296 ppm2      4.175 CV     1
 ASSI {  858}
   (( segid "T22D" and resid 76   and name HB2 ))
   (( segid "T22D" and resid 76   and name HB1 ))
      2.300     0.700     0.700 peak   858 spectrum    1 weight  0.10000E+01 volume  0.20554E-02 ppm1      2.298 ppm2      1.331 CV     1
 ASSI {  860}
   (( segid "T22D" and resid 76   and name HB2 ))
   (  segid "T22D" and resid 78   and name HE% )
      3.500     1.500     1.500 peak   860 spectrum    1 weight  0.10000E+01 volume  0.85008E-03 ppm1      2.295 ppm2      6.626 CV     1
 ASSI {  863}
   (( segid "T22D" and resid 91   and name HB2 ))
   (  segid "T22D" and resid 58   and name HD% )
      3.700     1.700     1.700 peak   863 spectrum    1 weight  0.10000E+01 volume  0.78327E-03 ppm1      2.053 ppm2      7.346 CV     1
 ASSI {  870}
   (( segid "T22D" and resid 91   and name HB1 ))
   (( segid "T22D" and resid 88   and name HA  ))
      4.000     2.000     2.000 peak   870 spectrum    1 weight  0.10000E+01 volume  0.15550E-02 ppm1      2.368 ppm2      4.339 CV     1
 ASSI {  871}
   (( segid "T22D" and resid 91   and name HB2 ))
   (( segid "T22D" and resid 88   and name HA  ))
      2.900     1.000     1.000 peak   871 spectrum    1 weight  0.10000E+01 volume  0.16648E-02 ppm1      2.047 ppm2      4.337 CV     1
 ASSI {  875}
   (( segid "T22D" and resid 91   and name HB1 ))
   (  segid "T22D" and resid 58   and name HD% )
      3.500     1.500     1.500 peak   875 spectrum    1 weight  0.10000E+01 volume  0.68815E-03 ppm1      2.357 ppm2      7.361 CV     1
 ASSI {  878}
   (( segid "T22D" and resid 91   and name HB2 ))
   (( segid "T22D" and resid 58   and name HB1 ))
      3.000     1.100     1.100 peak   878 spectrum    1 weight  0.10000E+01 volume  0.74207E-03 ppm1      2.051 ppm2      2.892 CV     1
 ASSI {  879}
   (( segid "T22D" and resid 33   and name HG1 ))
   (  segid "T22D" and resid 34   and name HD% )
      4.400     2.400     1.600 peak   879 spectrum    1 weight  0.10000E+01 volume  0.64845E-03 ppm1      0.920 ppm2      7.198 CV     1
 ASSI {  881}
   (( segid "T22D" and resid 91   and name HB1 ))
   (( segid "T22D" and resid 91   and name HD1 ))
      3.300     1.400     1.400 peak   881 spectrum    1 weight  0.10000E+01 volume  0.14226E-02 ppm1      2.358 ppm2      3.420 CV     1
 ASSI {  882}
   (( segid "T22D" and resid 91   and name HB1 ))
   (( segid "T22D" and resid 91   and name HB2 ))
      2.100     0.500     0.500 peak   882 spectrum    1 weight  0.10000E+01 volume  0.44529E-02 ppm1      2.358 ppm2      2.058 CV     1
 ASSI {  883}
   (( segid "T22D" and resid 91   and name HB1 ))
   (( segid "T22D" and resid 91   and name HG1 ))
      2.900     1.100     1.100 peak   883 spectrum    1 weight  0.10000E+01 volume  0.19380E-02 ppm1      2.355 ppm2      1.712 CV     1
 ASSI {  884}
   (( segid "T22D" and resid 91   and name HB2 ))
   (( segid "T22D" and resid 91   and name HG1 ))
      2.500     0.800     0.800 peak   884 spectrum    1 weight  0.10000E+01 volume  0.30095E-02 ppm1      2.061 ppm2      1.714 CV     1
 ASSI {  888}
   (( segid "T22D" and resid 104  and name HB2 ))
   (( segid "T22D" and resid 104  and name HE2 ))
      2.800     1.000     1.000 peak   888 spectrum    1 weight  0.10000E+01 volume  0.27420E-02 ppm1      1.629 ppm2      2.875 CV     1
 OR {  888}
   (( segid "T22D" and resid 104  and name HB2 ))
   (( segid "T22D" and resid 104  and name HE1 ))
 OR {  888}
   (( segid "T22D" and resid 104  and name HB1 ))
   (( segid "T22D" and resid 104  and name HE2 ))
 OR {  888}
   (( segid "T22D" and resid 104  and name HB1 ))
   (( segid "T22D" and resid 104  and name HE1 ))
 ASSI {  891}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 82   and name HA  ))
      5.100     3.200     0.900 peak   891 spectrum    1 weight  0.10000E+01 volume  0.54007E-03 ppm1      2.572 ppm2      5.244 CV     1
 ASSI {  894}
   (( segid "T22D" and resid 116  and name HB2 ))
   (( segid "T22D" and resid 116  and name HA  ))
      2.600     0.900     0.900 peak   894 spectrum    1 weight  0.10000E+01 volume  0.68353E-02 ppm1      1.868 ppm2      4.403 CV     1
 ASSI {  895}
   (( segid "T22D" and resid 104  and name HB2 ))
   (( segid "T22D" and resid 104  and name HA  ))
      2.500     0.800     0.800 peak   895 spectrum    1 weight  0.10000E+01 volume  0.39617E-02 ppm1      1.630 ppm2      4.138 CV     1
 OR {  895}
   (( segid "T22D" and resid 104  and name HB1 ))
   (( segid "T22D" and resid 104  and name HA  ))
 ASSI {  898}
   (( segid "T22D" and resid 116  and name HB1 ))
   (( segid "T22D" and resid 116  and name HD2 ))
      3.800     1.800     1.800 peak   898 spectrum    1 weight  0.10000E+01 volume  0.14707E-02 ppm1      2.295 ppm2      3.615 CV     1
 ASSI {  900}
   (( segid "T22D" and resid 27   and name HG2 ))
   (( segid "T22D" and resid 27   and name HB1 ))
      2.600     0.800     0.800 peak   900 spectrum    1 weight  0.10000E+01 volume  0.53273E-02 ppm1      2.564 ppm2      1.995 CV     1
 OR {  900}
   (( segid "T22D" and resid 27   and name HG1 ))
   (( segid "T22D" and resid 27   and name HB1 ))
 ASSI {  903}
   (( segid "T22D" and resid 116  and name HB1 ))
   (( segid "T22D" and resid 116  and name HA  ))
      2.100     0.500     0.500 peak   903 spectrum    1 weight  0.10000E+01 volume  0.12667E-01 ppm1      2.296 ppm2      4.403 CV     1
 ASSI {  905}
   (( segid "T22D" and resid 116  and name HB1 ))
   (( segid "T22D" and resid 116  and name HD1 ))
      3.300     1.300     1.300 peak   905 spectrum    1 weight  0.10000E+01 volume  0.16296E-02 ppm1      2.296 ppm2      3.798 CV     1
 ASSI {  906}
   (( segid "T22D" and resid 116  and name HB1 ))
   (( segid "T22D" and resid 116  and name HB2 ))
      1.600     0.300     0.600 peak   906 spectrum    1 weight  0.10000E+01 volume  0.24547E-01 ppm1      2.295 ppm2      1.870 CV     1
 ASSI {  912}
   (( segid "T22D" and resid 94   and name HB2 ))
   (( segid "T22D" and resid 94   and name HA  ))
      2.200     0.600     0.600 peak   912 spectrum    1 weight  0.10000E+01 volume  0.98807E-02 ppm1      1.896 ppm2      3.880 CV     1
 ASSI {  913}
   (( segid "T22D" and resid 116  and name HB2 ))
   (( segid "T22D" and resid 116  and name HD1 ))
      3.600     1.600     1.600 peak   913 spectrum    1 weight  0.10000E+01 volume  0.24478E-02 ppm1      1.853 ppm2      3.796 CV     1
 ASSI {  915}
   (( segid "T22D" and resid 39   and name HB  ))
   (  segid "T22D" and resid 107  and name HG2%)
      4.800     2.900     1.200 peak   915 spectrum    1 weight  0.10000E+01 volume  0.61213E-03 ppm1      1.456 ppm2      1.034 CV     1
 OR {  915}
   (( segid "T22D" and resid 39   and name HB  ))
   (  segid "T22D" and resid 107  and name HG1%)
 ASSI {  917}
   (( segid "T22D" and resid 39   and name HB  ))
   (  segid "T22D" and resid 51   and name HD1%)
      3.600     1.600     1.600 peak   917 spectrum    1 weight  0.10000E+01 volume  0.14126E-02 ppm1      1.450 ppm2      0.546 CV     1
 ASSI {  918}
   (( segid "T22D" and resid 39   and name HB  ))
   (  segid "T22D" and resid 81   and name HG2%)
      3.900     1.900     1.900 peak   918 spectrum    1 weight  0.10000E+01 volume  0.80488E-03 ppm1      1.449 ppm2      0.268 CV     1
 ASSI {  919}
   (( segid "T22D" and resid 83   and name HG1 ))
   (( segid "T22D" and resid 83   and name HA  ))
      3.500     1.600     1.600 peak   919 spectrum    1 weight  0.10000E+01 volume  0.10620E-02 ppm1      2.244 ppm2      5.094 CV     1
 ASSI {  921}
   (( segid "T22D" and resid 115  and name HB2 ))
   (( segid "T22D" and resid 116  and name HD1 ))
      4.800     2.900     1.200 peak   921 spectrum    1 weight  0.10000E+01 volume  0.86418E-03 ppm1      1.684 ppm2      3.798 CV     1
 ASSI {  923}
   (( segid "T22D" and resid 115  and name HB1 ))
   (( segid "T22D" and resid 116  and name HD2 ))
      2.300     0.700     0.700 peak   923 spectrum    1 weight  0.10000E+01 volume  0.43974E-02 ppm1      1.828 ppm2      3.614 CV     1
 ASSI {  924}
   (( segid "T22D" and resid 115  and name HB1 ))
   (( segid "T22D" and resid 115  and name HA  ))
      2.300     0.700     0.700 peak   924 spectrum    1 weight  0.10000E+01 volume  0.57790E-02 ppm1      1.811 ppm2      4.544 CV     1
 ASSI {  925}
   (( segid "T22D" and resid 83   and name HG2 ))
   (( segid "T22D" and resid 83   and name HG1 ))
      2.200     0.600     0.600 peak   925 spectrum    1 weight  0.10000E+01 volume  0.26342E-02 ppm1      2.567 ppm2      2.260 CV     1
 OR {  925}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 83   and name HG1 ))
 ASSI {  926}
   (( segid "T22D" and resid 115  and name HB2 ))
   (( segid "T22D" and resid 115  and name HE2 ))
      3.600     1.600     1.600 peak   926 spectrum    1 weight  0.10000E+01 volume  0.17703E-02 ppm1      1.737 ppm2      2.994 CV     1
 OR {  926}
   (( segid "T22D" and resid 115  and name HB1 ))
   (( segid "T22D" and resid 115  and name HE2 ))
 OR {  926}
   (( segid "T22D" and resid 115  and name HB2 ))
   (( segid "T22D" and resid 115  and name HE1 ))
 OR {  926}
   (( segid "T22D" and resid 115  and name HB1 ))
   (( segid "T22D" and resid 115  and name HE1 ))
 ASSI {  931}
   (( segid "T22D" and resid 98   and name HB1 ))
   (( segid "T22D" and resid 98   and name HB2 ))
      2.100     0.600     0.600 peak   931 spectrum    1 weight  0.10000E+01 volume  0.40208E-02 ppm1      2.125 ppm2      1.574 CV     1
 ASSI {  935}
   (( segid "T22D" and resid 98   and name HB2 ))
   (  segid "T22D" and resid 54   and name HE% )
      3.400     1.500     1.500 peak   935 spectrum    1 weight  0.10000E+01 volume  0.60200E-03 ppm1      1.586 ppm2      6.462 CV     1
 ASSI {  944}
   (( segid "T22D" and resid 83   and name HG1 ))
   (  segid "T22D" and resid 89   and name HB% )
      3.100     1.200     1.200 peak   944 spectrum    1 weight  0.10000E+01 volume  0.13562E-02 ppm1      2.253 ppm2      1.586 CV     1
 ASSI {  946}
   (( segid "T22D" and resid 27   and name HB1 ))
   (( segid "T22D" and resid 27   and name HA  ))
      2.600     0.800     0.800 peak   946 spectrum    1 weight  0.10000E+01 volume  0.55688E-02 ppm1      2.044 ppm2      4.435 CV     1
 OR {  946}
   (( segid "T22D" and resid 27   and name HB2 ))
   (( segid "T22D" and resid 27   and name HA  ))
 ASSI {  948}
   (( segid "T22D" and resid 49   and name HB1 ))
   (( segid "T22D" and resid 47   and name HB1 ))
      3.900     1.900     1.900 peak   948 spectrum    1 weight  0.10000E+01 volume  0.15096E-02 ppm1      1.813 ppm2      3.979 CV     1
 ASSI {  950}
   (( segid "T22D" and resid 33   and name HB1 ))
   (( segid "T22D" and resid 33   and name HA  ))
      2.700     0.900     0.900 peak   950 spectrum    1 weight  0.10000E+01 volume  0.44474E-02 ppm1      1.276 ppm2      3.743 CV     1
 ASSI {  953}
   (( segid "T22D" and resid 33   and name HB1 ))
   (( segid "T22D" and resid 33   and name HG1 ))
      2.700     0.900     0.900 peak   953 spectrum    1 weight  0.10000E+01 volume  0.67427E-02 ppm1      1.277 ppm2      0.898 CV     1
 ASSI {  954}
   (( segid "T22D" and resid 49   and name HB1 ))
   (( segid "T22D" and resid 49   and name HA  ))
      2.600     0.900     0.900 peak   954 spectrum    1 weight  0.10000E+01 volume  0.44958E-02 ppm1      1.809 ppm2      4.153 CV     1
 ASSI {  955}
   (( segid "T22D" and resid 33   and name HB1 ))
   (( segid "T22D" and resid 33   and name HB2 ))
      1.800     0.400     0.400 peak   955 spectrum    1 weight  0.10000E+01 volume  0.12309E-01 ppm1      1.281 ppm2      1.791 CV     1
 ASSI {  956}
   (( segid "T22D" and resid 33   and name HB2 ))
   (( segid "T22D" and resid 33   and name HA  ))
      2.400     0.700     0.700 peak   956 spectrum    1 weight  0.10000E+01 volume  0.69070E-02 ppm1      1.800 ppm2      3.743 CV     1
 ASSI {  957}
   (( segid "T22D" and resid 49   and name HB2 ))
   (( segid "T22D" and resid 49   and name HA  ))
      2.400     0.700     0.700 peak   957 spectrum    1 weight  0.10000E+01 volume  0.69996E-02 ppm1      1.906 ppm2      4.153 CV     1
 ASSI {  958}
   (( segid "T22D" and resid 33   and name HB1 ))
   (( segid "T22D" and resid 111  and name HB1 ))
      4.100     2.100     1.900 peak   958 spectrum    1 weight  0.10000E+01 volume  0.58928E-03 ppm1      1.269 ppm2      2.925 CV     1
 ASSI {  960}
   (( segid "T22D" and resid 33   and name HB1 ))
   (  segid "T22D" and resid 33   and name HE% )
      3.300     1.400     1.400 peak   960 spectrum    1 weight  0.10000E+01 volume  0.12611E-02 ppm1      1.285 ppm2      1.491 CV     1
 ASSI {  961}
   (( segid "T22D" and resid 33   and name HB1 ))
   (  segid "T22D" and resid 111  and name HE% )
      4.300     2.300     1.700 peak   961 spectrum    1 weight  0.10000E+01 volume  0.43778E-03 ppm1      1.319 ppm2      6.723 CV     1
 ASSI {  962}
   (( segid "T22D" and resid 84   and name HB2 ))
   (( segid "T22D" and resid 60   and name HB1 ))
      2.900     1.100     1.100 peak   962 spectrum    1 weight  0.10000E+01 volume  0.25783E-02 ppm1      1.907 ppm2      2.542 CV     1
 ASSI {  963}
   (( segid "T22D" and resid 84   and name HB2 ))
   (( segid "T22D" and resid 84   and name HE2 ))
      2.900     1.000     1.000 peak   963 spectrum    1 weight  0.10000E+01 volume  0.15666E-02 ppm1      1.894 ppm2      2.978 CV     1
 ASSI {  967}
   (( segid "T22D" and resid 84   and name HB1 ))
   (( segid "T22D" and resid 60   and name HB1 ))
      3.200     1.300     1.300 peak   967 spectrum    1 weight  0.10000E+01 volume  0.35592E-02 ppm1      1.725 ppm2      2.540 CV     1
 ASSI {  968}
   (( segid "T22D" and resid 96   and name HB1 ))
   (( segid "T22D" and resid 96   and name HA  ))
      2.400     0.700     0.700 peak   968 spectrum    1 weight  0.10000E+01 volume  0.50663E-02 ppm1      2.506 ppm2      4.704 CV     1
 ASSI {  971}
   (( segid "T22D" and resid 96   and name HB2 ))
   (( segid "T22D" and resid 96   and name HB1 ))
      1.800     0.400     0.400 peak   971 spectrum    1 weight  0.10000E+01 volume  0.11604E-01 ppm1      2.152 ppm2      2.504 CV     1
 ASSI {  972}
   (( segid "T22D" and resid 96   and name HB2 ))
   (( segid "T22D" and resid 96   and name HA  ))
      2.700     0.900     0.900 peak   972 spectrum    1 weight  0.10000E+01 volume  0.47673E-02 ppm1      2.147 ppm2      4.703 CV     1
 ASSI {  974}
   (( segid "T22D" and resid 84   and name HB2 ))
   (( segid "T22D" and resid 60   and name HB2 ))
      3.000     1.100     1.100 peak   974 spectrum    1 weight  0.10000E+01 volume  0.18276E-02 ppm1      1.902 ppm2      2.601 CV     1
 ASSI {  975}
   (( segid "T22D" and resid 96   and name HB2 ))
   (( segid "T22D" and resid 96   and name HD1 ))
      3.900     1.900     1.900 peak   975 spectrum    1 weight  0.10000E+01 volume  0.15270E-02 ppm1      2.143 ppm2      4.008 CV     1
 ASSI {  976}
   (( segid "T22D" and resid 84   and name HB1 ))
   (( segid "T22D" and resid 60   and name HB2 ))
      2.500     0.800     0.800 peak   976 spectrum    1 weight  0.10000E+01 volume  0.27920E-02 ppm1      1.726 ppm2      2.600 CV     1
 ASSI {  980}
   (( segid "T22D" and resid 74   and name HB1 ))
   (( segid "T22D" and resid 74   and name HA  ))
      2.300     0.700     0.700 peak   980 spectrum    1 weight  0.10000E+01 volume  0.52077E-02 ppm1      1.592 ppm2      4.363 CV     1
 ASSI {  984}
   (( segid "T22D" and resid 63   and name HB1 ))
   (( segid "T22D" and resid 63   and name HG2 ))
      2.700     0.900     0.900 peak   984 spectrum    1 weight  0.10000E+01 volume  0.23159E-02 ppm1      1.985 ppm2      2.359 CV     1
 ASSI {  985}
   (( segid "T22D" and resid 74   and name HB2 ))
   (( segid "T22D" and resid 74   and name HB1 ))
      1.600     0.300     0.600 peak   985 spectrum    1 weight  0.10000E+01 volume  0.19272E-01 ppm1      1.781 ppm2      1.593 CV     1
 ASSI {  988}
   (( segid "T22D" and resid 74   and name HB1 ))
   (( segid "T22D" and resid 74   and name HG2 ))
      2.400     0.700     0.700 peak   988 spectrum    1 weight  0.10000E+01 volume  0.67539E-02 ppm1      1.586 ppm2      1.381 CV     1
 OR {  988}
   (( segid "T22D" and resid 74   and name HB1 ))
   (( segid "T22D" and resid 74   and name HG1 ))
 ASSI {  991}
   (( segid "T22D" and resid 63   and name HB2 ))
   (( segid "T22D" and resid 63   and name HB1 ))
      1.900     0.500     0.500 peak   991 spectrum    1 weight  0.10000E+01 volume  0.88106E-02 ppm1      2.113 ppm2      1.983 CV     1
 ASSI {  993}
   (( segid "T22D" and resid 67   and name HB  ))
   (  segid "T22D" and resid 78   and name HE% )
      3.700     1.700     1.700 peak   993 spectrum    1 weight  0.10000E+01 volume  0.70342E-03 ppm1      0.971 ppm2      6.622 CV     1
 ASSI {  994}
   (( segid "T22D" and resid 67   and name HB  ))
   (  segid "T22D" and resid 67   and name HD1%)
      3.300     1.400     1.400 peak   994 spectrum    1 weight  0.10000E+01 volume  0.24888E-02 ppm1      0.972 ppm2      0.764 CV     1
 ASSI {  995}
   (( segid "T22D" and resid 36   and name HB1 ))
   (( segid "T22D" and resid 36   and name HA  ))
      3.300     1.400     1.400 peak   995 spectrum    1 weight  0.10000E+01 volume  0.12263E-02 ppm1      1.774 ppm2      4.957 CV     1
 ASSI {  996}
   (( segid "T22D" and resid 67   and name HB  ))
   (( segid "T22D" and resid 67   and name HA  ))
      3.100     1.200     1.200 peak   996 spectrum    1 weight  0.10000E+01 volume  0.12942E-02 ppm1      0.980 ppm2      4.105 CV     1
 ASSI {  997}
   (( segid "T22D" and resid 67   and name HB  ))
   (( segid "3T5T" and resid 6    and name H5' ))
      4.600     2.600     1.400 peak   997 spectrum    1 weight  0.10000E+01 volume  0.46297E-03 ppm1      0.981 ppm2      4.432 CV     1
 ASSI {  998}
   (( segid "T22D" and resid 67   and name HB  ))
   (  segid "T22D" and resid 80   and name HD% )
      4.900     3.000     1.100 peak   998 spectrum    1 weight  0.10000E+01 volume  0.48478E-03 ppm1      0.978 ppm2      6.601 CV     1
 ASSI { 1000}
   (( segid "T22D" and resid 63   and name HB2 ))
   (( segid "T22D" and resid 63   and name HG2 ))
      2.600     0.800     0.800 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.54712E-02 ppm1      2.116 ppm2      2.355 CV     1
 ASSI { 1001}
   (( segid "T22D" and resid 36   and name HB2 ))
   (( segid "T22D" and resid 36   and name HA  ))
      2.900     1.000     1.000 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.10607E-02 ppm1      2.044 ppm2      4.966 CV     1
 ASSI { 1003}
   (( segid "T22D" and resid 67   and name HB  ))
   (( segid "T22D" and resid 79   and name HA2 ))
      4.200     2.200     1.800 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.28757E-03 ppm1      0.977 ppm2      3.951 CV     1
 ASSI { 1005}
   (( segid "T22D" and resid 67   and name HB  ))
   (( segid "T22D" and resid 79   and name HA1 ))
      5.300     3.500     0.700 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.44028E-03 ppm1      0.978 ppm2      3.792 CV     1
 ASSI { 1006}
   (( segid "T22D" and resid 67   and name HB  ))
   (( segid "T22D" and resid 67   and name HG12))
      2.900     1.000     1.000 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.98561E-03 ppm1      0.973 ppm2      1.152 CV     1
 ASSI { 1007}
   (( segid "T22D" and resid 67   and name HB  ))
   (  segid "T22D" and resid 66   and name HG1%)
      4.300     2.400     1.700 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.59704E-03 ppm1      0.971 ppm2      0.723 CV     1
 ASSI { 1009}
   (( segid "T22D" and resid 36   and name HB1 ))
   (( segid "T22D" and resid 36   and name HB2 ))
      2.100     0.500     0.500 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.32796E-02 ppm1      1.782 ppm2      2.050 CV     1
 ASSI { 1010}
   (( segid "T22D" and resid 36   and name HB2 ))
   (( segid "T22D" and resid 36   and name HD2 ))
      2.600     0.900     0.900 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.24063E-02 ppm1      2.053 ppm2      1.614 CV     1
 ASSI { 1012}
   (( segid "T22D" and resid 36   and name HB1 ))
   (( segid "T22D" and resid 82   and name HA  ))
      4.800     2.900     1.200 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.47368E-03 ppm1      1.782 ppm2      5.252 CV     1
 ASSI { 1013}
   (( segid "T22D" and resid 36   and name HB2 ))
   (( segid "T22D" and resid 82   and name HA  ))
      4.200     2.200     1.800 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.54120E-03 ppm1      2.054 ppm2      5.235 CV     1
 ASSI { 1014}
   (( segid "T22D" and resid 73   and name HG2 ))
   (( segid "T22D" and resid 70   and name HB2 ))
      2.200     2.200     3.800 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.36940E-02 ppm1      2.292 ppm2      1.868 CV     1
 OR { 1014}
   (( segid "T22D" and resid 73   and name HG2 ))
   (( segid "T22D" and resid 70   and name HB1 ))
 OR { 1014}
   (( segid "T22D" and resid 73   and name HG1 ))
   (( segid "T22D" and resid 70   and name HB1 ))
 OR { 1014}
   (( segid "T22D" and resid 73   and name HG1 ))
   (( segid "T22D" and resid 70   and name HB2 ))
 ASSI { 1017}
   (( segid "T22D" and resid 121  and name HG1 ))
   (( segid "T22D" and resid 121  and name HB1 ))
      2.100     0.500     0.500 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.20801E-01 ppm1      2.285 ppm2      2.092 CV     1
 OR { 1017}
   (( segid "T22D" and resid 121  and name HG2 ))
   (( segid "T22D" and resid 121  and name HB1 ))
 ASSI { 1018}
   (( segid "T22D" and resid 73   and name HG1 ))
   (  segid "T22D" and resid 72   and name HG2%)
      3.200     3.200     2.800 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.23148E-02 ppm1      2.292 ppm2      1.167 CV     1
 ASSI { 1019}
   (( segid "T22D" and resid 73   and name HG2 ))
   (  segid "T22D" and resid 68   and name HG2%)
      3.600     1.600     1.600 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.90133E-03 ppm1      2.290 ppm2      0.966 CV     1
 OR { 1019}
   (( segid "T22D" and resid 73   and name HG1 ))
   (  segid "T22D" and resid 68   and name HG2%)
 ASSI { 1020}
   (( segid "T22D" and resid 73   and name HG1 ))
   (( segid "T22D" and resid 72   and name HA  ))
      2.900     1.000     1.000 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.16451E-02 ppm1      2.290 ppm2      4.371 CV     1
 ASSI { 1022}
   (( segid "T22D" and resid 73   and name HG2 ))
   (( segid "T22D" and resid 73   and name HA  ))
      2.100     0.600     0.600 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.13255E-01 ppm1      2.290 ppm2      3.976 CV     1
 OR { 1022}
   (( segid "T22D" and resid 73   and name HG1 ))
   (( segid "T22D" and resid 73   and name HA  ))
 ASSI { 1024}
   (( segid "T22D" and resid 103  and name HB2 ))
   (( segid "T22D" and resid 103  and name HG2 ))
      2.800     1.000     1.000 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.24327E-02 ppm1      1.508 ppm2      1.793 CV     1
 ASSI { 1025}
   (( segid "T22D" and resid 103  and name HB2 ))
   (( segid "T22D" and resid 103  and name HB1 ))
      2.300     0.700     0.700 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.25045E-02 ppm1      1.505 ppm2      1.668 CV     1
 ASSI { 1028}
   (( segid "T22D" and resid 103  and name HB2 ))
   (( segid "T22D" and resid 103  and name HD1 ))
      3.100     1.200     1.200 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.10078E-02 ppm1      1.507 ppm2      2.726 CV     1
 ASSI { 1031}
   (( segid "T22D" and resid 107  and name HB  ))
   (  segid "T22D" and resid 107  and name HG2%)
      2.500     0.800     0.800 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.40443E-02 ppm1      2.011 ppm2      1.011 CV     1
 ASSI { 1032}
   (( segid "T22D" and resid 107  and name HB  ))
   (( segid "T22D" and resid 106  and name HA  ))
      4.900     3.000     1.100 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.53757E-03 ppm1      2.011 ppm2      5.435 CV     1
 ASSI { 1033}
   (( segid "T22D" and resid 107  and name HB  ))
   (( segid "T22D" and resid 93   and name HA  ))
      3.800     1.800     1.800 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.47027E-03 ppm1      1.996 ppm2      4.253 CV     1
 ASSI { 1034}
   (( segid "T22D" and resid 107  and name HB  ))
   (( segid "T22D" and resid 98   and name HD1 ))
      3.400     1.400     1.400 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.85342E-03 ppm1      2.011 ppm2      3.595 CV     1
 ASSI { 1036}
   (( segid "T22D" and resid 107  and name HB  ))
   (( segid "T22D" and resid 96   and name HA  ))
      2.600     0.800     0.800 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.37314E-02 ppm1      2.004 ppm2      4.705 CV     1
 ASSI { 1037}
   (( segid "T22D" and resid 81   and name HB  ))
   (  segid "T22D" and resid 39   and name HG2%)
      3.300     1.400     1.400 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.92043E-03 ppm1      1.088 ppm2      0.600 CV     1
 ASSI { 1038}
   (( segid "T22D" and resid 103  and name HB2 ))
   (( segid "T22D" and resid 103  and name HD2 ))
      3.200     1.300     1.300 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.13070E-02 ppm1      1.496 ppm2      2.892 CV     1
 ASSI { 1040}
   (( segid "T22D" and resid 107  and name HB  ))
   (  segid "T22D" and resid 37   and name HG2%)
      4.000     2.000     2.000 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.17025E-02 ppm1      2.014 ppm2      0.679 CV     1
 OR { 1040}
   (( segid "T22D" and resid 107  and name HB  ))
   (  segid "T22D" and resid 37   and name HD1%)
 ASSI { 1041}
   (( segid "T22D" and resid 107  and name HB  ))
   (  segid "T22D" and resid 107  and name HG1%)
      2.300     0.600     0.600 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.63536E-02 ppm1      2.010 ppm2      1.046 CV     1
 ASSI { 1043}
   (( segid "T22D" and resid 103  and name HB1 ))
   (( segid "T22D" and resid 103  and name HD2 ))
      3.700     1.700     1.700 peak  1043 spectrum    1 weight  0.10000E+01 volume  0.10483E-02 ppm1      1.664 ppm2      2.886 CV     1
 ASSI { 1044}
   (( segid "T22D" and resid 81   and name HB  ))
   (( segid "T22D" and resid 80   and name HA  ))
      4.300     2.300     1.700 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.68023E-03 ppm1      1.099 ppm2      5.586 CV     1
 ASSI { 1045}
   (( segid "T22D" and resid 81   and name HB  ))
   (( segid "T22D" and resid 37   and name HB  ))
      2.600     0.900     0.900 peak  1045 spectrum    1 weight  0.10000E+01 volume  0.23494E-02 ppm1      1.089 ppm2      1.891 CV     1
 ASSI { 1048}
   (( segid "T22D" and resid 107  and name HB  ))
   (( segid "T22D" and resid 98   and name HD2 ))
      4.300     2.300     1.700 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.64725E-03 ppm1      1.993 ppm2      3.168 CV     1
 ASSI { 1050}
   (( segid "T22D" and resid 107  and name HB  ))
   (( segid "T22D" and resid 107  and name HA  ))
      3.000     1.100     1.100 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.17913E-02 ppm1      2.016 ppm2      5.168 CV     1
 ASSI { 1051}
   (( segid "T22D" and resid 62   and name HG1 ))
   (( segid "T22D" and resid 62   and name HA  ))
      2.400     0.700     0.700 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.73469E-02 ppm1      2.102 ppm2      4.401 CV     1
 OR { 1051}
   (( segid "T22D" and resid 62   and name HG2 ))
   (( segid "T22D" and resid 62   and name HA  ))
 ASSI { 1052}
   (( segid "T22D" and resid 62   and name HG2 ))
   (( segid "T22D" and resid 84   and name HA  ))
      2.700     0.900     0.900 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.62135E-02 ppm1      2.103 ppm2      4.097 CV     1
 OR { 1052}
   (( segid "T22D" and resid 62   and name HG1 ))
   (( segid "T22D" and resid 84   and name HA  ))
 ASSI { 1053}
   (( segid "T22D" and resid 62   and name HG1 ))
   (  segid "T22D" and resid 61   and name HG2%)
      4.600     2.700     1.400 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.65187E-03 ppm1      2.104 ppm2      0.596 CV     1
 OR { 1053}
   (( segid "T22D" and resid 62   and name HG2 ))
   (  segid "T22D" and resid 61   and name HG2%)
 ASSI { 1055}
   (( segid "T22D" and resid 103  and name HB1 ))
   (( segid "T22D" and resid 43   and name HD2 ))
      4.200     2.200     1.800 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.63707E-03 ppm1      1.666 ppm2      3.891 CV     1
 ASSI { 1056}
   (( segid "T22D" and resid 62   and name HG2 ))
   (( segid "T22D" and resid 84   and name HG1 ))
      3.400     1.400     1.400 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.14699E-02 ppm1      2.108 ppm2      1.361 CV     1
 OR { 1056}
   (( segid "T22D" and resid 62   and name HG1 ))
   (( segid "T22D" and resid 84   and name HG1 ))
 OR { 1056}
   (( segid "T22D" and resid 62   and name HG2 ))
   (( segid "T22D" and resid 84   and name HG2 ))
 OR { 1056}
   (( segid "T22D" and resid 62   and name HG1 ))
   (( segid "T22D" and resid 84   and name HG2 ))
 ASSI { 1057}
   (( segid "T22D" and resid 62   and name HG2 ))
   (( segid "T22D" and resid 62   and name HB2 ))
      2.100     0.600     0.600 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.11484E-01 ppm1      2.099 ppm2      1.815 CV     1
 OR { 1057}
   (( segid "T22D" and resid 62   and name HG1 ))
   (( segid "T22D" and resid 62   and name HB2 ))
 ASSI { 1058}
   (( segid "T22D" and resid 62   and name HG2 ))
   (( segid "T22D" and resid 84   and name HE2 ))
      3.500     1.600     1.600 peak  1058 spectrum    1 weight  0.10000E+01 volume  0.71922E-03 ppm1      2.104 ppm2      2.968 CV     1
 OR { 1058}
   (( segid "T22D" and resid 62   and name HG1 ))
   (( segid "T22D" and resid 84   and name HE2 ))
 ASSI { 1059}
   (( segid "T22D" and resid 62   and name HG1 ))
   (( segid "T22D" and resid 62   and name HB1 ))
      2.200     0.600     0.600 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.12929E-01 ppm1      2.101 ppm2      1.703 CV     1
 OR { 1059}
   (( segid "T22D" and resid 62   and name HG2 ))
   (( segid "T22D" and resid 62   and name HB1 ))
 ASSI { 1060}
   (( segid "T22D" and resid 62   and name HG1 ))
   (( segid "T22D" and resid 82   and name HB  ))
      3.900     1.900     1.900 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.17777E-02 ppm1      2.102 ppm2      3.911 CV     1
 OR { 1060}
   (( segid "T22D" and resid 62   and name HG2 ))
   (( segid "T22D" and resid 82   and name HB  ))
 ASSI { 1061}
   (( segid "T22D" and resid 107  and name HB  ))
   (( segid "T22D" and resid 96   and name HB1 ))
      3.600     1.600     1.600 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.58499E-03 ppm1      2.013 ppm2      2.506 CV     1
 ASSI { 1063}
   (( segid "T22D" and resid 99   and name HB  ))
   (( segid "T22D" and resid 99   and name HA  ))
      2.900     1.100     1.100 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.21722E-02 ppm1      1.802 ppm2      4.153 CV     1
 ASSI { 1064}
   (( segid "T22D" and resid 99   and name HB  ))
   (( segid "T22D" and resid 99   and name HG11))
      2.500     0.800     0.800 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.48440E-02 ppm1      1.803 ppm2      1.459 CV     1
 ASSI { 1066}
   (( segid "T22D" and resid 99   and name HB  ))
   (( segid "T22D" and resid 100  and name HA  ))
      3.700     1.700     1.700 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.67281E-03 ppm1      1.799 ppm2      3.742 CV     1
 ASSI { 1074}
   (( segid "T22D" and resid 56   and name HG1 ))
   (( segid "T22D" and resid 56   and name HB1 ))
      3.000     1.100     1.100 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.27021E-02 ppm1      2.421 ppm2      2.063 CV     1
 ASSI { 1075}
   (( segid "T22D" and resid 56   and name HG2 ))
   (( segid "T22D" and resid 53   and name HA  ))
      2.800     1.000     1.000 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.16265E-02 ppm1      2.629 ppm2      4.073 CV     1
 ASSI { 1076}
   (( segid "T22D" and resid 56   and name HG1 ))
   (( segid "T22D" and resid 53   and name HA  ))
      3.700     1.700     1.700 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.15708E-02 ppm1      2.428 ppm2      4.069 CV     1
 ASSI { 1079}
   (( segid "T22D" and resid 56   and name HG2 ))
   (( segid "T22D" and resid 56   and name HG1 ))
      1.800     0.400     0.400 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.11723E-01 ppm1      2.627 ppm2      2.426 CV     1
 ASSI { 1081}
   (( segid "T22D" and resid 56   and name HG1 ))
   (( segid "T22D" and resid 56   and name HA  ))
      3.400     1.400     1.400 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.15976E-02 ppm1      2.430 ppm2      4.403 CV     1
 ASSI { 1082}
   (( segid "T22D" and resid 56   and name HG2 ))
   (( segid "T22D" and resid 56   and name HA  ))
      3.500     1.500     1.500 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.17033E-02 ppm1      2.638 ppm2      4.405 CV     1
 ASSI { 1083}
   (( segid "T22D" and resid 65   and name HB  ))
   (  segid "T22D" and resid 66   and name HG1%)
      4.500     2.500     1.500 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.68974E-03 ppm1      1.923 ppm2      0.714 CV     1
 ASSI { 1084}
   (( segid "T22D" and resid 65   and name HB  ))
   (  segid "T22D" and resid 51   and name HD1%)
      4.300     2.300     1.700 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.53223E-03 ppm1      1.934 ppm2      0.532 CV     1
 ASSI { 1085}
   (( segid "T22D" and resid 65   and name HB  ))
   (  segid "T22D" and resid 65   and name HG1%)
      2.000     0.500     0.500 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.21037E-01 ppm1      1.929 ppm2      0.938 CV     1
 ASSI { 1086}
   (( segid "T22D" and resid 65   and name HB  ))
   (( segid "T22D" and resid 65   and name HA  ))
      2.400     0.700     0.700 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.58824E-02 ppm1      1.935 ppm2      4.747 CV     1
 ASSI { 1087}
   (( segid "T22D" and resid 65   and name HB  ))
   (  segid "T22D" and resid 67   and name HD1%)
      3.500     1.600     1.600 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.10113E-02 ppm1      1.924 ppm2      0.764 CV     1
 ASSI { 1090}
   (( segid "T22D" and resid 90   and name HG1 ))
   (( segid "T22D" and resid 91   and name HA  ))
      3.600     3.600     2.400 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.15228E-02 ppm1      2.286 ppm2      3.976 CV     1
 ASSI { 1093}
   (( segid "T22D" and resid 44   and name HB2 ))
   (( segid "T22D" and resid 75   and name HB1 ))
      4.900     3.000     1.100 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.52969E-03 ppm1      2.849 ppm2      4.017 CV     1
 ASSI { 1094}
   (( segid "T22D" and resid 90   and name HG1 ))
   (( segid "T22D" and resid 90   and name HB1 ))
      2.400     0.700     0.700 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.11794E-01 ppm1      2.254 ppm2      2.095 CV     1
 ASSI { 1095}
   (( segid "T22D" and resid 90   and name HG2 ))
   (( segid "T22D" and resid 90   and name HA  ))
      2.600     0.800     0.800 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.40941E-02 ppm1      2.566 ppm2      4.054 CV     1
 ASSI { 1096}
   (( segid "T22D" and resid 90   and name HG2 ))
   (( segid "T22D" and resid 87   and name HA  ))
      3.800     1.900     1.900 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.16775E-02 ppm1      2.563 ppm2      4.239 CV     1
 ASSI { 1097}
   (( segid "T22D" and resid 90   and name HG1 ))
   (( segid "T22D" and resid 87   and name HA  ))
      3.800     1.800     1.800 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.18101E-02 ppm1      2.240 ppm2      4.239 CV     1
 ASSI { 1098}
   (( segid "T22D" and resid 90   and name HG2 ))
   (( segid "T22D" and resid 90   and name HB1 ))
      2.500     0.800     0.800 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.50984E-02 ppm1      2.554 ppm2      2.094 CV     1
 ASSI { 1102}
   (( segid "T22D" and resid 90   and name HG2 ))
   (( segid "T22D" and resid 90   and name HG1 ))
      1.700     0.300     0.500 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.24244E-01 ppm1      2.557 ppm2      2.240 CV     1
 ASSI { 1103}
   (( segid "T22D" and resid 65   and name HB  ))
   (( segid "T22D" and resid 64   and name HA  ))
      4.700     2.800     1.300 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.58211E-03 ppm1      1.960 ppm2      5.250 CV     1
 ASSI { 1105}
   (( segid "T22D" and resid 90   and name HG1 ))
   (( segid "T22D" and resid 90   and name HA  ))
      2.500     0.800     0.800 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.60859E-02 ppm1      2.254 ppm2      4.051 CV     1
 ASSI { 1106}
   (( segid "T22D" and resid 44   and name HB1 ))
   (( segid "T22D" and resid 44   and name HB2 ))
      2.200     0.600     0.600 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.41633E-02 ppm1      3.257 ppm2      2.825 CV     1
 ASSI { 1107}
   (( segid "T22D" and resid 111  and name HB2 ))
   (( segid "T22D" and resid 111  and name HA  ))
      2.300     0.600     0.600 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.66851E-02 ppm1      3.223 ppm2      4.436 CV     1
 ASSI { 1108}
   (( segid "T22D" and resid 111  and name HB1 ))
   (  segid "T22D" and resid 111  and name HD% )
      2.600     0.900     0.900 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.41357E-02 ppm1      2.938 ppm2      7.097 CV     1
 ASSI { 1109}
   (( segid "T22D" and resid 111  and name HB1 ))
   (( segid "T22D" and resid 33   and name HG1 ))
      3.700     1.700     1.700 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.87156E-03 ppm1      2.939 ppm2      1.274 CV     1
 OR { 1109}
   (( segid "T22D" and resid 111  and name HB1 ))
   (( segid "T22D" and resid 33   and name HG2 ))
 OR { 1109}
   (( segid "T22D" and resid 111  and name HB1 ))
   (( segid "T22D" and resid 33   and name HB1 ))
 OR { 1109}
   (( segid "T22D" and resid 111  and name HB1 ))
   (( segid "T22D" and resid 33   and name HB2 ))
 OR { 1109}
   (( segid "T22D" and resid 111  and name HB1 ))
   (  segid "T22D" and resid 33   and name HE% )
 ASSI { 1111}
   (( segid "T22D" and resid 111  and name HB2 ))
   (  segid "T22D" and resid 111  and name HD% )
      2.400     0.700     0.700 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.40911E-02 ppm1      3.225 ppm2      7.096 CV     1
 ASSI { 1112}
   (( segid "T22D" and resid 44   and name HB1 ))
   (( segid "T22D" and resid 44   and name HA  ))
      2.800     1.000     1.000 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.18703E-02 ppm1      3.262 ppm2      4.236 CV     1
 ASSI { 1114}
   (( segid "T22D" and resid 53   and name HG2 ))
   (( segid "T22D" and resid 53   and name HB1 ))
      2.900     1.100     1.100 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.41464E-02 ppm1      2.650 ppm2      2.061 CV     1
 ASSI { 1117}
   (( segid "T22D" and resid 53   and name HG2 ))
   (( segid "T22D" and resid 50   and name HA  ))
      3.100     1.200     1.200 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.16544E-02 ppm1      2.658 ppm2      4.174 CV     1
 ASSI { 1118}
   (( segid "T22D" and resid 53   and name HG2 ))
   (( segid "T22D" and resid 53   and name HA  ))
      2.700     0.900     0.900 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.40344E-02 ppm1      2.658 ppm2      4.073 CV     1
 ASSI { 1119}
   (( segid "T22D" and resid 63   and name HG1 ))
   (( segid "T22D" and resid 63   and name HB2 ))
      2.800     1.000     1.000 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.36298E-02 ppm1      1.987 ppm2      2.114 CV     1
 ASSI { 1121}
   (( segid "T22D" and resid 63   and name HG1 ))
   (  segid "T22D" and resid 65   and name HG1%)
      2.900     1.100     1.100 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.21316E-02 ppm1      2.045 ppm2      0.938 CV     1
 OR { 1121}
   (( segid "T22D" and resid 63   and name HG1 ))
   (  segid "T22D" and resid 65   and name HG2%)
 ASSI { 1124}
   (( segid "T22D" and resid 111  and name HB2 ))
   (( segid "T22D" and resid 111  and name HB1 ))
      1.900     0.500     0.500 peak  1124 spectrum    1 weight  0.10000E+01 volume  0.76768E-02 ppm1      3.225 ppm2      2.932 CV     1
 ASSI { 1127}
   (( segid "T22D" and resid 53   and name HG1 ))
   (( segid "T22D" and resid 53   and name HA  ))
      2.900     1.000     1.000 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.59800E-02 ppm1      2.308 ppm2      4.067 CV     1
 ASSI { 1129}
   (( segid "T22D" and resid 53   and name HG1 ))
   (( segid "T22D" and resid 53   and name HG2 ))
      1.800     0.400     0.400 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.15919E-01 ppm1      2.329 ppm2      2.651 CV     1
 ASSI { 1130}
   (( segid "T22D" and resid 44   and name HB1 ))
   (  segid "T22D" and resid 44   and name HE% )
      4.500     2.500     1.500 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.63069E-03 ppm1      3.264 ppm2      6.017 CV     1
 ASSI { 1134}
   (( segid "T22D" and resid 53   and name HG1 ))
   (( segid "T22D" and resid 50   and name HA  ))
      3.300     1.400     1.400 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.16856E-02 ppm1      2.315 ppm2      4.176 CV     1
 ASSI { 1136}
   (( segid "T22D" and resid 63   and name HG2 ))
   (( segid "T22D" and resid 63   and name HG1 ))
      1.900     0.500     0.500 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.94270E-02 ppm1      2.356 ppm2      1.994 CV     1
 ASSI { 1138}
   (( segid "T22D" and resid 63   and name HG1 ))
   (( segid "T22D" and resid 63   and name HA  ))
      2.800     0.900     0.900 peak  1138 spectrum    1 weight  0.10000E+01 volume  0.29938E-02 ppm1      2.003 ppm2      4.533 CV     1
 ASSI { 1139}
   (( segid "T22D" and resid 63   and name HG1 ))
   (( segid "T22D" and resid 82   and name HB  ))
      4.500     2.500     1.500 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.63924E-03 ppm1      2.019 ppm2      3.905 CV     1
 ASSI { 1141}
   (( segid "T22D" and resid 54   and name HB2 ))
   (  segid "T22D" and resid 54   and name HD% )
      3.300     1.400     1.400 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.80913E-03 ppm1      3.244 ppm2      6.343 CV     1
 ASSI { 1142}
   (( segid "T22D" and resid 54   and name HB1 ))
   (  segid "T22D" and resid 54   and name HD% )
      3.400     1.500     1.500 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.65546E-03 ppm1      2.914 ppm2      6.339 CV     1
 ASSI { 1143}
   (( segid "T22D" and resid 54   and name HB1 ))
   (  segid "T22D" and resid 54   and name HE% )
      4.500     2.500     1.500 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.63711E-03 ppm1      2.900 ppm2      6.451 CV     1
 ASSI { 1146}
   (( segid "T22D" and resid 54   and name HB1 ))
   (( segid "T22D" and resid 54   and name HA  ))
      3.200     1.300     1.300 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.18711E-02 ppm1      2.904 ppm2      4.101 CV     1
 ASSI { 1147}
   (( segid "T22D" and resid 54   and name HB2 ))
   (  segid "T22D" and resid 54   and name HE% )
      4.400     2.400     1.600 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.74687E-03 ppm1      3.220 ppm2      6.458 CV     1
 ASSI { 1148}
   (( segid "T22D" and resid 54   and name HB2 ))
   (( segid "T22D" and resid 54   and name HA  ))
      2.700     0.900     0.900 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.28888E-02 ppm1      3.225 ppm2      4.101 CV     1
 ASSI { 1154}
   (( segid "T22D" and resid 71   and name HB2 ))
   (( segid "T22D" and resid 71   and name HB1 ))
      1.600     0.300     0.600 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.27562E-01 ppm1      2.858 ppm2      3.006 CV     1
 ASSI { 1161}
   (( segid "T22D" and resid 34   and name HB2 ))
   (( segid "T22D" and resid 33   and name HB2 ))
      3.700     1.700     1.700 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.12474E-02 ppm1      3.527 ppm2      1.813 CV     1
 ASSI { 1162}
   (( segid "T22D" and resid 71   and name HB2 ))
   (( segid "T22D" and resid 71   and name HA  ))
      2.600     0.800     0.800 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.91655E-02 ppm1      2.858 ppm2      4.726 CV     1
 ASSI { 1164}
   (( segid "T22D" and resid 71   and name HB1 ))
   (( segid "T22D" and resid 71   and name HA  ))
      2.400     0.700     0.700 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.68002E-02 ppm1      3.008 ppm2      4.723 CV     1
 ASSI { 1166}
   (( segid "T22D" and resid 34   and name HB2 ))
   (  segid "T22D" and resid 34   and name HD% )
      2.900     1.100     1.100 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.17859E-02 ppm1      3.529 ppm2      7.224 CV     1
 ASSI { 1167}
   (( segid "T22D" and resid 34   and name HB2 ))
   (( segid "T22D" and resid 34   and name HB1 ))
      1.900     0.500     0.500 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.66318E-02 ppm1      3.526 ppm2      2.740 CV     1
 ASSI { 1170}
   (( segid "T22D" and resid 34   and name HB1 ))
   (( segid "T22D" and resid 33   and name HB2 ))
      4.600     2.700     1.400 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.10223E-02 ppm1      2.747 ppm2      1.821 CV     1
 ASSI { 1171}
   (( segid "T22D" and resid 34   and name HB1 ))
   (  segid "T22D" and resid 34   and name HD% )
      2.700     0.900     0.900 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.20808E-02 ppm1      2.747 ppm2      7.226 CV     1
 ASSI { 1174}
   (( segid "T22D" and resid 100  and name HB  ))
   (( segid "T22D" and resid 99   and name HA  ))
      4.300     2.300     1.700 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.88915E-03 ppm1      1.318 ppm2      4.150 CV     1
 ASSI { 1178}
   (( segid "T22D" and resid 100  and name HB  ))
   (( segid "T22D" and resid 100  and name HA  ))
      3.000     1.100     1.100 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.19623E-02 ppm1      1.314 ppm2      3.768 CV     1
 ASSI { 1179}
   (( segid "T22D" and resid 100  and name HB  ))
   (  segid "T22D" and resid 42   and name HD2%)
      3.100     1.200     1.200 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.11937E-02 ppm1      1.301 ppm2      0.659 CV     1
 ASSI { 1182}
   (( segid "T22D" and resid 48   and name HB1 ))
   (( segid "T22D" and resid 48   and name HB2 ))
      1.900     0.400     0.400 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.11149E-01 ppm1      2.989 ppm2      2.747 CV     1
 ASSI { 1184}
   (( segid "T22D" and resid 58   and name HB1 ))
   (( segid "T22D" and resid 91   and name HG2 ))
      4.600     2.600     1.400 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.50304E-03 ppm1      2.880 ppm2      2.087 CV     1
 ASSI { 1185}
   (( segid "T22D" and resid 101  and name HB2 ))
   (( segid "T22D" and resid 101  and name HB1 ))
      2.000     0.500     0.500 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.94357E-02 ppm1      3.007 ppm2      2.235 CV     1
 ASSI { 1188}
   (( segid "T22D" and resid 101  and name HB1 ))
   (( segid "T22D" and resid 43   and name HG2 ))
      3.500     1.500     1.500 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.65112E-03 ppm1      2.227 ppm2      1.800 CV     1
 ASSI { 1189}
   (( segid "T22D" and resid 101  and name HB2 ))
   (( segid "T22D" and resid 43   and name HG2 ))
      3.700     1.700     1.700 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.61388E-03 ppm1      3.012 ppm2      1.806 CV     1
 ASSI { 1190}
   (( segid "T22D" and resid 101  and name HB2 ))
   (( segid "T22D" and resid 43   and name HB1 ))
      4.400     2.500     1.600 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.64975E-03 ppm1      3.009 ppm2      2.051 CV     1
 ASSI { 1191}
   (( segid "T22D" and resid 101  and name HB1 ))
   (( segid "T22D" and resid 43   and name HD1 ))
      4.100     2.100     1.900 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.69912E-03 ppm1      2.242 ppm2      3.788 CV     1
 ASSI { 1192}
   (( segid "T22D" and resid 101  and name HB2 ))
   (( segid "T22D" and resid 100  and name HA  ))
      4.300     2.400     1.700 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.52715E-03 ppm1      3.007 ppm2      3.759 CV     1
 ASSI { 1193}
   (( segid "T22D" and resid 101  and name HB2 ))
   (( segid "T22D" and resid 43   and name HD1 ))
      4.500     2.500     1.500 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.47268E-03 ppm1      3.009 ppm2      3.804 CV     1
 ASSI { 1194}
   (( segid "T22D" and resid 101  and name HB2 ))
   (( segid "T22D" and resid 45   and name HD2 ))
      3.000     3.000     3.000 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.53874E-03 ppm1      2.991 ppm2      7.115 CV     1
 ASSI { 1195}
   (( segid "T22D" and resid 101  and name HB2 ))
   (( segid "T22D" and resid 101  and name HA  ))
      2.600     0.800     0.800 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.48945E-02 ppm1      3.007 ppm2      4.217 CV     1
 ASSI { 1197}
   (( segid "T22D" and resid 58   and name HB2 ))
   (( segid "T22D" and resid 91   and name HG2 ))
      5.000     3.200     1.000 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.54854E-03 ppm1      3.670 ppm2      2.074 CV     1
 ASSI { 1199}
   (( segid "T22D" and resid 58   and name HB2 ))
   (  segid "T22D" and resid 58   and name HD% )
      3.000     1.200     1.200 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.12690E-02 ppm1      3.667 ppm2      7.371 CV     1
 ASSI { 1200}
   (( segid "T22D" and resid 58   and name HB1 ))
   (( segid "T22D" and resid 58   and name HB2 ))
      2.300     0.700     0.700 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.25017E-02 ppm1      2.891 ppm2      3.669 CV     1
 ASSI { 1201}
   (( segid "T22D" and resid 55   and name HB1 ))
   (  segid "T22D" and resid 92   and name HB% )
      3.400     3.400     2.600 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.96684E-03 ppm1      2.884 ppm2      1.423 CV     1
 ASSI { 1203}
   (( segid "T22D" and resid 58   and name HB1 ))
   (  segid "T22D" and resid 58   and name HD% )
      3.100     1.200     1.200 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.14473E-02 ppm1      2.886 ppm2      7.363 CV     1
 ASSI { 1205}
   (( segid "T22D" and resid 55   and name HB1 ))
   (  segid "T22D" and resid 81   and name HG2%)
      3.500     1.500     1.500 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.12145E-02 ppm1      2.873 ppm2      0.281 CV     1
 ASSI { 1209}
   (( segid "T22D" and resid 55   and name HB1 ))
   (( segid "T22D" and resid 55   and name HB2 ))
      2.100     0.500     0.500 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.30768E-02 ppm1      2.869 ppm2      3.255 CV     1
 ASSI { 1210}
   (( segid "T22D" and resid 58   and name HB2 ))
   (( segid "T22D" and resid 91   and name HB1 ))
      5.000     3.100     1.000 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.63182E-03 ppm1      3.677 ppm2      2.363 CV     1
 ASSI { 1211}
   (( segid "T22D" and resid 55   and name HB1 ))
   (  segid "T22D" and resid 55   and name HD% )
      2.600     0.800     0.800 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.22562E-02 ppm1      2.867 ppm2      7.794 CV     1
 ASSI { 1215}
   (( segid "T22D" and resid 55   and name HB2 ))
   (  segid "T22D" and resid 55   and name HD% )
      2.800     1.000     1.000 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.20967E-02 ppm1      3.259 ppm2      7.795 CV     1
 ASSI { 1216}
   (( segid "T22D" and resid 55   and name HB2 ))
   (  segid "T22D" and resid 61   and name HD1%)
      2.900     1.100     1.100 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.85796E-03 ppm1      3.258 ppm2      0.332 CV     1
 ASSI { 1217}
   (( segid "T22D" and resid 55   and name HB1 ))
   (  segid "T22D" and resid 61   and name HD1%)
      3.100     1.200     1.200 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.11116E-02 ppm1      2.868 ppm2      0.331 CV     1
 ASSI { 1220}
   (( segid "T22D" and resid 55   and name HB2 ))
   (  segid "T22D" and resid 81   and name HG2%)
      3.000     1.100     1.100 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.10800E-02 ppm1      3.260 ppm2      0.286 CV     1
 ASSI { 1225}
   (( segid "T22D" and resid 95   and name HB2 ))
   (( segid "T22D" and resid 95   and name HB1 ))
      2.000     0.500     0.500 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.10301E-01 ppm1      2.816 ppm2      2.484 CV     1
 ASSI { 1227}
   (( segid "T22D" and resid 106  and name HB1 ))
   (( segid "T22D" and resid 106  and name HA  ))
      2.700     0.900     0.900 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.36135E-02 ppm1      2.823 ppm2      5.431 CV     1
 OR { 1227}
   (( segid "T22D" and resid 106  and name HB2 ))
   (( segid "T22D" and resid 106  and name HA  ))
 ASSI { 1228}
   (( segid "T22D" and resid 95   and name HB1 ))
   (( segid "T22D" and resid 96   and name HD1 ))
      4.500     2.500     1.500 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.76051E-03 ppm1      2.491 ppm2      4.007 CV     1
 ASSI { 1229}
   (( segid "T22D" and resid 95   and name HB1 ))
   (( segid "T22D" and resid 96   and name HD2 ))
      4.400     2.500     1.600 peak  1229 spectrum    1 weight  0.10000E+01 volume  0.99729E-03 ppm1      2.493 ppm2      4.109 CV     1
 ASSI { 1231}
   (( segid "T22D" and resid 106  and name HB1 ))
   (( segid "T22D" and resid 97   and name HA  ))
      4.100     2.100     1.900 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.74662E-03 ppm1      2.831 ppm2      6.047 CV     1
 OR { 1231}
   (( segid "T22D" and resid 106  and name HB2 ))
   (( segid "T22D" and resid 97   and name HA  ))
 ASSI { 1235}
   (( segid "T22D" and resid 78   and name HB1 ))
   (( segid "T22D" and resid 78   and name HB2 ))
      2.400     0.700     0.700 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.18900E-02 ppm1      2.382 ppm2      2.488 CV     1
 ASSI { 1237}
   (( segid "T22D" and resid 78   and name HB1 ))
   (( segid "3T5T" and resid 4    and name H8  ))
      4.000     2.000     2.000 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.43670E-03 ppm1      2.439 ppm2      7.844 CV     1
 ASSI { 1240}
   (( segid "T22D" and resid 37   and name HB  ))
   (  segid "T22D" and resid 107  and name HG1%)
      3.400     1.400     1.400 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.25741E-02 ppm1      1.891 ppm2      1.086 CV     1
 ASSI { 1241}
   (( segid "T22D" and resid 37   and name HB  ))
   (( segid "T22D" and resid 82   and name HA  ))
      3.900     1.900     1.900 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.65346E-03 ppm1      1.880 ppm2      5.243 CV     1
 ASSI { 1242}
   (( segid "T22D" and resid 37   and name HB  ))
   (( segid "T22D" and resid 37   and name HG12))
      3.100     1.200     1.200 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.18765E-02 ppm1      1.886 ppm2      0.530 CV     1
 ASSI { 1243}
   (( segid "T22D" and resid 78   and name HB1 ))
   (  segid "T22D" and resid 78   and name HD% )
      3.300     1.400     1.400 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.72735E-03 ppm1      2.481 ppm2      6.388 CV     1
 OR { 1243}
   (( segid "T22D" and resid 78   and name HB2 ))
   (  segid "T22D" and resid 78   and name HD% )
 ASSI { 1246}
   (( segid "T22D" and resid 31   and name HB2 ))
   (( segid "T22D" and resid 31   and name HA  ))
      2.400     0.700     0.700 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.72214E-02 ppm1      2.818 ppm2      4.653 CV     1
 ASSI { 1247}
   (( segid "T22D" and resid 31   and name HB2 ))
   (( segid "T22D" and resid 31   and name HB1 ))
      1.700     0.300     0.500 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.28946E-01 ppm1      2.819 ppm2      2.656 CV     1
 ASSI { 1248}
   (( segid "T22D" and resid 38   and name HB1 ))
   (  segid "T22D" and resid 38   and name HD% )
      3.000     1.100     1.100 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.12182E-02 ppm1      2.620 ppm2      6.682 CV     1
 ASSI { 1249}
   (( segid "T22D" and resid 37   and name HB  ))
   (  segid "T22D" and resid 81   and name HG2%)
      4.200     2.200     1.800 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.98327E-03 ppm1      1.893 ppm2      0.269 CV     1
 ASSI { 1250}
   (( segid "T22D" and resid 37   and name HB  ))
   (( segid "T22D" and resid 37   and name HG11))
      2.600     0.900     0.900 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.22886E-02 ppm1      1.882 ppm2      1.715 CV     1
 ASSI { 1251}
   (( segid "T22D" and resid 37   and name HB  ))
   (( segid "T22D" and resid 36   and name HA  ))
      4.100     2.100     1.900 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.13907E-02 ppm1      1.877 ppm2      4.957 CV     1
 ASSI { 1252}
   (( segid "T22D" and resid 38   and name HB2 ))
   (( segid "T22D" and resid 38   and name HA  ))
      2.800     1.000     1.000 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.14115E-02 ppm1      2.801 ppm2      4.592 CV     1
 ASSI { 1253}
   (( segid "T22D" and resid 38   and name HB1 ))
   (( segid "3T5T" and resid 5    and name H1' ))
      5.400     3.700     0.600 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.26874E-03 ppm1      2.628 ppm2      6.581 CV     1
 ASSI { 1254}
   (( segid "T22D" and resid 38   and name HB1 ))
   (( segid "T22D" and resid 38   and name HA  ))
      3.500     1.500     1.500 peak  1254 spectrum    1 weight  0.10000E+01 volume  0.10915E-02 ppm1      2.648 ppm2      4.589 CV     1
 ASSI { 1256}
   (( segid "T22D" and resid 61   and name HB  ))
   (( segid "T22D" and resid 61   and name HG12))
      2.900     1.100     1.100 peak  1256 spectrum    1 weight  0.10000E+01 volume  0.26890E-02 ppm1      1.475 ppm2      0.936 CV     1
 ASSI { 1261}
   (( segid "T22D" and resid 38   and name HB2 ))
   (  segid "T22D" and resid 38   and name HD% )
      3.100     1.200     1.200 peak  1261 spectrum    1 weight  0.10000E+01 volume  0.15943E-02 ppm1      2.797 ppm2      6.678 CV     1
 ASSI { 1262}
   (( segid "T22D" and resid 38   and name HB2 ))
   (( segid "T22D" and resid 110  and name HA  ))
      2.700     0.900     0.900 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.25814E-02 ppm1      2.805 ppm2      4.129 CV     1
 ASSI { 1264}
   (( segid "T22D" and resid 104  and name HE1 ))
   (( segid "T22D" and resid 104  and name HD2 ))
      2.200     0.600     0.600 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.12341E-01 ppm1      2.871 ppm2      1.617 CV     1
 OR { 1264}
   (( segid "T22D" and resid 104  and name HE2 ))
   (( segid "T22D" and resid 104  and name HD1 ))
 OR { 1264}
   (( segid "T22D" and resid 104  and name HE1 ))
   (( segid "T22D" and resid 104  and name HD1 ))
 OR { 1264}
   (( segid "T22D" and resid 104  and name HE2 ))
   (( segid "T22D" and resid 104  and name HD2 ))
 ASSI { 1265}
   (( segid "T22D" and resid 61   and name HB  ))
   (( segid "T22D" and resid 61   and name HA  ))
      2.900     1.000     1.000 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.20155E-02 ppm1      1.476 ppm2      4.110 CV     1
 ASSI { 1266}
   (( segid "T22D" and resid 104  and name HE1 ))
   (  segid "T22D" and resid 99   and name HD1%)
      2.800     1.000     1.000 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.31469E-02 ppm1      2.876 ppm2      0.705 CV     1
 OR { 1266}
   (( segid "T22D" and resid 104  and name HE2 ))
   (  segid "T22D" and resid 99   and name HD1%)
 ASSI { 1267}
   (( segid "T22D" and resid 61   and name HB  ))
   (( segid "T22D" and resid 83   and name HA  ))
      4.200     2.200     1.800 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.11866E-02 ppm1      1.473 ppm2      5.081 CV     1
 ASSI { 1269}
   (( segid "T22D" and resid 61   and name HB  ))
   (  segid "T22D" and resid 81   and name HG2%)
      3.700     3.700     2.300 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.25605E-02 ppm1      1.470 ppm2      0.288 CV     1
 ASSI { 1270}
   (( segid "T22D" and resid 104  and name HE1 ))
   (( segid "T22D" and resid 99   and name HG12))
      2.800     2.800     3.200 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.88369E-03 ppm1      2.858 ppm2      1.167 CV     1
 OR { 1270}
   (( segid "T22D" and resid 104  and name HE2 ))
   (( segid "T22D" and resid 99   and name HG12))
 ASSI { 1272}
   (( segid "T22D" and resid 36   and name HE2 ))
   (( segid "T22D" and resid 36   and name HB1 ))
      4.200     2.300     1.800 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.69979E-03 ppm1      2.258 ppm2      1.782 CV     1
 ASSI { 1273}
   (( segid "T22D" and resid 38   and name HB2 ))
   (( segid "3T5T" and resid 5    and name H1' ))
      3.800     1.800     1.800 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.65496E-03 ppm1      2.782 ppm2      6.594 CV     1
 ASSI { 1274}
   (( segid "T22D" and resid 36   and name HE2 ))
   (( segid "T22D" and resid 36   and name HG2 ))
      2.900     1.100     1.100 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.10902E-02 ppm1      2.240 ppm2      1.376 CV     1
 ASSI { 1276}
   (( segid "T22D" and resid 36   and name HE2 ))
   (( segid "T22D" and resid 36   and name HE1 ))
      1.800     0.400     0.400 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.10122E-01 ppm1      2.251 ppm2      2.773 CV     1
 ASSI { 1278}
   (( segid "T22D" and resid 36   and name HE2 ))
   (  segid "T22D" and resid 80   and name HD% )
      3.300     1.300     1.300 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.86096E-03 ppm1      2.260 ppm2      6.596 CV     1
 ASSI { 1281}
   (( segid "T22D" and resid 36   and name HE1 ))
   (( segid "T22D" and resid 36   and name HD2 ))
      2.300     0.700     0.700 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.41425E-02 ppm1      2.779 ppm2      1.611 CV     1
 ASSI { 1283}
   (( segid "T22D" and resid 36   and name HE1 ))
   (( segid "T22D" and resid 36   and name HB1 ))
      4.400     2.400     1.600 peak  1283 spectrum    1 weight  0.10000E+01 volume  0.78182E-03 ppm1      2.779 ppm2      1.785 CV     1
 ASSI { 1284}
   (( segid "T22D" and resid 36   and name HE2 ))
   (( segid "T22D" and resid 36   and name HD2 ))
      3.100     1.200     1.200 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.19593E-02 ppm1      2.247 ppm2      1.606 CV     1
 ASSI { 1289}
   (( segid "T22D" and resid 109  and name HB2 ))
   (( segid "T22D" and resid 109  and name HB1 ))
      1.700     0.400     0.500 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.71426E-02 ppm1      1.891 ppm2      1.799 CV     1
 ASSI { 1292}
   (( segid "T22D" and resid 109  and name HB1 ))
   (( segid "T22D" and resid 112  and name HG  ))
      4.100     2.100     1.900 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.62523E-03 ppm1      1.806 ppm2      0.778 CV     1
 ASSI { 1293}
   (( segid "T22D" and resid 109  and name HB2 ))
   (( segid "T22D" and resid 112  and name HG  ))
      2.800     1.000     1.000 peak  1293 spectrum    1 weight  0.10000E+01 volume  0.65271E-03 ppm1      1.885 ppm2      0.779 CV     1
 ASSI { 1294}
   (( segid "T22D" and resid 109  and name HB1 ))
   (  segid "T22D" and resid 112  and name HD2%)
      5.000     3.100     1.000 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.56434E-03 ppm1      1.817 ppm2      0.606 CV     1
 ASSI { 1295}
   (( segid "T22D" and resid 109  and name HB1 ))
   (( segid "T22D" and resid 37   and name HG12))
      3.900     1.900     1.900 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.84136E-03 ppm1      1.821 ppm2      0.549 CV     1
 ASSI { 1296}
   (( segid "T22D" and resid 60   and name HB1 ))
   (( segid "T22D" and resid 84   and name HD2 ))
      2.500     0.800     0.800 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.74904E-02 ppm1      2.575 ppm2      1.716 CV     1
 OR { 1296}
   (( segid "T22D" and resid 60   and name HB2 ))
   (( segid "T22D" and resid 84   and name HD2 ))
 OR { 1296}
   (( segid "T22D" and resid 60   and name HB1 ))
   (( segid "T22D" and resid 84   and name HD1 ))
 OR { 1296}
   (( segid "T22D" and resid 60   and name HB2 ))
   (( segid "T22D" and resid 84   and name HD1 ))
 ASSI { 1297}
   (( segid "T22D" and resid 61   and name HB  ))
   (( segid "T22D" and resid 52   and name HD2 ))
      4.000     2.000     2.000 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.42610E-03 ppm1      1.475 ppm2      7.307 CV     1
 ASSI { 1298}
   (( segid "T22D" and resid 109  and name HB1 ))
   (( segid "T22D" and resid 109  and name HA  ))
      2.400     0.700     0.700 peak  1298 spectrum    1 weight  0.10000E+01 volume  0.25960E-02 ppm1      1.816 ppm2      4.476 CV     1
 ASSI { 1299}
   (( segid "T22D" and resid 60   and name HB2 ))
   (( segid "T22D" and resid 84   and name HB2 ))
      2.700     0.900     0.900 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.32686E-02 ppm1      2.563 ppm2      1.900 CV     1
 OR { 1299}
   (( segid "T22D" and resid 60   and name HB1 ))
   (( segid "T22D" and resid 84   and name HB2 ))
 ASSI { 1300}
   (( segid "T22D" and resid 60   and name HB2 ))
   (( segid "T22D" and resid 84   and name HG2 ))
      4.000     2.000     2.000 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.13406E-02 ppm1      2.590 ppm2      1.379 CV     1
 OR { 1300}
   (( segid "T22D" and resid 60   and name HB1 ))
   (( segid "T22D" and resid 84   and name HG2 ))
 OR { 1300}
   (( segid "T22D" and resid 60   and name HB2 ))
   (( segid "T22D" and resid 84   and name HG1 ))
 OR { 1300}
   (( segid "T22D" and resid 60   and name HB1 ))
   (( segid "T22D" and resid 84   and name HG1 ))
 ASSI { 1301}
   (( segid "T22D" and resid 109  and name HB1 ))
   (  segid "T22D" and resid 111  and name HD% )
      2.400     0.700     0.700 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.22005E-02 ppm1      1.817 ppm2      7.097 CV     1
 ASSI { 1303}
   (( segid "T22D" and resid 60   and name HB2 ))
   (( segid "T22D" and resid 60   and name HA  ))
      2.600     0.800     0.800 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.74520E-02 ppm1      2.615 ppm2      4.718 CV     1
 ASSI { 1304}
   (( segid "T22D" and resid 60   and name HB1 ))
   (( segid "T22D" and resid 60   and name HA  ))
      2.400     0.700     0.700 peak  1304 spectrum    1 weight  0.10000E+01 volume  0.58315E-02 ppm1      2.539 ppm2      4.718 CV     1
 ASSI { 1306}
   (( segid "T22D" and resid 60   and name HB1 ))
   (  segid "T22D" and resid 61   and name HG2%)
      4.500     2.600     1.500 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.42844E-03 ppm1      2.580 ppm2      0.609 CV     1
 OR { 1306}
   (( segid "T22D" and resid 60   and name HB2 ))
   (  segid "T22D" and resid 61   and name HG2%)
 ASSI { 1307}
   (( segid "T22D" and resid 109  and name HB2 ))
   (( segid "T22D" and resid 109  and name HG  ))
      2.500     0.800     0.800 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.32381E-02 ppm1      1.879 ppm2      2.083 CV     1
 OR { 1307}
   (( segid "T22D" and resid 109  and name HB1 ))
   (( segid "T22D" and resid 109  and name HG  ))
 ASSI { 1308}
   (( segid "T22D" and resid 109  and name HB1 ))
   (( segid "T22D" and resid 109  and name HG  ))
      2.800     1.000     1.000 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.29234E-02 ppm1      1.832 ppm2      2.083 CV     1
 ASSI { 1309}
   (( segid "T22D" and resid 36   and name HE2 ))
   (  segid "T22D" and resid 80   and name HE% )
      3.300     1.300     1.300 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.53161E-03 ppm1      2.258 ppm2      7.154 CV     1
 ASSI { 1311}
   (( segid "T22D" and resid 36   and name HE2 ))
   (( segid "3T5T" and resid 6    and name H2' ))
      4.500     2.500     1.500 peak  1311 spectrum    1 weight  0.10000E+01 volume  0.34243E-03 ppm1      2.253 ppm2      2.560 CV     1
 ASSI { 1312}
   (( segid "T22D" and resid 36   and name HE1 ))
   (  segid "T22D" and resid 80   and name HE% )
      4.100     2.100     1.900 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.56580E-03 ppm1      2.795 ppm2      7.138 CV     1
 ASSI { 1315}
   (( segid "T22D" and resid 42   and name HB2 ))
   (( segid "T22D" and resid 42   and name HA  ))
      3.300     1.400     1.400 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.11397E-02 ppm1      0.949 ppm2      4.315 CV     1
 ASSI { 1318}
   (( segid "T22D" and resid 42   and name HB2 ))
   (( segid "T22D" and resid 43   and name HD1 ))
      4.700     2.800     1.300 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.66163E-03 ppm1      0.954 ppm2      3.788 CV     1
 ASSI { 1321}
   (( segid "T22D" and resid 42   and name HB2 ))
   (( segid "T22D" and resid 42   and name HG  ))
      2.900     1.000     1.000 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.10825E-02 ppm1      0.958 ppm2      1.251 CV     1
 ASSI { 1323}
   (( segid "T22D" and resid 84   and name HE2 ))
   (( segid "T22D" and resid 62   and name HA  ))
      2.500     0.800     0.800 peak  1323 spectrum    1 weight  0.10000E+01 volume  0.50809E-02 ppm1      2.964 ppm2      4.405 CV     1
 ASSI { 1324}
   (( segid "T22D" and resid 94   and name HE2 ))
   (( segid "T22D" and resid 94   and name HA  ))
      3.500     1.500     1.500 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.18722E-02 ppm1      2.996 ppm2      3.884 CV     1
 OR { 1324}
   (( segid "T22D" and resid 94   and name HE1 ))
   (( segid "T22D" and resid 94   and name HA  ))
 ASSI { 1325}
   (( segid "T22D" and resid 84   and name HE2 ))
   (( segid "T22D" and resid 62   and name HG2 ))
      2.900     1.100     1.100 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.27474E-02 ppm1      2.972 ppm2      2.106 CV     1
 OR { 1325}
   (( segid "T22D" and resid 84   and name HE2 ))
   (( segid "T22D" and resid 62   and name HG1 ))
 OR { 1325}
   (( segid "T22D" and resid 84   and name HE1 ))
   (( segid "T22D" and resid 62   and name HG2 ))
 OR { 1325}
   (( segid "T22D" and resid 84   and name HE1 ))
   (( segid "T22D" and resid 62   and name HG1 ))
 ASSI { 1327}
   (( segid "T22D" and resid 49   and name HE2 ))
   (( segid "T22D" and resid 49   and name HD1 ))
      2.400     0.700     0.700 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.63002E-02 ppm1      2.979 ppm2      1.640 CV     1
 OR { 1327}
   (( segid "T22D" and resid 49   and name HE1 ))
   (( segid "T22D" and resid 49   and name HD1 ))
 ASSI { 1329}
   (( segid "T22D" and resid 97   and name HB1 ))
   (( segid "T22D" and resid 97   and name HB2 ))
      1.900     0.400     0.400 peak  1329 spectrum    1 weight  0.10000E+01 volume  0.13664E-01 ppm1      2.428 ppm2      2.801 CV     1
 ASSI { 1330}
   (( segid "T22D" and resid 42   and name HB1 ))
   (( segid "T22D" and resid 42   and name HA  ))
      2.900     1.100     1.100 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.11000E-02 ppm1      1.151 ppm2      4.314 CV     1
 ASSI { 1331}
   (( segid "T22D" and resid 49   and name HE1 ))
   (( segid "T22D" and resid 49   and name HD2 ))
      2.000     0.500     0.500 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.22471E-01 ppm1      2.976 ppm2      1.713 CV     1
 OR { 1331}
   (( segid "T22D" and resid 49   and name HE2 ))
   (( segid "T22D" and resid 49   and name HD1 ))
 OR { 1331}
   (( segid "T22D" and resid 49   and name HE1 ))
   (( segid "T22D" and resid 49   and name HD1 ))
 OR { 1331}
   (( segid "T22D" and resid 49   and name HE2 ))
   (( segid "T22D" and resid 49   and name HD2 ))
 ASSI { 1332}
   (( segid "T22D" and resid 49   and name HE1 ))
   (( segid "T22D" and resid 49   and name HB2 ))
      2.600     0.800     0.800 peak  1332 spectrum    1 weight  0.10000E+01 volume  0.48540E-02 ppm1      2.989 ppm2      1.895 CV     1
 OR { 1332}
   (( segid "T22D" and resid 49   and name HE2 ))
   (( segid "T22D" and resid 49   and name HB2 ))
 ASSI { 1333}
   (( segid "T22D" and resid 115  and name HE2 ))
   (( segid "3T5T" and resid 5    and name H2''))
      3.400     3.400     2.600 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.22824E-02 ppm1      2.982 ppm2      2.427 CV     1
 OR { 1333}
   (( segid "T22D" and resid 115  and name HE1 ))
   (( segid "3T5T" and resid 5    and name H2''))
 ASSI { 1334}
   (( segid "T22D" and resid 97   and name HB2 ))
   (( segid "T22D" and resid 97   and name HA  ))
      2.900     1.100     1.100 peak  1334 spectrum    1 weight  0.10000E+01 volume  0.36027E-02 ppm1      2.805 ppm2      6.045 CV     1
 ASSI { 1341}
   (( segid "T22D" and resid 97   and name HB1 ))
   (( segid "T22D" and resid 97   and name HA  ))
      2.600     0.800     0.800 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.28819E-02 ppm1      2.429 ppm2      6.045 CV     1
 ASSI { 1344}
   (( segid "T22D" and resid 42   and name HB2 ))
   (( segid "T22D" and resid 77   and name HA1 ))
      4.000     2.000     2.000 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.50125E-03 ppm1      0.942 ppm2      3.222 CV     1
 ASSI { 1347}
   (( segid "T22D" and resid 112  and name HB2 ))
   (  segid "T22D" and resid 112  and name HD1%)
      2.500     0.800     0.800 peak  1347 spectrum    1 weight  0.10000E+01 volume  0.42268E-02 ppm1      1.376 ppm2      0.942 CV     1
 ASSI { 1350}
   (( segid "T22D" and resid 112  and name HB2 ))
   (( segid "T22D" and resid 112  and name HB1 ))
      1.800     0.400     0.400 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.10490E-01 ppm1      1.373 ppm2      1.502 CV     1
 ASSI { 1352}
   (( segid "T22D" and resid 112  and name HB1 ))
   (( segid "T22D" and resid 112  and name HA  ))
      2.600     0.800     0.800 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.32668E-02 ppm1      1.501 ppm2      3.667 CV     1
 ASSI { 1353}
   (( segid "T22D" and resid 112  and name HB2 ))
   (( segid "T22D" and resid 112  and name HA  ))
      2.800     1.000     1.000 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.40507E-02 ppm1      1.380 ppm2      3.667 CV     1
 ASSI { 1357}
   (( segid "T22D" and resid 108  and name HB2 ))
   (( segid "T22D" and resid 108  and name HA  ))
      2.400     0.700     0.700 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.53507E-02 ppm1      2.774 ppm2      4.940 CV     1
 ASSI { 1361}
   (( segid "T22D" and resid 51   and name HB1 ))
   (( segid "T22D" and resid 48   and name HA  ))
      3.800     1.800     1.800 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.19046E-02 ppm1      1.923 ppm2      4.054 CV     1
 ASSI { 1362}
   (( segid "T22D" and resid 51   and name HB2 ))
   (  segid "T22D" and resid 81   and name HG2%)
      4.200     2.200     1.800 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.67948E-03 ppm1      1.312 ppm2      0.269 CV     1
 ASSI { 1363}
   (( segid "T22D" and resid 51   and name HB1 ))
   (( segid "T22D" and resid 51   and name HB2 ))
      2.000     0.500     0.500 peak  1363 spectrum    1 weight  0.10000E+01 volume  0.51889E-02 ppm1      1.924 ppm2      1.321 CV     1
 ASSI { 1365}
   (( segid "T22D" and resid 51   and name HB2 ))
   (  segid "T22D" and resid 51   and name HD2%)
      3.300     1.300     1.300 peak  1365 spectrum    1 weight  0.10000E+01 volume  0.30203E-02 ppm1      1.313 ppm2      0.936 CV     1
 ASSI { 1366}
   (( segid "T22D" and resid 51   and name HB1 ))
   (  segid "T22D" and resid 66   and name HG2%)
      4.300     2.300     1.700 peak  1366 spectrum    1 weight  0.10000E+01 volume  0.11781E-02 ppm1      1.930 ppm2      0.589 CV     1
 ASSI { 1367}
   (( segid "T22D" and resid 51   and name HB2 ))
   (  segid "T22D" and resid 66   and name HG2%)
      3.500     1.500     1.500 peak  1367 spectrum    1 weight  0.10000E+01 volume  0.14603E-02 ppm1      1.306 ppm2      0.596 CV     1
 ASSI { 1372}
   (( segid "T22D" and resid 51   and name HB2 ))
   (( segid "T22D" and resid 48   and name HA  ))
      3.000     1.100     1.100 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.97122E-03 ppm1      1.306 ppm2      4.054 CV     1
 ASSI { 1377}
   (( segid "T22D" and resid 51   and name HB1 ))
   (( segid "T22D" and resid 51   and name HA  ))
      2.600     0.900     0.900 peak  1377 spectrum    1 weight  0.10000E+01 volume  0.23892E-02 ppm1      1.930 ppm2      4.140 CV     1
 ASSI { 1378}
   (( segid "T22D" and resid 108  and name HB1 ))
   (( segid "T22D" and resid 108  and name HB2 ))
      1.900     0.500     0.500 peak  1378 spectrum    1 weight  0.10000E+01 volume  0.93836E-02 ppm1      3.003 ppm2      2.784 CV     1
 ASSI { 1380}
   (( segid "T22D" and resid 103  and name HD2 ))
   (( segid "T22D" and resid 103  and name HD1 ))
      2.000     0.500     0.500 peak  1380 spectrum    1 weight  0.10000E+01 volume  0.49253E-02 ppm1      2.869 ppm2      2.737 CV     1
 ASSI { 1383}
   (( segid "T22D" and resid 69   and name HB2 ))
   (( segid "T22D" and resid 69   and name HB1 ))
      1.800     0.400     0.400 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.13635E-01 ppm1      3.088 ppm2      2.493 CV     1
 ASSI { 1385}
   (( segid "T22D" and resid 103  and name HD1 ))
   (( segid "T22D" and resid 103  and name HB1 ))
      3.700     1.700     1.700 peak  1385 spectrum    1 weight  0.10000E+01 volume  0.99912E-03 ppm1      2.744 ppm2      1.665 CV     1
 ASSI { 1386}
   (( segid "T22D" and resid 69   and name HB2 ))
   (  segid "T22D" and resid 72   and name HG2%)
      4.800     2.800     1.200 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.57886E-03 ppm1      3.088 ppm2      1.170 CV     1
 ASSI { 1391}
   (( segid "T22D" and resid 103  and name HD1 ))
   (( segid "T22D" and resid 43   and name HD1 ))
      3.900     1.900     1.900 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.40565E-03 ppm1      2.731 ppm2      3.803 CV     1
 ASSI { 1392}
   (( segid "T22D" and resid 103  and name HD2 ))
   (( segid "T22D" and resid 43   and name HD1 ))
      4.400     2.400     1.600 peak  1392 spectrum    1 weight  0.10000E+01 volume  0.35380E-03 ppm1      2.914 ppm2      3.795 CV     1
 ASSI { 1394}
   (( segid "T22D" and resid 69   and name HB1 ))
   (( segid "T22D" and resid 76   and name HD1 ))
      5.100     3.200     0.900 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.57927E-03 ppm1      2.487 ppm2      3.379 CV     1
 ASSI { 1399}
   (( segid "T22D" and resid 30   and name HD2 ))
   (( segid "T22D" and resid 31   and name HB1 ))
      3.200     1.300     1.300 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.23891E-02 ppm1      3.194 ppm2      2.627 CV     1
 OR { 1399}
   (( segid "T22D" and resid 30   and name HD1 ))
   (( segid "T22D" and resid 31   and name HB1 ))
 ASSI { 1400}
   (( segid "T22D" and resid 30   and name HD1 ))
   (( segid "T22D" and resid 30   and name HG1 ))
      2.400     0.700     0.700 peak  1400 spectrum    1 weight  0.10000E+01 volume  0.66847E-02 ppm1      3.186 ppm2      1.586 CV     1
 OR { 1400}
   (( segid "T22D" and resid 30   and name HD2 ))
   (( segid "T22D" and resid 30   and name HG1 ))
 ASSI { 1401}
   (( segid "T22D" and resid 70   and name HD1 ))
   (( segid "T22D" and resid 70   and name HA  ))
      2.500     0.800     0.800 peak  1401 spectrum    1 weight  0.10000E+01 volume  0.50767E-02 ppm1      3.201 ppm2      4.057 CV     1
 OR { 1401}
   (( segid "T22D" and resid 70   and name HD2 ))
   (( segid "T22D" and resid 70   and name HA  ))
 ASSI { 1402}
   (( segid "T22D" and resid 117  and name HD1 ))
   (( segid "T22D" and resid 117  and name HG2 ))
      2.000     0.500     0.500 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.19700E-01 ppm1      3.206 ppm2      1.697 CV     1
 OR { 1402}
   (( segid "T22D" and resid 117  and name HD2 ))
   (( segid "T22D" and resid 117  and name HG1 ))
 OR { 1402}
   (( segid "T22D" and resid 117  and name HD2 ))
   (( segid "T22D" and resid 117  and name HG2 ))
 OR { 1402}
   (( segid "T22D" and resid 117  and name HD1 ))
   (( segid "T22D" and resid 117  and name HG1 ))
 ASSI { 1405}
   (( segid "T22D" and resid 117  and name HD2 ))
   (( segid "T22D" and resid 117  and name HB2 ))
      2.200     0.600     0.600 peak  1405 spectrum    1 weight  0.10000E+01 volume  0.16832E-01 ppm1      3.200 ppm2      1.860 CV     1
 OR { 1405}
   (( segid "T22D" and resid 117  and name HD1 ))
   (( segid "T22D" and resid 117  and name HB1 ))
 OR { 1405}
   (( segid "T22D" and resid 117  and name HD1 ))
   (( segid "T22D" and resid 117  and name HB2 ))
 OR { 1405}
   (( segid "T22D" and resid 117  and name HD2 ))
   (( segid "T22D" and resid 117  and name HB1 ))
 ASSI { 1406}
   (( segid "T22D" and resid 30   and name HD1 ))
   (( segid "T22D" and resid 30   and name HA  ))
      2.600     0.900     0.900 peak  1406 spectrum    1 weight  0.10000E+01 volume  0.57644E-02 ppm1      3.188 ppm2      4.298 CV     1
 OR { 1406}
   (( segid "T22D" and resid 30   and name HD2 ))
   (( segid "T22D" and resid 30   and name HA  ))
 ASSI { 1409}
   (( segid "T22D" and resid 70   and name HD2 ))
   (( segid "T22D" and resid 73   and name HG2 ))
      2.800     2.800     3.200 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.84487E-03 ppm1      3.195 ppm2      2.298 CV     1
 OR { 1409}
   (( segid "T22D" and resid 70   and name HD1 ))
   (( segid "T22D" and resid 73   and name HG2 ))
 OR { 1409}
   (( segid "T22D" and resid 70   and name HD2 ))
   (( segid "T22D" and resid 73   and name HG1 ))
 OR { 1409}
   (( segid "T22D" and resid 70   and name HD1 ))
   (( segid "T22D" and resid 73   and name HG1 ))
 ASSI { 1410}
   (( segid "T22D" and resid 117  and name HD2 ))
   (( segid "T22D" and resid 117  and name HA  ))
      2.700     0.900     0.900 peak  1410 spectrum    1 weight  0.10000E+01 volume  0.39602E-02 ppm1      3.198 ppm2      4.408 CV     1
 OR { 1410}
   (( segid "T22D" and resid 117  and name HD1 ))
   (( segid "T22D" and resid 117  and name HA  ))
 ASSI { 1411}
   (( segid "T22D" and resid 30   and name HD2 ))
   (( segid "T22D" and resid 30   and name HG2 ))
      2.200     0.600     0.600 peak  1411 spectrum    1 weight  0.10000E+01 volume  0.11870E-01 ppm1      3.191 ppm2      1.649 CV     1
 OR { 1411}
   (( segid "T22D" and resid 30   and name HD1 ))
   (( segid "T22D" and resid 30   and name HG2 ))
 ASSI { 1412}
   (( segid "T22D" and resid 76   and name HD2 ))
   (( segid "T22D" and resid 67   and name HB  ))
      4.200     2.200     1.800 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.55771E-03 ppm1      3.068 ppm2      0.970 CV     1
 ASSI { 1414}
   (( segid "T22D" and resid 76   and name HD1 ))
   (( segid "T22D" and resid 76   and name HG1 ))
      2.600     0.800     0.800 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.30198E-02 ppm1      3.373 ppm2      1.727 CV     1
 ASSI { 1415}
   (( segid "T22D" and resid 76   and name HD2 ))
   (( segid "T22D" and resid 76   and name HA  ))
      4.000     2.000     2.000 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      3.064 ppm2      4.589 CV     1
 ASSI { 1417}
   (( segid "T22D" and resid 76   and name HD2 ))
   (( segid "T22D" and resid 76   and name HB2 ))
      3.700     1.700     1.700 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.12397E-02 ppm1      3.074 ppm2      2.294 CV     1
 ASSI { 1421}
   (( segid "T22D" and resid 76   and name HD1 ))
   (  segid "T22D" and resid 78   and name HE% )
      3.400     1.400     1.400 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.82339E-03 ppm1      3.386 ppm2      6.629 CV     1
 ASSI { 1422}
   (( segid "T22D" and resid 76   and name HD1 ))
   (( segid "T22D" and resid 76   and name HB2 ))
      2.800     1.000     1.000 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.16480E-02 ppm1      3.377 ppm2      2.290 CV     1
 ASSI { 1423}
   (( segid "T22D" and resid 76   and name HD1 ))
   (( segid "T22D" and resid 76   and name HD2 ))
      1.700     0.400     0.500 peak  1423 spectrum    1 weight  0.10000E+01 volume  0.12595E-01 ppm1      3.381 ppm2      3.069 CV     1
 ASSI { 1426}
   (( segid "T22D" and resid 76   and name HD1 ))
   (( segid "T22D" and resid 76   and name HB1 ))
      3.100     1.200     1.200 peak  1426 spectrum    1 weight  0.10000E+01 volume  0.13970E-02 ppm1      3.375 ppm2      1.335 CV     1
 ASSI { 1427}
   (( segid "T22D" and resid 76   and name HD2 ))
   (( segid "T22D" and resid 76   and name HB1 ))
      3.800     1.800     1.800 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.11879E-02 ppm1      3.069 ppm2      1.335 CV     1
 ASSI { 1428}
   (( segid "T22D" and resid 76   and name HD1 ))
   (( segid "T22D" and resid 76   and name HG2 ))
      3.100     1.200     1.200 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      3.381 ppm2      1.506 CV     1
 ASSI { 1430}
   (( segid "T22D" and resid 76   and name HD2 ))
   (  segid "T22D" and resid 78   and name HE% )
      4.400     2.400     1.600 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.72710E-03 ppm1      3.093 ppm2      6.632 CV     1
 ASSI { 1431}
   (( segid "T22D" and resid 86   and name HD1 ))
   (( segid "T22D" and resid 86   and name HB2 ))
      2.900     1.100     1.100 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.33066E-02 ppm1      2.968 ppm2      1.916 CV     1
 ASSI { 1432}
   (( segid "T22D" and resid 86   and name HD1 ))
   (( segid "T22D" and resid 86   and name HG2 ))
      2.400     0.700     0.700 peak  1432 spectrum    1 weight  0.10000E+01 volume  0.45892E-02 ppm1      2.964 ppm2      1.832 CV     1
 ASSI { 1434}
   (( segid "T22D" and resid 86   and name HD2 ))
   (( segid "T22D" and resid 86   and name HG2 ))
      2.600     0.900     0.900 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.50079E-02 ppm1      3.016 ppm2      1.829 CV     1
 ASSI { 1435}
   (( segid "T22D" and resid 86   and name HD1 ))
   (( segid "T22D" and resid 34   and name HB2 ))
      3.400     1.500     1.500 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.15455E-02 ppm1      2.963 ppm2      3.528 CV     1
 OR { 1435}
   (( segid "T22D" and resid 86   and name HD2 ))
   (( segid "T22D" and resid 34   and name HB2 ))
 ASSI { 1436}
   (( segid "T22D" and resid 86   and name HD1 ))
   (  segid "T22D" and resid 34   and name HD% )
      3.800     1.800     1.800 peak  1436 spectrum    1 weight  0.10000E+01 volume  0.78219E-03 ppm1      2.984 ppm2      7.222 CV     1
 OR { 1436}
   (( segid "T22D" and resid 86   and name HD2 ))
   (  segid "T22D" and resid 34   and name HD% )
 ASSI { 1437}
   (( segid "T22D" and resid 86   and name HD1 ))
   (( segid "T22D" and resid 86   and name HG1 ))
      2.500     0.800     0.800 peak  1437 spectrum    1 weight  0.10000E+01 volume  0.44132E-02 ppm1      2.985 ppm2      1.638 CV     1
 OR { 1437}
   (( segid "T22D" and resid 86   and name HD2 ))
   (( segid "T22D" and resid 86   and name HG1 ))
 ASSI { 1438}
   (( segid "T22D" and resid 86   and name HD1 ))
   (( segid "T22D" and resid 86   and name HA  ))
      3.800     1.800     1.800 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.18878E-02 ppm1      2.983 ppm2      4.065 CV     1
 OR { 1438}
   (( segid "T22D" and resid 86   and name HD2 ))
   (( segid "T22D" and resid 86   and name HA  ))
 ASSI { 1443}
   (( segid "T22D" and resid 91   and name HD2 ))
   (( segid "T22D" and resid 91   and name HA  ))
      3.200     1.200     1.200 peak  1443 spectrum    1 weight  0.10000E+01 volume  0.14738E-02 ppm1      3.597 ppm2      3.977 CV     1
 ASSI { 1444}
   (( segid "T22D" and resid 91   and name HD1 ))
   (( segid "T22D" and resid 91   and name HD2 ))
      1.800     0.400     0.400 peak  1444 spectrum    1 weight  0.10000E+01 volume  0.12857E-01 ppm1      3.421 ppm2      3.596 CV     1
 ASSI { 1445}
   (( segid "T22D" and resid 85   and name HB1 ))
   (( segid "T22D" and resid 85   and name HB2 ))
      1.800     0.400     0.400 peak  1445 spectrum    1 weight  0.10000E+01 volume  0.16297E-01 ppm1      2.998 ppm2      2.737 CV     1
 ASSI { 1450}
   (( segid "T22D" and resid 91   and name HD1 ))
   (( segid "T22D" and resid 91   and name HG2 ))
      2.600     0.800     0.800 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.27905E-02 ppm1      3.420 ppm2      2.080 CV     1
 ASSI { 1453}
   (( segid "T22D" and resid 91   and name HD2 ))
   (( segid "T22D" and resid 91   and name HB1 ))
      2.900     1.100     1.100 peak  1453 spectrum    1 weight  0.10000E+01 volume  0.12902E-02 ppm1      3.598 ppm2      2.358 CV     1
 ASSI { 1454}
   (( segid "T22D" and resid 59   and name HA1 ))
   (( segid "T22D" and resid 88   and name HB2 ))
      3.800     1.800     1.800 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.98895E-03 ppm1      4.603 ppm2      4.053 CV     1
 ASSI { 1455}
   (( segid "T22D" and resid 59   and name HA1 ))
   (( segid "T22D" and resid 59   and name HA2 ))
      2.000     0.500     0.500 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.78857E-02 ppm1      4.594 ppm2      3.836 CV     1
 ASSI { 1457}
   (( segid "T22D" and resid 91   and name HD1 ))
   (( segid "T22D" and resid 91   and name HG1 ))
      2.700     0.900     0.900 peak  1457 spectrum    1 weight  0.10000E+01 volume  0.32928E-02 ppm1      3.412 ppm2      1.718 CV     1
 ASSI { 1458}
   (( segid "T22D" and resid 91   and name HD2 ))
   (( segid "T22D" and resid 91   and name HB2 ))
      3.300     1.300     1.300 peak  1458 spectrum    1 weight  0.10000E+01 volume  0.26759E-02 ppm1      3.602 ppm2      2.069 CV     1
 ASSI { 1459}
   (( segid "T22D" and resid 91   and name HD1 ))
   (( segid "T22D" and resid 91   and name HB2 ))
      3.500     1.500     1.500 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.23181E-02 ppm1      3.412 ppm2      2.056 CV     1
 ASSI { 1462}
   (( segid "T22D" and resid 59   and name HA2 ))
   (  segid "T22D" and resid 83   and name HE% )
      4.600     2.600     1.400 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.63632E-03 ppm1      3.837 ppm2      1.922 CV     1
 ASSI { 1464}
   (( segid "T22D" and resid 80   and name HB2 ))
   (( segid "T22D" and resid 80   and name HB1 ))
      2.200     0.600     0.600 peak  1464 spectrum    1 weight  0.10000E+01 volume  0.37762E-02 ppm1      2.775 ppm2      2.178 CV     1
 ASSI { 1465}
   (( segid "T22D" and resid 80   and name HB1 ))
   (  segid "T22D" and resid 80   and name HD% )
      3.000     1.100     1.100 peak  1465 spectrum    1 weight  0.10000E+01 volume  0.13840E-02 ppm1      2.183 ppm2      6.611 CV     1
 ASSI { 1466}
   (( segid "T22D" and resid 80   and name HB1 ))
   (( segid "T22D" and resid 80   and name HA  ))
      3.000     1.100     1.100 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.13854E-02 ppm1      2.178 ppm2      5.587 CV     1
 ASSI { 1472}
   (( segid "T22D" and resid 113  and name HA2 ))
   (( segid "3T5T" and resid 5    and name H72 ))
      4.000     2.000     2.000 peak  1472 spectrum    1 weight  0.10000E+01 volume  0.10823E-02 ppm1      3.306 ppm2      1.149 CV     1
 OR { 1472}
   (( segid "T22D" and resid 113  and name HA2 ))
   (( segid "3T5T" and resid 5    and name H71 ))
 OR { 1472}
   (( segid "T22D" and resid 113  and name HA2 ))
   (( segid "3T5T" and resid 5    and name H73 ))
 ASSI { 1473}
   (( segid "T22D" and resid 113  and name HA2 ))
   (( segid "T22D" and resid 113  and name HA1 ))
      2.000     0.500     0.500 peak  1473 spectrum    1 weight  0.10000E+01 volume  0.10878E-01 ppm1      3.310 ppm2      4.154 CV     1
 ASSI { 1475}
   (( segid "T22D" and resid 113  and name HA1 ))
   (( segid "3T5T" and resid 5    and name H72 ))
      3.400     1.400     1.400 peak  1475 spectrum    1 weight  0.10000E+01 volume  0.87039E-03 ppm1      4.160 ppm2      1.153 CV     1
 OR { 1475}
   (( segid "T22D" and resid 113  and name HA1 ))
   (( segid "3T5T" and resid 5    and name H71 ))
 OR { 1475}
   (( segid "T22D" and resid 113  and name HA1 ))
   (( segid "3T5T" and resid 5    and name H73 ))
 ASSI { 1478}
   (( segid "T22D" and resid 79   and name HA1 ))
   (( segid "T22D" and resid 79   and name HA2 ))
      2.200     0.600     0.600 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.22816E-02 ppm1      3.782 ppm2      3.935 CV     1
 ASSI { 1479}
   (( segid "T22D" and resid 79   and name HA1 ))
   (( segid "T22D" and resid 66   and name HA  ))
      2.800     1.000     1.000 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.15892E-02 ppm1      3.781 ppm2      3.740 CV     1
 ASSI { 1482}
   (( segid "T22D" and resid 79   and name HA1 ))
   (( segid "T22D" and resid 67   and name HG12))
      4.900     3.000     1.100 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.46351E-03 ppm1      3.796 ppm2      1.165 CV     1
 ASSI { 1487}
   (( segid "T22D" and resid 79   and name HA2 ))
   (( segid "T22D" and resid 67   and name HG12))
      2.700     2.700     3.300 peak  1487 spectrum    1 weight  0.10000E+01 volume  0.44975E-03 ppm1      3.955 ppm2      1.163 CV     1
 ASSI { 1490}
   (( segid "T22D" and resid 79   and name HA1 ))
   (  segid "T22D" and resid 66   and name HG2%)
      4.200     2.200     1.800 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.45771E-03 ppm1      3.797 ppm2      0.591 CV     1
 ASSI { 1491}
   (( segid "T22D" and resid 79   and name HA1 ))
   (  segid "T22D" and resid 51   and name HD1%)
      3.500     1.500     1.500 peak  1491 spectrum    1 weight  0.10000E+01 volume  0.36431E-03 ppm1      3.787 ppm2      0.544 CV     1
 ASSI { 1492}
   (( segid "T22D" and resid 79   and name HA1 ))
   (  segid "T22D" and resid 42   and name HD1%)
      3.600     1.700     1.700 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.31733E-03 ppm1      3.803 ppm2      0.450 CV     1
 ASSI { 1495}
   (( segid "T22D" and resid 102  and name HA1 ))
   (( segid "T22D" and resid 102  and name HA2 ))
      2.000     0.500     0.500 peak  1495 spectrum    1 weight  0.10000E+01 volume  0.86426E-02 ppm1      3.445 ppm2      4.143 CV     1
 ASSI { 1503}
   (( segid "T22D" and resid 77   and name HA2 ))
   (( segid "T22D" and resid 77   and name HA1 ))
      2.300     0.600     0.600 peak  1503 spectrum    1 weight  0.10000E+01 volume  0.31325E-02 ppm1      4.257 ppm2      3.220 CV     1
 ASSI { 1504}
   (( segid "T22D" and resid 77   and name HA2 ))
   (  segid "T22D" and resid 44   and name HD% )
      3.700     1.700     1.700 peak  1504 spectrum    1 weight  0.10000E+01 volume  0.38796E-03 ppm1      4.256 ppm2      6.824 CV     1
 ASSI { 1505}
   (( segid "T22D" and resid 77   and name HA1 ))
   (  segid "T22D" and resid 44   and name HD% )
      4.700     2.700     1.300 peak  1505 spectrum    1 weight  0.10000E+01 volume  0.42685E-03 ppm1      3.242 ppm2      6.820 CV     1
 ASSI { 1510}
   (( segid "T22D" and resid 41   and name HA1 ))
   (( segid "T22D" and resid 41   and name HA2 ))
      2.400     0.700     0.700 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.24532E-02 ppm1      4.083 ppm2      3.986 CV     1
 ASSI { 1515}
   (( segid "T22D" and resid 98   and name HD2 ))
   (( segid "T22D" and resid 98   and name HB1 ))
      4.300     2.300     1.700 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.60971E-03 ppm1      3.158 ppm2      2.127 CV     1
 ASSI { 1516}
   (( segid "T22D" and resid 98   and name HD1 ))
   (( segid "T22D" and resid 98   and name HB1 ))
      3.500     1.500     1.500 peak  1516 spectrum    1 weight  0.10000E+01 volume  0.95980E-03 ppm1      3.593 ppm2      2.129 CV     1
 ASSI { 1518}
   (( segid "T22D" and resid 98   and name HD2 ))
   (( segid "T22D" and resid 98   and name HA  ))
      3.800     1.800     1.800 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.68886E-03 ppm1      3.154 ppm2      4.478 CV     1
 ASSI { 1519}
   (( segid "T22D" and resid 98   and name HD1 ))
   (( segid "T22D" and resid 98   and name HD2 ))
      2.200     0.600     0.600 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.35733E-02 ppm1      3.590 ppm2      3.169 CV     1
 ASSI { 1522}
   (( segid "T22D" and resid 98   and name HD2 ))
   (( segid "T22D" and resid 98   and name HG2 ))
      2.900     1.100     1.100 peak  1522 spectrum    1 weight  0.10000E+01 volume  0.13835E-02 ppm1      3.175 ppm2      1.989 CV     1
 OR { 1522}
   (( segid "T22D" and resid 98   and name HD2 ))
   (( segid "T22D" and resid 98   and name HG1 ))
 ASSI { 1524}
   (( segid "T22D" and resid 98   and name HD2 ))
   (( segid "T22D" and resid 98   and name HB2 ))
      3.700     1.700     1.700 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.13887E-02 ppm1      3.169 ppm2      1.576 CV     1
 ASSI { 1525}
   (( segid "T22D" and resid 98   and name HD1 ))
   (  segid "T22D" and resid 105  and name HB% )
      4.500     2.500     1.500 peak  1525 spectrum    1 weight  0.10000E+01 volume  0.83394E-03 ppm1      3.596 ppm2      1.302 CV     1
 ASSI { 1528}
   (( segid "T22D" and resid 95   and name HA  ))
   (( segid "T22D" and resid 96   and name HB2 ))
      5.100     3.300     0.900 peak  1528 spectrum    1 weight  0.10000E+01 volume  0.55971E-03 ppm1      5.141 ppm2      2.162 CV     1
 ASSI { 1529}
   (( segid "T22D" and resid 95   and name HA  ))
   (( segid "T22D" and resid 95   and name HB2 ))
      2.700     0.900     0.900 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.25922E-02 ppm1      5.140 ppm2      2.815 CV     1
 ASSI { 1530}
   (( segid "T22D" and resid 95   and name HA  ))
   (( segid "T22D" and resid 96   and name HD1 ))
      2.500     0.800     0.800 peak  1530 spectrum    1 weight  0.10000E+01 volume  0.67235E-02 ppm1      5.138 ppm2      4.009 CV     1
 ASSI { 1531}
   (( segid "T22D" and resid 95   and name HA  ))
   (( segid "T22D" and resid 96   and name HD2 ))
      2.300     0.600     0.600 peak  1531 spectrum    1 weight  0.10000E+01 volume  0.61034E-02 ppm1      5.142 ppm2      4.106 CV     1
 ASSI { 1533}
   (( segid "T22D" and resid 95   and name HA  ))
   (( segid "T22D" and resid 95   and name HB1 ))
      3.000     1.100     1.100 peak  1533 spectrum    1 weight  0.10000E+01 volume  0.37228E-02 ppm1      5.137 ppm2      2.487 CV     1
 ASSI { 1535}
   (( segid "T22D" and resid 43   and name HD2 ))
   (( segid "T22D" and resid 43   and name HG1 ))
      3.300     1.300     1.300 peak  1535 spectrum    1 weight  0.10000E+01 volume  0.13038E-02 ppm1      3.866 ppm2      2.227 CV     1
 ASSI { 1538}
   (( segid "T22D" and resid 43   and name HD2 ))
   (( segid "T22D" and resid 43   and name HG2 ))
      2.700     0.900     0.900 peak  1538 spectrum    1 weight  0.10000E+01 volume  0.13419E-02 ppm1      3.869 ppm2      1.800 CV     1
 ASSI { 1540}
   (( segid "T22D" and resid 43   and name HD2 ))
   (( segid "T22D" and resid 43   and name HD1 ))
      2.200     0.600     0.600 peak  1540 spectrum    1 weight  0.10000E+01 volume  0.25859E-02 ppm1      3.916 ppm2      3.793 CV     1
 ASSI { 1541}
   (( segid "T22D" and resid 43   and name HD2 ))
   (( segid "T22D" and resid 43   and name HB2 ))
      4.000     2.000     2.000 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.72956E-03 ppm1      3.890 ppm2      1.621 CV     1
 ASSI { 1542}
   (( segid "T22D" and resid 43   and name HD1 ))
   (( segid "T22D" and resid 43   and name HB2 ))
      4.000     2.000     2.000 peak  1542 spectrum    1 weight  0.10000E+01 volume  0.94541E-03 ppm1      3.793 ppm2      1.621 CV     1
 ASSI { 1544}
   (( segid "T22D" and resid 43   and name HD2 ))
   (( segid "T22D" and resid 103  and name HB2 ))
      5.100     3.300     0.900 peak  1544 spectrum    1 weight  0.10000E+01 volume  0.56213E-03 ppm1      3.877 ppm2      1.517 CV     1
 ASSI { 1546}
   (( segid "T22D" and resid 43   and name HD2 ))
   (( segid "T22D" and resid 42   and name HB2 ))
      4.600     2.600     1.400 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.49474E-03 ppm1      3.888 ppm2      0.942 CV     1
 ASSI { 1548}
   (( segid "T22D" and resid 43   and name HD2 ))
   (  segid "T22D" and resid 42   and name HD1%)
      4.600     2.600     1.400 peak  1548 spectrum    1 weight  0.10000E+01 volume  0.48632E-03 ppm1      3.875 ppm2      0.438 CV     1
 ASSI { 1549}
   (( segid "T22D" and resid 43   and name HD1 ))
   (  segid "T22D" and resid 42   and name HD1%)
      5.100     3.200     0.900 peak  1549 spectrum    1 weight  0.10000E+01 volume  0.56855E-03 ppm1      3.798 ppm2      0.440 CV     1
 ASSI { 1551}
   (( segid "T22D" and resid 43   and name HD1 ))
   (  segid "T22D" and resid 46   and name HG2%)
      4.600     2.600     1.400 peak  1551 spectrum    1 weight  0.10000E+01 volume  0.80121E-03 ppm1      3.803 ppm2      1.147 CV     1
 ASSI { 1554}
   (( segid "T22D" and resid 116  and name HD1 ))
   (( segid "T22D" and resid 115  and name HB1 ))
      3.500     1.500     1.500 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.24260E-02 ppm1      3.804 ppm2      1.804 CV     1
 ASSI { 1556}
   (( segid "T22D" and resid 116  and name HD2 ))
   (( segid "T22D" and resid 116  and name HB2 ))
      3.400     1.400     1.400 peak  1556 spectrum    1 weight  0.10000E+01 volume  0.26860E-02 ppm1      3.613 ppm2      1.869 CV     1
 ASSI { 1557}
   (( segid "T22D" and resid 116  and name HD2 ))
   (( segid "T22D" and resid 115  and name HA  ))
      2.200     0.600     0.600 peak  1557 spectrum    1 weight  0.10000E+01 volume  0.11843E-01 ppm1      3.610 ppm2      4.544 CV     1
 ASSI { 1558}
   (( segid "T22D" and resid 116  and name HD1 ))
   (( segid "T22D" and resid 115  and name HA  ))
      2.000     0.500     0.500 peak  1558 spectrum    1 weight  0.10000E+01 volume  0.12510E-01 ppm1      3.798 ppm2      4.544 CV     1
 ASSI { 1559}
   (( segid "T22D" and resid 116  and name HD1 ))
   (( segid "T22D" and resid 116  and name HG1 ))
      2.500     0.800     0.800 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.52156E-02 ppm1      3.796 ppm2      2.002 CV     1
 OR { 1559}
   (( segid "T22D" and resid 116  and name HD1 ))
   (( segid "T22D" and resid 116  and name HG2 ))
 ASSI { 1562}
   (( segid "T22D" and resid 116  and name HD1 ))
   (( segid "T22D" and resid 116  and name HD2 ))
      1.600     0.300     0.600 peak  1562 spectrum    1 weight  0.10000E+01 volume  0.27540E-01 ppm1      3.797 ppm2      3.613 CV     1
 ASSI { 1566}
   (( segid "T22D" and resid 116  and name HD2 ))
   (( segid "T22D" and resid 115  and name HB2 ))
      3.800     1.800     1.800 peak  1566 spectrum    1 weight  0.10000E+01 volume  0.21995E-02 ppm1      3.613 ppm2      1.691 CV     1
 ASSI { 1568}
   (( segid "T22D" and resid 96   and name HD1 ))
   (( segid "T22D" and resid 96   and name HB1 ))
      3.100     1.200     1.200 peak  1568 spectrum    1 weight  0.10000E+01 volume  0.14894E-02 ppm1      4.011 ppm2      2.497 CV     1
 ASSI { 1569}
   (( segid "T22D" and resid 96   and name HD1 ))
   (( segid "T22D" and resid 96   and name HD2 ))
      1.900     0.500     0.500 peak  1569 spectrum    1 weight  0.10000E+01 volume  0.90796E-02 ppm1      4.018 ppm2      4.107 CV     1
 ASSI { 1570}
   (( segid "T22D" and resid 96   and name HD2 ))
   (( segid "T22D" and resid 96   and name HB2 ))
      4.100     2.100     1.900 peak  1570 spectrum    1 weight  0.10000E+01 volume  0.11370E-02 ppm1      4.115 ppm2      2.158 CV     1
 ASSI { 1573}
   (( segid "T22D" and resid 96   and name HD2 ))
   (( segid "T22D" and resid 96   and name HB1 ))
      3.700     1.700     1.700 peak  1573 spectrum    1 weight  0.10000E+01 volume  0.19358E-02 ppm1      4.095 ppm2      2.498 CV     1
 ASSI { 1576}
   (( segid "T22D" and resid 96   and name HD2 ))
   (( segid "T22D" and resid 95   and name HB2 ))
      5.100     3.200     0.900 peak  1576 spectrum    1 weight  0.10000E+01 volume  0.44333E-03 ppm1      4.122 ppm2      2.822 CV     1
 ASSI { 1577}
   (( segid "T22D" and resid 96   and name HD1 ))
   (( segid "T22D" and resid 95   and name HB2 ))
      5.100     3.200     0.900 peak  1577 spectrum    1 weight  0.10000E+01 volume  0.43107E-03 ppm1      4.014 ppm2      2.817 CV     1
 ASSI { 1582}
   (( segid "T22D" and resid 105  and name HA  ))
   (  segid "T22D" and resid 105  and name HB% )
      2.400     0.700     0.700 peak  1582 spectrum    1 weight  0.10000E+01 volume  0.55763E-02 ppm1      4.754 ppm2      1.310 CV     1
 ASSI { 1585}
   (( segid "T22D" and resid 97   and name HA  ))
   (( segid "T22D" and resid 106  and name HA  ))
      3.000     1.100     1.100 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.18428E-02 ppm1      6.037 ppm2      5.434 CV     1
 ASSI { 1589}
   (( segid "T22D" and resid 97   and name HA  ))
   (( segid "T22D" and resid 98   and name HD2 ))
      2.400     0.700     0.700 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.35561E-02 ppm1      6.046 ppm2      3.171 CV     1
 ASSI { 1592}
   (( segid "T22D" and resid 97   and name HA  ))
   (  segid "T22D" and resid 107  and name HG2%)
      4.200     2.200     1.800 peak  1592 spectrum    1 weight  0.10000E+01 volume  0.67869E-03 ppm1      6.029 ppm2      1.023 CV     1
 OR { 1592}
   (( segid "T22D" and resid 97   and name HA  ))
   (  segid "T22D" and resid 107  and name HG1%)
 ASSI { 1593}
   (( segid "T22D" and resid 97   and name HA  ))
   (( segid "T22D" and resid 104  and name HG2 ))
      3.500     1.600     1.600 peak  1593 spectrum    1 weight  0.10000E+01 volume  0.72456E-03 ppm1      6.048 ppm2      1.600 CV     1
 OR { 1593}
   (( segid "T22D" and resid 97   and name HA  ))
   (( segid "T22D" and resid 104  and name HG1 ))
 OR { 1593}
   (( segid "T22D" and resid 97   and name HA  ))
   (( segid "T22D" and resid 104  and name HD2 ))
 OR { 1593}
   (( segid "T22D" and resid 97   and name HA  ))
   (( segid "T22D" and resid 104  and name HD1 ))
 OR { 1593}
   (( segid "T22D" and resid 97   and name HA  ))
   (  segid "T22D" and resid 104  and name HZ% )
 OR { 1593}
   (( segid "T22D" and resid 97   and name HA  ))
   (( segid "T22D" and resid 104  and name HB2 ))
 OR { 1593}
   (( segid "T22D" and resid 97   and name HA  ))
   (( segid "T22D" and resid 104  and name HB1 ))
 ASSI { 1594}
   (( segid "T22D" and resid 105  and name HA  ))
   (( segid "T22D" and resid 104  and name HA  ))
      4.000     2.000     2.000 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.81538E-03 ppm1      4.749 ppm2      4.126 CV     1
 ASSI { 1599}
   (( segid "T22D" and resid 64   and name HA  ))
   (  segid "T22D" and resid 65   and name HG2%)
      3.600     1.600     1.600 peak  1599 spectrum    1 weight  0.10000E+01 volume  0.22560E-02 ppm1      5.259 ppm2      0.937 CV     1
 ASSI { 1603}
   (( segid "T22D" and resid 114  and name HA  ))
   (( segid "3T5T" and resid 5    and name H2''))
      3.500     1.600     1.600 peak  1603 spectrum    1 weight  0.10000E+01 volume  0.86780E-03 ppm1      4.006 ppm2      2.439 CV     1
 ASSI { 1607}
   (( segid "T22D" and resid 114  and name HA  ))
   (( segid "3T5T" and resid 5    and name H71 ))
      3.600     1.600     1.600 peak  1607 spectrum    1 weight  0.10000E+01 volume  0.83211E-03 ppm1      4.012 ppm2      1.149 CV     1
 OR { 1607}
   (( segid "T22D" and resid 114  and name HA  ))
   (( segid "3T5T" and resid 5    and name H72 ))
 OR { 1607}
   (( segid "T22D" and resid 114  and name HA  ))
   (( segid "3T5T" and resid 5    and name H73 ))
 ASSI { 1608}
   (( segid "T22D" and resid 114  and name HA  ))
   (( segid "3T5T" and resid 5    and name H1' ))
      3.600     1.600     1.600 peak  1608 spectrum    1 weight  0.10000E+01 volume  0.74299E-03 ppm1      4.005 ppm2      6.575 CV     1
 ASSI { 1609}
   (( segid "T22D" and resid 85   and name HA  ))
   (  segid "T22D" and resid 35   and name HG2%)
      2.800     1.000     1.000 peak  1609 spectrum    1 weight  0.10000E+01 volume  0.32730E-02 ppm1      4.882 ppm2      0.798 CV     1
 ASSI { 1610}
   (( segid "T22D" and resid 85   and name HA  ))
   (( segid "T22D" and resid 85   and name HB2 ))
      2.300     2.300     3.700 peak  1610 spectrum    1 weight  0.10000E+01 volume  0.90792E-02 ppm1      4.885 ppm2      2.737 CV     1
 ASSI { 1611}
   (( segid "T22D" and resid 85   and name HA  ))
   (( segid "T22D" and resid 86   and name HB2 ))
      5.100     3.200     0.900 peak  1611 spectrum    1 weight  0.10000E+01 volume  0.46489E-03 ppm1      4.877 ppm2      1.915 CV     1
 ASSI { 1613}
   (( segid "T22D" and resid 85   and name HA  ))
   (( segid "T22D" and resid 85   and name HB1 ))
      2.400     0.700     0.700 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.91722E-02 ppm1      4.882 ppm2      2.998 CV     1
 ASSI { 1614}
   (( segid "T22D" and resid 42   and name HA  ))
   (( segid "T22D" and resid 43   and name HD1 ))
      2.700     0.900     0.900 peak  1614 spectrum    1 weight  0.10000E+01 volume  0.23037E-02 ppm1      4.322 ppm2      3.795 CV     1
 ASSI { 1615}
   (( segid "T22D" and resid 42   and name HA  ))
   (( segid "T22D" and resid 43   and name HD2 ))
      2.400     0.700     0.700 peak  1615 spectrum    1 weight  0.10000E+01 volume  0.24438E-02 ppm1      4.321 ppm2      3.897 CV     1
 ASSI { 1622}
   (( segid "T22D" and resid 42   and name HA  ))
   (( segid "T22D" and resid 43   and name HG2 ))
      4.800     2.900     1.200 peak  1622 spectrum    1 weight  0.10000E+01 volume  0.57377E-03 ppm1      4.296 ppm2      1.800 CV     1
 ASSI { 1624}
   (( segid "T22D" and resid 42   and name HA  ))
   (( segid "T22D" and resid 43   and name HB1 ))
      4.800     2.900     1.200 peak  1624 spectrum    1 weight  0.10000E+01 volume  0.47644E-03 ppm1      4.334 ppm2      2.058 CV     1
 ASSI { 1625}
   (( segid "T22D" and resid 42   and name HA  ))
   (( segid "T22D" and resid 42   and name HG  ))
      3.200     1.300     1.300 peak  1625 spectrum    1 weight  0.10000E+01 volume  0.10231E-02 ppm1      4.320 ppm2      1.258 CV     1
 ASSI { 1628}
   (( segid "T22D" and resid 83   and name HA  ))
   (  segid "T22D" and resid 89   and name HB% )
      4.800     2.800     1.200 peak  1628 spectrum    1 weight  0.10000E+01 volume  0.65183E-03 ppm1      5.077 ppm2      1.591 CV     1
 ASSI { 1629}
   (( segid "T22D" and resid 83   and name HA  ))
   (( segid "T22D" and resid 62   and name HB1 ))
      4.500     2.600     1.500 peak  1629 spectrum    1 weight  0.10000E+01 volume  0.52389E-03 ppm1      5.089 ppm2      1.705 CV     1
 ASSI { 1630}
   (( segid "T22D" and resid 83   and name HA  ))
   (( segid "T22D" and resid 61   and name HG11))
      4.300     2.300     1.700 peak  1630 spectrum    1 weight  0.10000E+01 volume  0.56847E-03 ppm1      5.080 ppm2      1.520 CV     1
 ASSI { 1632}
   (( segid "T22D" and resid 83   and name HA  ))
   (( segid "T22D" and resid 61   and name HG12))
      3.800     1.800     1.800 peak  1632 spectrum    1 weight  0.10000E+01 volume  0.51847E-03 ppm1      5.063 ppm2      0.912 CV     1
 ASSI { 1633}
   (( segid "T22D" and resid 83   and name HA  ))
   (  segid "T22D" and resid 81   and name HG1%)
      4.000     2.000     2.000 peak  1633 spectrum    1 weight  0.10000E+01 volume  0.40189E-03 ppm1      5.102 ppm2      0.524 CV     1
 ASSI { 1634}
   (( segid "T22D" and resid 83   and name HA  ))
   (( segid "T22D" and resid 83   and name HB1 ))
      2.300     0.700     0.700 peak  1634 spectrum    1 weight  0.10000E+01 volume  0.35131E-02 ppm1      5.091 ppm2      2.560 CV     1
 ASSI { 1635}
   (( segid "T22D" and resid 83   and name HA  ))
   (( segid "T22D" and resid 83   and name HB2 ))
      3.100     1.200     1.200 peak  1635 spectrum    1 weight  0.10000E+01 volume  0.16985E-02 ppm1      5.090 ppm2      1.993 CV     1
 ASSI { 1636}
   (( segid "T22D" and resid 106  and name HA  ))
   (( segid "T22D" and resid 106  and name HB1 ))
      2.700     0.900     0.900 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.24433E-02 ppm1      5.432 ppm2      2.768 CV     1
 ASSI { 1637}
   (( segid "T22D" and resid 83   and name HA  ))
   (( segid "T22D" and resid 61   and name HA  ))
      2.100     0.600     0.600 peak  1637 spectrum    1 weight  0.10000E+01 volume  0.71760E-02 ppm1      5.092 ppm2      4.111 CV     1
 ASSI { 1639}
   (( segid "T22D" and resid 106  and name HA  ))
   (( segid "T22D" and resid 106  and name HB2 ))
      2.800     1.000     1.000 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.36624E-02 ppm1      5.431 ppm2      2.824 CV     1
 ASSI { 1643}
   (( segid "T22D" and resid 108  and name HA  ))
   (  segid "T22D" and resid 107  and name HG1%)
      3.700     1.700     1.700 peak  1643 spectrum    1 weight  0.10000E+01 volume  0.48936E-03 ppm1      4.933 ppm2      1.042 CV     1
 ASSI { 1644}
   (( segid "T22D" and resid 108  and name HA  ))
   (  segid "T22D" and resid 37   and name HG2%)
      3.900     1.900     1.900 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.43507E-03 ppm1      4.946 ppm2      0.678 CV     1
 ASSI { 1647}
   (( segid "T22D" and resid 108  and name HA  ))
   (( segid "T22D" and resid 108  and name HB1 ))
      2.200     0.600     0.600 peak  1647 spectrum    1 weight  0.10000E+01 volume  0.81822E-02 ppm1      4.935 ppm2      3.004 CV     1
 ASSI { 1648}
   (( segid "T22D" and resid 92   and name HA  ))
   (( segid "T22D" and resid 58   and name HB1 ))
      3.800     1.800     1.800 peak  1648 spectrum    1 weight  0.10000E+01 volume  0.49303E-03 ppm1      1.953 ppm2      2.908 CV     1
 ASSI { 1649}
   (( segid "T22D" and resid 92   and name HA  ))
   (( segid "T22D" and resid 58   and name HB2 ))
      4.000     2.000     2.000 peak  1649 spectrum    1 weight  0.10000E+01 volume  0.59049E-03 ppm1      1.948 ppm2      3.659 CV     1
 ASSI { 1650}
   (( segid "T22D" and resid 119  and name HA  ))
   (( segid "T22D" and resid 119  and name HB2 ))
      2.700     0.900     0.900 peak  1650 spectrum    1 weight  0.10000E+01 volume  0.43094E-02 ppm1      4.753 ppm2      2.831 CV     1
 ASSI { 1651}
   (( segid "T22D" and resid 92   and name HA  ))
   (  segid "T22D" and resid 55   and name HE% )
      4.000     2.000     2.000 peak  1651 spectrum    1 weight  0.10000E+01 volume  0.82860E-03 ppm1      1.919 ppm2      7.296 CV     1
 ASSI { 1652}
   (( segid "T22D" and resid 119  and name HA  ))
   (( segid "T22D" and resid 119  and name HB1 ))
      2.700     0.900     0.900 peak  1652 spectrum    1 weight  0.10000E+01 volume  0.38954E-02 ppm1      4.749 ppm2      2.757 CV     1
 ASSI { 1654}
   (( segid "T22D" and resid 92   and name HA  ))
   (  segid "T22D" and resid 58   and name HD% )
      3.400     1.400     1.400 peak  1654 spectrum    1 weight  0.10000E+01 volume  0.98361E-03 ppm1      1.921 ppm2      7.360 CV     1
 ASSI { 1656}
   (( segid "T22D" and resid 92   and name HA  ))
   (( segid "T22D" and resid 58   and name HZ  ))
      3.500     1.500     1.500 peak  1656 spectrum    1 weight  0.10000E+01 volume  0.94120E-03 ppm1      1.922 ppm2      7.243 CV     1
 ASSI { 1657}
   (( segid "T22D" and resid 92   and name HA  ))
   (  segid "T22D" and resid 58   and name HE% )
      3.500     1.500     1.500 peak  1657 spectrum    1 weight  0.10000E+01 volume  0.81026E-03 ppm1      1.927 ppm2      6.967 CV     1
 ASSI { 1661}
   (( segid "T22D" and resid 69   and name HA  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      2.600     0.800     0.800 peak  1661 spectrum    1 weight  0.10000E+01 volume  0.64879E-02 ppm1      4.614 ppm2      2.494 CV     1
 ASSI { 1662}
   (( segid "T22D" and resid 69   and name HA  ))
   (( segid "T22D" and resid 69   and name HB2 ))
      2.400     0.700     0.700 peak  1662 spectrum    1 weight  0.10000E+01 volume  0.54616E-02 ppm1      4.615 ppm2      3.085 CV     1
 ASSI { 1663}
   (( segid "T22D" and resid 115  and name HA  ))
   (( segid "T22D" and resid 115  and name HG1 ))
      3.200     1.300     1.300 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.17867E-02 ppm1      4.541 ppm2      1.409 CV     1
 ASSI { 1665}
   (( segid "T22D" and resid 115  and name HA  ))
   (( segid "T22D" and resid 115  and name HG2 ))
      3.000     1.100     1.100 peak  1665 spectrum    1 weight  0.10000E+01 volume  0.14535E-02 ppm1      4.530 ppm2      1.499 CV     1
 ASSI { 1666}
   (( segid "T22D" and resid 115  and name HA  ))
   (( segid "T22D" and resid 116  and name HG1 ))
      4.800     2.800     1.200 peak  1666 spectrum    1 weight  0.10000E+01 volume  0.86580E-03 ppm1      4.539 ppm2      2.024 CV     1
 OR { 1666}
   (( segid "T22D" and resid 115  and name HA  ))
   (( segid "T22D" and resid 116  and name HG2 ))
 ASSI { 1668}
   (( segid "T22D" and resid 115  and name HA  ))
   (  segid "T22D" and resid 114  and name HB% )
      2.800     2.800     3.200 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.86626E-03 ppm1      4.553 ppm2      1.284 CV     1
 ASSI { 1669}
   (( segid "T22D" and resid 115  and name HA  ))
   (( segid "T22D" and resid 115  and name HB2 ))
      2.700     0.900     0.900 peak  1669 spectrum    1 weight  0.10000E+01 volume  0.58828E-02 ppm1      4.550 ppm2      1.688 CV     1
 ASSI { 1670}
   (( segid "T22D" and resid 103  and name HA  ))
   (( segid "T22D" and resid 103  and name HB2 ))
      2.500     0.800     0.800 peak  1670 spectrum    1 weight  0.10000E+01 volume  0.34987E-02 ppm1      4.605 ppm2      1.488 CV     1
 ASSI { 1671}
   (( segid "T22D" and resid 103  and name HA  ))
   (( segid "T22D" and resid 103  and name HG1 ))
      2.700     0.900     0.900 peak  1671 spectrum    1 weight  0.10000E+01 volume  0.35199E-02 ppm1      4.606 ppm2      1.458 CV     1
 ASSI { 1672}
   (( segid "T22D" and resid 103  and name HA  ))
   (( segid "T22D" and resid 104  and name HB2 ))
      4.500     2.500     1.500 peak  1672 spectrum    1 weight  0.10000E+01 volume  0.70700E-03 ppm1      4.611 ppm2      1.587 CV     1
 ASSI { 1674}
   (( segid "T22D" and resid 103  and name HA  ))
   (  segid "T22D" and resid 99   and name HD1%)
      4.200     2.200     1.800 peak  1674 spectrum    1 weight  0.10000E+01 volume  0.41475E-03 ppm1      4.593 ppm2      0.700 CV     1
 ASSI { 1676}
   (( segid "T22D" and resid 103  and name HA  ))
   (( segid "T22D" and resid 103  and name HD1 ))
      4.100     2.100     1.900 peak  1676 spectrum    1 weight  0.10000E+01 volume  0.54750E-03 ppm1      4.606 ppm2      2.728 CV     1
 ASSI { 1677}
   (( segid "T22D" and resid 103  and name HA  ))
   (( segid "T22D" and resid 103  and name HB1 ))
      3.000     1.100     1.100 peak  1677 spectrum    1 weight  0.10000E+01 volume  0.27483E-02 ppm1      4.617 ppm2      1.671 CV     1
 ASSI { 1678}
   (( segid "T22D" and resid 103  and name HA  ))
   (( segid "T22D" and resid 103  and name HG2 ))
      3.200     1.300     1.300 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.30493E-02 ppm1      4.617 ppm2      1.783 CV     1
 ASSI { 1679}
   (( segid "T22D" and resid 103  and name HA  ))
   (( segid "T22D" and resid 103  and name HD2 ))
      3.500     1.500     1.500 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.50233E-03 ppm1      4.599 ppm2      2.894 CV     1
 ASSI { 1683}
   (( segid "T22D" and resid 60   and name HA  ))
   (( segid "T22D" and resid 61   and name HG11))
      3.500     1.600     1.600 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.11093E-02 ppm1      4.726 ppm2      1.533 CV     1
 ASSI { 1684}
   (( segid "T22D" and resid 60   and name HA  ))
   (( segid "T22D" and resid 61   and name HB  ))
      4.700     2.700     1.300 peak  1684 spectrum    1 weight  0.10000E+01 volume  0.77760E-03 ppm1      4.713 ppm2      1.471 CV     1
 ASSI { 1685}
   (( segid "T22D" and resid 60   and name HA  ))
   (( segid "T22D" and resid 84   and name HB1 ))
      4.000     2.000     2.000 peak  1685 spectrum    1 weight  0.10000E+01 volume  0.15596E-02 ppm1      4.715 ppm2      1.707 CV     1
 OR { 1685}
   (( segid "T22D" and resid 60   and name HA  ))
   (( segid "T22D" and resid 84   and name HD2 ))
 OR { 1685}
   (( segid "T22D" and resid 60   and name HA  ))
   (( segid "T22D" and resid 84   and name HD1 ))
 ASSI { 1686}
   (( segid "T22D" and resid 31   and name HA  ))
   (( segid "T22D" and resid 31   and name HB1 ))
      2.400     0.700     0.700 peak  1686 spectrum    1 weight  0.10000E+01 volume  0.91588E-02 ppm1      4.652 ppm2      2.654 CV     1
 ASSI { 1689}
   (( segid "T22D" and resid 31   and name HA  ))
   (  segid "T22D" and resid 32   and name HG2%)
      4.100     2.100     1.900 peak  1689 spectrum    1 weight  0.10000E+01 volume  0.60780E-03 ppm1      4.642 ppm2      1.069 CV     1
 ASSI { 1690}
   (( segid "T22D" and resid 78   and name HA  ))
   (( segid "T22D" and resid 78   and name HB2 ))
      2.900     1.100     1.100 peak  1690 spectrum    1 weight  0.10000E+01 volume  0.15880E-02 ppm1      4.989 ppm2      2.482 CV     1
 ASSI { 1691}
   (( segid "T22D" and resid 78   and name HA  ))
   (( segid "T22D" and resid 78   and name HB1 ))
      2.800     1.000     1.000 peak  1691 spectrum    1 weight  0.10000E+01 volume  0.14098E-02 ppm1      4.988 ppm2      2.378 CV     1
 ASSI { 1692}
   (( segid "T22D" and resid 78   and name HA  ))
   (( segid "T22D" and resid 79   and name HA1 ))
      4.000     2.000     2.000 peak  1692 spectrum    1 weight  0.10000E+01 volume  0.59766E-03 ppm1      4.982 ppm2      3.786 CV     1
 ASSI { 1696}
   (( segid "T22D" and resid 78   and name HA  ))
   (  segid "T22D" and resid 78   and name HD% )
      4.600     2.600     1.400 peak  1696 spectrum    1 weight  0.10000E+01 volume  0.38505E-03 ppm1      4.997 ppm2      6.399 CV     1
 ASSI { 1697}
   (( segid "T22D" and resid 101  and name HA  ))
   (( segid "T22D" and resid 101  and name HB1 ))
      2.500     0.800     0.800 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.70258E-02 ppm1      4.229 ppm2      2.234 CV     1
 ASSI { 1700}
   (( segid "T22D" and resid 71   and name HA  ))
   (  segid "T22D" and resid 72   and name HG2%)
      4.000     2.000     2.000 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.10599E-02 ppm1      4.733 ppm2      1.175 CV     1
 ASSI { 1702}
   (( segid "T22D" and resid 71   and name HA  ))
   (( segid "T22D" and resid 70   and name HB1 ))
      3.300     1.400     1.400 peak  1702 spectrum    1 weight  0.10000E+01 volume  0.85859E-03 ppm1      4.721 ppm2      1.859 CV     1
 ASSI { 1703}
   (( segid "T22D" and resid 87   and name HA  ))
   (( segid "T22D" and resid 86   and name HG1 ))
      3.700     1.700     1.700 peak  1703 spectrum    1 weight  0.10000E+01 volume  0.15237E-02 ppm1      4.244 ppm2      1.648 CV     1
 ASSI { 1706}
   (( segid "T22D" and resid 87   and name HA  ))
   (( segid "T22D" and resid 90   and name HB1 ))
      2.600     0.800     0.800 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.36549E-02 ppm1      4.236 ppm2      2.095 CV     1
 ASSI { 1708}
   (( segid "T22D" and resid 74   and name HA  ))
   (( segid "T22D" and resid 74   and name HG1 ))
      2.700     0.900     0.900 peak  1708 spectrum    1 weight  0.10000E+01 volume  0.44533E-02 ppm1      4.365 ppm2      1.384 CV     1
 OR { 1708}
   (( segid "T22D" and resid 74   and name HA  ))
   (( segid "T22D" and resid 74   and name HG2 ))
 ASSI { 1710}
   (( segid "T22D" and resid 74   and name HA  ))
   (( segid "T22D" and resid 74   and name HD2 ))
      2.300     0.700     0.700 peak  1710 spectrum    1 weight  0.10000E+01 volume  0.56351E-02 ppm1      4.365 ppm2      1.591 CV     1
 OR { 1710}
   (( segid "T22D" and resid 74   and name HA  ))
   (( segid "T22D" and resid 74   and name HB1 ))
 OR { 1710}
   (( segid "T22D" and resid 74   and name HA  ))
   (( segid "T22D" and resid 74   and name HD1 ))
 ASSI { 1711}
   (( segid "T22D" and resid 47   and name HA  ))
   (  segid "T22D" and resid 66   and name HG2%)
      2.700     0.900     0.900 peak  1711 spectrum    1 weight  0.10000E+01 volume  0.23514E-02 ppm1      4.842 ppm2      0.590 CV     1
 ASSI { 1713}
   (( segid "T22D" and resid 110  and name HA  ))
   (( segid "T22D" and resid 38   and name HA  ))
      3.900     1.900     1.900 peak  1713 spectrum    1 weight  0.10000E+01 volume  0.14140E-02 ppm1      4.125 ppm2      4.589 CV     1
 ASSI { 1714}
   (( segid "T22D" and resid 27   and name HA  ))
   (( segid "T22D" and resid 27   and name HG2 ))
      3.600     1.600     1.600 peak  1714 spectrum    1 weight  0.10000E+01 volume  0.84941E-03 ppm1      4.440 ppm2      2.578 CV     1
 OR { 1714}
   (( segid "T22D" and resid 27   and name HA  ))
   (( segid "T22D" and resid 27   and name HG1 ))
 ASSI { 1715}
   (( segid "T22D" and resid 47   and name HA  ))
   (( segid "T22D" and resid 47   and name HB2 ))
      2.300     0.600     0.600 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.82260E-02 ppm1      4.844 ppm2      4.433 CV     1
 ASSI { 1716}
   (( segid "T22D" and resid 45   and name HA  ))
   (( segid "T22D" and resid 45   and name HB1 ))
      2.400     0.700     0.700 peak  1716 spectrum    1 weight  0.10000E+01 volume  0.61134E-02 ppm1      4.789 ppm2      3.063 CV     1
 ASSI { 1717}
   (( segid "T22D" and resid 47   and name HA  ))
   (( segid "T22D" and resid 47   and name HB1 ))
      2.200     0.600     0.600 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.86826E-02 ppm1      4.843 ppm2      3.986 CV     1
 ASSI { 1718}
   (( segid "T22D" and resid 110  and name HA  ))
   (( segid "T22D" and resid 38   and name HB1 ))
      2.700     0.900     0.900 peak  1718 spectrum    1 weight  0.10000E+01 volume  0.32023E-02 ppm1      4.129 ppm2      2.620 CV     1
 ASSI { 1719}
   (( segid "T22D" and resid 45   and name HA  ))
   (( segid "T22D" and resid 45   and name HB2 ))
      2.700     0.900     0.900 peak  1719 spectrum    1 weight  0.10000E+01 volume  0.56989E-02 ppm1      4.789 ppm2      3.438 CV     1
 ASSI { 1721}
   (( segid "T22D" and resid 110  and name HA  ))
   (  segid "T22D" and resid 38   and name HD% )
      4.100     2.100     1.900 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.96009E-03 ppm1      4.127 ppm2      6.690 CV     1
 ASSI { 1725}
   (( segid "T22D" and resid 74   and name HA  ))
   (  segid "T22D" and resid 68   and name HG2%)
      3.400     1.500     1.500 peak  1725 spectrum    1 weight  0.10000E+01 volume  0.13093E-02 ppm1      4.363 ppm2      0.967 CV     1
 ASSI { 1727}
   (( segid "T22D" and resid 47   and name HA  ))
   (  segid "T22D" and resid 66   and name HG1%)
      4.000     2.000     2.000 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.73886E-03 ppm1      4.837 ppm2      0.712 CV     1
 ASSI { 1728}
   (( segid "T22D" and resid 63   and name HA  ))
   (( segid "T22D" and resid 63   and name HB2 ))
      2.400     0.700     0.700 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.46272E-02 ppm1      4.534 ppm2      2.114 CV     1
 ASSI { 1730}
   (( segid "T22D" and resid 27   and name HA  ))
   (( segid "T22D" and resid 27   and name HB1 ))
      2.900     1.000     1.000 peak  1730 spectrum    1 weight  0.10000E+01 volume  0.25431E-02 ppm1      4.430 ppm2      1.996 CV     1
 ASSI { 1732}
   (( segid "T22D" and resid 27   and name HA  ))
   (( segid "T22D" and resid 27   and name HB2 ))
      2.700     0.900     0.900 peak  1732 spectrum    1 weight  0.10000E+01 volume  0.40880E-02 ppm1      4.435 ppm2      2.056 CV     1
 ASSI { 1733}
   (( segid "T22D" and resid 63   and name HA  ))
   (( segid "T22D" and resid 63   and name HB1 ))
      2.700     0.900     0.900 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.55367E-02 ppm1      4.533 ppm2      1.987 CV     1
 ASSI { 1734}
   (( segid "T22D" and resid 89   and name HA  ))
   (( segid "T22D" and resid 37   and name HG12))
      4.400     2.400     1.600 peak  1734 spectrum    1 weight  0.10000E+01 volume  0.52193E-03 ppm1      4.097 ppm2      0.518 CV     1
 ASSI { 1736}
   (( segid "T22D" and resid 63   and name HA  ))
   (( segid "T22D" and resid 63   and name HG2 ))
      3.000     1.100     1.100 peak  1736 spectrum    1 weight  0.10000E+01 volume  0.46130E-02 ppm1      4.535 ppm2      2.356 CV     1
 ASSI { 1737}
   (( segid "T22D" and resid 89   and name HA  ))
   (( segid "T22D" and resid 83   and name HG1 ))
      2.200     0.600     0.600 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.22286E-02 ppm1      4.112 ppm2      2.250 CV     1
 ASSI { 1738}
   (( segid "T22D" and resid 89   and name HA  ))
   (( segid "T22D" and resid 83   and name HB2 ))
      4.000     2.000     2.000 peak  1738 spectrum    1 weight  0.10000E+01 volume  0.83207E-03 ppm1      4.101 ppm2      1.996 CV     1
 ASSI { 1739}
   (( segid "T22D" and resid 74   and name HA  ))
   (( segid "T22D" and resid 74   and name HB2 ))
      2.500     0.800     0.800 peak  1739 spectrum    1 weight  0.10000E+01 volume  0.79574E-02 ppm1      4.384 ppm2      1.775 CV     1
 ASSI { 1740}
   (( segid "T22D" and resid 27   and name HA  ))
   (( segid "T22D" and resid 27   and name HG2 ))
      3.300     1.400     1.400 peak  1740 spectrum    1 weight  0.10000E+01 volume  0.12706E-02 ppm1      4.424 ppm2      2.505 CV     1
 ASSI { 1741}
   (( segid "T22D" and resid 63   and name HA  ))
   (( segid "T22D" and resid 62   and name HB1 ))
      3.600     1.700     1.700 peak  1741 spectrum    1 weight  0.10000E+01 volume  0.10807E-02 ppm1      4.537 ppm2      1.695 CV     1
 ASSI { 1742}
   (( segid "T22D" and resid 63   and name HA  ))
   (( segid "T22D" and resid 62   and name HB2 ))
      4.600     2.600     1.400 peak  1742 spectrum    1 weight  0.10000E+01 volume  0.65642E-03 ppm1      4.534 ppm2      1.797 CV     1
 ASSI { 1743}
   (( segid "T22D" and resid 47   and name HA  ))
   (  segid "T22D" and resid 46   and name HG2%)
      3.700     1.700     1.700 peak  1743 spectrum    1 weight  0.10000E+01 volume  0.74441E-03 ppm1      4.848 ppm2      1.135 CV     1
 ASSI { 1748}
   (( segid "T22D" and resid 80   and name HA  ))
   (  segid "T22D" and resid 39   and name HG2%)
      3.400     1.400     1.400 peak  1748 spectrum    1 weight  0.10000E+01 volume  0.75692E-03 ppm1      5.583 ppm2      0.595 CV     1
 ASSI { 1750}
   (( segid "T22D" and resid 117  and name HA  ))
   (( segid "T22D" and resid 117  and name HB2 ))
      2.500     0.800     0.800 peak  1750 spectrum    1 weight  0.10000E+01 volume  0.67314E-02 ppm1      4.406 ppm2      1.872 CV     1
 ASSI { 1751}
   (( segid "T22D" and resid 80   and name HA  ))
   (  segid "T22D" and resid 80   and name HD% )
      3.100     1.200     1.200 peak  1751 spectrum    1 weight  0.10000E+01 volume  0.13179E-02 ppm1      5.587 ppm2      6.610 CV     1
 ASSI { 1753}
   (( segid "T22D" and resid 80   and name HA  ))
   (( segid "T22D" and resid 80   and name HB2 ))
      3.000     1.100     1.100 peak  1753 spectrum    1 weight  0.10000E+01 volume  0.23645E-02 ppm1      5.585 ppm2      2.779 CV     1
 ASSI { 1756}
   (( segid "T22D" and resid 80   and name HA  ))
   (  segid "T22D" and resid 65   and name HG2%)
      4.000     2.000     2.000 peak  1756 spectrum    1 weight  0.10000E+01 volume  0.84791E-03 ppm1      5.583 ppm2      0.935 CV     1
 ASSI { 1759}
   (( segid "T22D" and resid 30   and name HA  ))
   (( segid "T22D" and resid 30   and name HG1 ))
      3.000     1.200     1.200 peak  1759 spectrum    1 weight  0.10000E+01 volume  0.38144E-02 ppm1      4.314 ppm2      1.584 CV     1
 ASSI { 1761}
   (( segid "T22D" and resid 76   and name HA  ))
   (( segid "T22D" and resid 76   and name HG2 ))
      2.700     0.900     0.900 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.21675E-02 ppm1      4.580 ppm2      1.502 CV     1
 ASSI { 1764}
   (( segid "T22D" and resid 76   and name HA  ))
   (  segid "T22D" and resid 44   and name HE% )
      3.300     1.400     1.400 peak  1764 spectrum    1 weight  0.10000E+01 volume  0.98828E-03 ppm1      4.582 ppm2      6.022 CV     1
 ASSI { 1765}
   (( segid "T22D" and resid 76   and name HA  ))
   (( segid "T22D" and resid 76   and name HB1 ))
      2.700     0.900     0.900 peak  1765 spectrum    1 weight  0.10000E+01 volume  0.21858E-02 ppm1      4.573 ppm2      1.332 CV     1
 ASSI { 1768}
   (( segid "T22D" and resid 112  and name HA  ))
   (  segid "T22D" and resid 111  and name HE% )
      3.800     1.800     1.800 peak  1768 spectrum    1 weight  0.10000E+01 volume  0.10563E-02 ppm1      3.665 ppm2      6.728 CV     1
 ASSI { 1770}
   (( segid "T22D" and resid 76   and name HA  ))
   (( segid "T22D" and resid 76   and name HG1 ))
      3.000     1.100     1.100 peak  1770 spectrum    1 weight  0.10000E+01 volume  0.33085E-02 ppm1      4.580 ppm2      1.731 CV     1
 ASSI { 1771}
   (( segid "T22D" and resid 76   and name HA  ))
   (( segid "T22D" and resid 76   and name HB2 ))
      3.100     1.200     1.200 peak  1771 spectrum    1 weight  0.10000E+01 volume  0.26112E-02 ppm1      4.580 ppm2      2.297 CV     1
 ASSI { 1773}
   (( segid "T22D" and resid 112  and name HA  ))
   (  segid "T22D" and resid 111  and name HD% )
      3.500     1.500     1.500 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.11840E-02 ppm1      3.659 ppm2      7.098 CV     1
 ASSI { 1775}
   (( segid "T22D" and resid 76   and name HA  ))
   (( segid "T22D" and resid 76   and name HD1 ))
      4.300     2.300     1.700 peak  1775 spectrum    1 weight  0.10000E+01 volume  0.10669E-02 ppm1      4.580 ppm2      3.379 CV     1
 ASSI { 1777}
   (( segid "T22D" and resid 30   and name HA  ))
   (( segid "T22D" and resid 30   and name HG2 ))
      3.000     1.100     1.100 peak  1777 spectrum    1 weight  0.10000E+01 volume  0.27346E-02 ppm1      4.292 ppm2      1.646 CV     1
 ASSI { 1781}
   (( segid "T22D" and resid 30   and name HA  ))
   (  segid "T22D" and resid 32   and name HG2%)
      4.100     2.100     1.900 peak  1781 spectrum    1 weight  0.10000E+01 volume  0.70788E-03 ppm1      4.300 ppm2      1.072 CV     1
 ASSI { 1783}
   (( segid "T22D" and resid 36   and name HA  ))
   (  segid "T22D" and resid 37   and name HD1%)
      4.600     2.700     1.400 peak  1783 spectrum    1 weight  0.10000E+01 volume  0.71101E-03 ppm1      4.957 ppm2      0.694 CV     1
 OR { 1783}
   (( segid "T22D" and resid 36   and name HA  ))
   (  segid "T22D" and resid 37   and name HG2%)
 ASSI { 1785}
   (( segid "T22D" and resid 36   and name HA  ))
   (( segid "T22D" and resid 37   and name HG12))
      5.000     3.100     1.000 peak  1785 spectrum    1 weight  0.10000E+01 volume  0.49337E-03 ppm1      4.955 ppm2      0.518 CV     1
 ASSI { 1787}
   (( segid "T22D" and resid 36   and name HA  ))
   (( segid "T22D" and resid 82   and name HA  ))
      2.500     0.800     0.800 peak  1787 spectrum    1 weight  0.10000E+01 volume  0.35075E-02 ppm1      4.958 ppm2      5.243 CV     1
 ASSI { 1789}
   (( segid "T22D" and resid 36   and name HA  ))
   (( segid "T22D" and resid 37   and name HG11))
      3.700     1.700     1.700 peak  1789 spectrum    1 weight  0.10000E+01 volume  0.92568E-03 ppm1      4.969 ppm2      1.725 CV     1
 ASSI { 1791}
   (( segid "T22D" and resid 36   and name HA  ))
   (( segid "T22D" and resid 36   and name HD2 ))
      4.300     2.300     1.700 peak  1791 spectrum    1 weight  0.10000E+01 volume  0.58544E-03 ppm1      4.974 ppm2      1.595 CV     1
 ASSI { 1792}
   (( segid "T22D" and resid 36   and name HA  ))
   (( segid "T22D" and resid 36   and name HG1 ))
      3.100     1.200     1.200 peak  1792 spectrum    1 weight  0.10000E+01 volume  0.92556E-03 ppm1      4.974 ppm2      0.958 CV     1
 ASSI { 1795}
   (( segid "T22D" and resid 109  and name HA  ))
   (( segid "T22D" and resid 109  and name HB2 ))
      2.800     1.000     1.000 peak  1795 spectrum    1 weight  0.10000E+01 volume  0.22955E-02 ppm1      4.466 ppm2      1.899 CV     1
 ASSI { 1797}
   (( segid "T22D" and resid 109  and name HA  ))
   (( segid "T22D" and resid 37   and name HG12))
      3.200     1.300     1.300 peak  1797 spectrum    1 weight  0.10000E+01 volume  0.93181E-03 ppm1      4.468 ppm2      0.521 CV     1
 ASSI { 1798}
   (( segid "T22D" and resid 109  and name HA  ))
   (  segid "T22D" and resid 111  and name HD% )
      4.700     2.700     1.300 peak  1798 spectrum    1 weight  0.10000E+01 volume  0.53440E-03 ppm1      4.482 ppm2      7.089 CV     1
 ASSI { 1799}
   (( segid "T22D" and resid 109  and name HA  ))
   (  segid "T22D" and resid 111  and name HE% )
      5.200     3.400     0.800 peak  1799 spectrum    1 weight  0.10000E+01 volume  0.39751E-03 ppm1      4.468 ppm2      6.718 CV     1
 ASSI { 1801}
   (( segid "T22D" and resid 57   and name HA  ))
   (( segid "T22D" and resid 57   and name HG1 ))
      3.400     1.500     1.500 peak  1801 spectrum    1 weight  0.10000E+01 volume  0.20320E-02 ppm1      4.074 ppm2      1.476 CV     1
 ASSI { 1804}
   (( segid "T22D" and resid 109  and name HA  ))
   (( segid "T22D" and resid 37   and name HA  ))
      2.400     0.700     0.700 peak  1804 spectrum    1 weight  0.10000E+01 volume  0.44641E-02 ppm1      4.479 ppm2      4.201 CV     1
 ASSI { 1811}
   (( segid "T22D" and resid 121  and name HA  ))
   (( segid "T22D" and resid 121  and name HB1 ))
      3.300     1.400     1.400 peak  1811 spectrum    1 weight  0.10000E+01 volume  0.11208E-02 ppm1      4.159 ppm2      2.093 CV     1
 ASSI { 1812}
   (( segid "T22D" and resid 73   and name HA  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      4.200     2.200     1.800 peak  1812 spectrum    1 weight  0.10000E+01 volume  0.51856E-03 ppm1      3.982 ppm2      2.494 CV     1
 ASSI { 1813}
   (( segid "T22D" and resid 73   and name HA  ))
   (( segid "T22D" and resid 68   and name HB  ))
      2.300     0.700     0.700 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.57802E-02 ppm1      3.975 ppm2      3.674 CV     1
 ASSI { 1814}
   (( segid "T22D" and resid 73   and name HA  ))
   (( segid "T22D" and resid 69   and name HB2 ))
      4.900     3.000     1.100 peak  1814 spectrum    1 weight  0.10000E+01 volume  0.55842E-03 ppm1      3.991 ppm2      3.090 CV     1
 ASSI { 1818}
   (( segid "T22D" and resid 104  and name HA  ))
   (( segid "T22D" and resid 104  and name HB2 ))
      2.400     0.700     0.700 peak  1818 spectrum    1 weight  0.10000E+01 volume  0.34011E-02 ppm1      4.118 ppm2      1.600 CV     1
 ASSI { 1819}
   (( segid "T22D" and resid 62   and name HA  ))
   (( segid "T22D" and resid 84   and name HE2 ))
      3.200     1.300     1.300 peak  1819 spectrum    1 weight  0.10000E+01 volume  0.11464E-02 ppm1      4.406 ppm2      2.969 CV     1
 OR { 1819}
   (( segid "T22D" and resid 62   and name HA  ))
   (( segid "T22D" and resid 84   and name HE1 ))
 ASSI { 1821}
   (( segid "T22D" and resid 121  and name HA  ))
   (( segid "3T5T" and resid 7    and name H1' ))
      3.100     3.100     2.900 peak  1821 spectrum    1 weight  0.10000E+01 volume  0.47977E-03 ppm1      4.151 ppm2      6.395 CV     1
 ASSI { 1822}
   (( segid "T22D" and resid 62   and name HA  ))
   (( segid "T22D" and resid 62   and name HB2 ))
      2.500     0.800     0.800 peak  1822 spectrum    1 weight  0.10000E+01 volume  0.45617E-02 ppm1      4.401 ppm2      1.817 CV     1
 ASSI { 1823}
   (( segid "T22D" and resid 38   and name HA  ))
   (  segid "T22D" and resid 39   and name HG2%)
      4.000     2.000     2.000 peak  1823 spectrum    1 weight  0.10000E+01 volume  0.75988E-03 ppm1      4.593 ppm2      0.591 CV     1
 ASSI { 1826}
   (( segid "T22D" and resid 62   and name HA  ))
   (( segid "T22D" and resid 84   and name HG1 ))
      3.800     1.800     1.800 peak  1826 spectrum    1 weight  0.10000E+01 volume  0.12125E-02 ppm1      4.396 ppm2      1.369 CV     1
 OR { 1826}
   (( segid "T22D" and resid 62   and name HA  ))
   (( segid "T22D" and resid 84   and name HG2 ))
 ASSI { 1828}
   (( segid "T22D" and resid 38   and name HA  ))
   (  segid "T22D" and resid 38   and name HD% )
      3.200     1.200     1.200 peak  1828 spectrum    1 weight  0.10000E+01 volume  0.99649E-03 ppm1      4.588 ppm2      6.686 CV     1
 ASSI { 1829}
   (( segid "T22D" and resid 104  and name HA  ))
   (( segid "T22D" and resid 104  and name HB1 ))
      3.100     1.200     1.200 peak  1829 spectrum    1 weight  0.10000E+01 volume  0.25075E-02 ppm1      4.125 ppm2      1.661 CV     1
 OR { 1829}
   (( segid "T22D" and resid 104  and name HA  ))
   (( segid "T22D" and resid 104  and name HD2 ))
 OR { 1829}
   (( segid "T22D" and resid 104  and name HA  ))
   (( segid "T22D" and resid 104  and name HD1 ))
 ASSI { 1830}
   (( segid "T22D" and resid 38   and name HA  ))
   (( segid "T22D" and resid 80   and name HA  ))
      3.100     1.200     1.200 peak  1830 spectrum    1 weight  0.10000E+01 volume  0.10713E-02 ppm1      4.591 ppm2      5.587 CV     1
 ASSI { 1833}
   (( segid "T22D" and resid 34   and name HA  ))
   (  segid "T22D" and resid 35   and name HG2%)
      4.300     2.300     1.700 peak  1833 spectrum    1 weight  0.10000E+01 volume  0.56155E-03 ppm1      4.958 ppm2      0.798 CV     1
 ASSI { 1834}
   (( segid "T22D" and resid 34   and name HA  ))
   (( segid "T22D" and resid 34   and name HB1 ))
      2.500     0.800     0.800 peak  1834 spectrum    1 weight  0.10000E+01 volume  0.33475E-02 ppm1      4.959 ppm2      2.741 CV     1
 ASSI { 1835}
   (( segid "T22D" and resid 34   and name HA  ))
   (  segid "T22D" and resid 34   and name HE% )
      3.900     1.900     1.900 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.10309E-02 ppm1      4.966 ppm2      7.298 CV     1
 ASSI { 1838}
   (( segid "T22D" and resid 34   and name HA  ))
   (( segid "T22D" and resid 34   and name HB2 ))
      2.700     0.900     0.900 peak  1838 spectrum    1 weight  0.10000E+01 volume  0.44587E-02 ppm1      4.960 ppm2      3.523 CV     1
 ASSI { 1840}
   (( segid "T22D" and resid 34   and name HA  ))
   (  segid "T22D" and resid 34   and name HD% )
      2.800     1.000     1.000 peak  1840 spectrum    1 weight  0.10000E+01 volume  0.31738E-02 ppm1      4.965 ppm2      7.222 CV     1
 ASSI { 1841}
   (( segid "T22D" and resid 34   and name HA  ))
   (  segid "T22D" and resid 109  and name HD2%)
      2.700     0.900     0.900 peak  1841 spectrum    1 weight  0.10000E+01 volume  0.23183E-02 ppm1      4.963 ppm2      0.884 CV     1
 ASSI { 1843}
   (( segid "T22D" and resid 34   and name HA  ))
   (( segid "T22D" and resid 33   and name HG2 ))
      4.100     2.100     1.900 peak  1843 spectrum    1 weight  0.10000E+01 volume  0.50996E-03 ppm1      4.965 ppm2      1.276 CV     1
 ASSI { 1845}
   (( segid "T22D" and resid 38   and name HA  ))
   (( segid "3T5T" and resid 5    and name H1' ))
      4.200     2.200     1.800 peak  1845 spectrum    1 weight  0.10000E+01 volume  0.85442E-03 ppm1      4.588 ppm2      6.597 CV     1
 ASSI { 1847}
   (( segid "T22D" and resid 56   and name HA  ))
   (( segid "T22D" and resid 61   and name HG11))
      2.700     0.900     0.900 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.13443E-02 ppm1      4.403 ppm2      1.531 CV     1
 ASSI { 1849}
   (( segid "T22D" and resid 48   and name HA  ))
   (( segid "T22D" and resid 48   and name HB2 ))
      2.900     1.000     1.000 peak  1849 spectrum    1 weight  0.10000E+01 volume  0.42669E-02 ppm1      4.055 ppm2      2.747 CV     1
 ASSI { 1851}
   (( segid "T22D" and resid 48   and name HA  ))
   (( segid "T22D" and resid 48   and name HB1 ))
      2.400     0.700     0.700 peak  1851 spectrum    1 weight  0.10000E+01 volume  0.50834E-02 ppm1      4.054 ppm2      2.990 CV     1
 ASSI { 1853}
   (( segid "T22D" and resid 56   and name HA  ))
   (  segid "T22D" and resid 81   and name HG2%)
      3.700     3.700     2.300 peak  1853 spectrum    1 weight  0.10000E+01 volume  0.28532E-02 ppm1      4.406 ppm2      0.289 CV     1
 ASSI { 1854}
   (( segid "T22D" and resid 70   and name HA  ))
   (( segid "T22D" and resid 71   and name HA  ))
      3.000     3.000     3.000 peak  1854 spectrum    1 weight  0.10000E+01 volume  0.23273E-02 ppm1      4.050 ppm2      4.735 CV     1
 ASSI { 1856}
   (( segid "T22D" and resid 51   and name HA  ))
   (( segid "T22D" and resid 51   and name HB2 ))
      2.600     0.900     0.900 peak  1856 spectrum    1 weight  0.10000E+01 volume  0.52152E-02 ppm1      4.125 ppm2      1.312 CV     1
 ASSI { 1859}
   (( segid "T22D" and resid 75   and name HA  ))
   (( segid "T22D" and resid 75   and name HB1 ))
      2.400     0.700     0.700 peak  1859 spectrum    1 weight  0.10000E+01 volume  0.40297E-02 ppm1      4.179 ppm2      4.028 CV     1
 ASSI { 1860}
   (( segid "T22D" and resid 75   and name HA  ))
   (( segid "T22D" and resid 75   and name HB2 ))
      2.300     0.700     0.700 peak  1860 spectrum    1 weight  0.10000E+01 volume  0.61301E-02 ppm1      4.183 ppm2      4.228 CV     1
 ASSI { 1863}
   (( segid "T22D" and resid 70   and name HA  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      4.100     2.100     1.900 peak  1863 spectrum    1 weight  0.10000E+01 volume  0.47519E-03 ppm1      4.071 ppm2      2.504 CV     1
 ASSI { 1865}
   (( segid "T22D" and resid 51   and name HA  ))
   (( segid "T22D" and resid 54   and name HB2 ))
      3.800     1.800     1.800 peak  1865 spectrum    1 weight  0.10000E+01 volume  0.73657E-03 ppm1      4.137 ppm2      3.241 CV     1
 ASSI { 1866}
   (( segid "T22D" and resid 51   and name HA  ))
   (( segid "T22D" and resid 51   and name HG  ))
      3.000     1.200     1.200 peak  1866 spectrum    1 weight  0.10000E+01 volume  0.18362E-02 ppm1      4.117 ppm2      1.464 CV     1
 ASSI { 1868}
   (( segid "T22D" and resid 51   and name HA  ))
   (  segid "T22D" and resid 46   and name HG2%)
      3.800     1.800     1.800 peak  1868 spectrum    1 weight  0.10000E+01 volume  0.13493E-02 ppm1      4.124 ppm2      1.148 CV     1
 ASSI { 1871}
   (( segid "T22D" and resid 29   and name HA  ))
   (( segid "T22D" and resid 29   and name HB2 ))
      2.400     0.700     0.700 peak  1871 spectrum    1 weight  0.10000E+01 volume  0.83261E-02 ppm1      4.415 ppm2      3.840 CV     1
 ASSI { 1872}
   (( segid "T22D" and resid 51   and name HA  ))
   (( segid "T22D" and resid 54   and name HB1 ))
      3.200     1.300     1.300 peak  1872 spectrum    1 weight  0.10000E+01 volume  0.67644E-03 ppm1      4.145 ppm2      2.894 CV     1
 ASSI { 1874}
   (( segid "T22D" and resid 51   and name HA  ))
   (  segid "T22D" and resid 100  and name HD1%)
      3.800     1.800     1.800 peak  1874 spectrum    1 weight  0.10000E+01 volume  0.55805E-03 ppm1      4.113 ppm2      0.257 CV     1
 ASSI { 1875}
   (( segid "T22D" and resid 29   and name HA  ))
   (( segid "T22D" and resid 29   and name HB1 ))
      2.400     0.700     0.700 peak  1875 spectrum    1 weight  0.10000E+01 volume  0.79274E-02 ppm1      4.415 ppm2      3.886 CV     1
 ASSI { 1877}
   (( segid "T22D" and resid 70   and name HA  ))
   (( segid "T22D" and resid 69   and name HA  ))
      3.900     1.900     1.900 peak  1877 spectrum    1 weight  0.10000E+01 volume  0.13027E-02 ppm1      4.047 ppm2      4.620 CV     1
 ASSI { 1879}
   (( segid "T22D" and resid 58   and name HA  ))
   (( segid "T22D" and resid 58   and name HB2 ))
      3.100     1.200     1.200 peak  1879 spectrum    1 weight  0.10000E+01 volume  0.26441E-02 ppm1      4.729 ppm2      3.673 CV     1
 ASSI { 1881}
   (( segid "T22D" and resid 58   and name HA  ))
   (( segid "T22D" and resid 58   and name HB1 ))
      2.900     1.000     1.000 peak  1881 spectrum    1 weight  0.10000E+01 volume  0.17568E-02 ppm1      4.722 ppm2      2.885 CV     1
 ASSI { 1883}
   (( segid "T22D" and resid 58   and name HA  ))
   (  segid "T22D" and resid 58   and name HD% )
      3.000     1.100     1.100 peak  1883 spectrum    1 weight  0.10000E+01 volume  0.24250E-02 ppm1      4.720 ppm2      7.365 CV     1
 ASSI { 1885}
   (( segid "T22D" and resid 58   and name HA  ))
   (  segid "T22D" and resid 92   and name HB% )
      4.600     2.600     1.400 peak  1885 spectrum    1 weight  0.10000E+01 volume  0.82589E-03 ppm1      4.721 ppm2      1.415 CV     1
 ASSI { 1886}
   (( segid "T22D" and resid 58   and name HA  ))
   (( segid "T22D" and resid 91   and name HB2 ))
      4.300     2.300     1.700 peak  1886 spectrum    1 weight  0.10000E+01 volume  0.52606E-03 ppm1      4.735 ppm2      2.073 CV     1
 ASSI { 1887}
   (( segid "T22D" and resid 58   and name HA  ))
   (( segid "T22D" and resid 91   and name HB1 ))
      4.100     2.100     1.900 peak  1887 spectrum    1 weight  0.10000E+01 volume  0.62448E-03 ppm1      4.728 ppm2      2.361 CV     1
 ASSI { 1889}
   (( segid "T22D" and resid 70   and name HA  ))
   (( segid "T22D" and resid 73   and name HG2 ))
      3.000     1.100     1.100 peak  1889 spectrum    1 weight  0.10000E+01 volume  0.19633E-02 ppm1      4.063 ppm2      2.284 CV     1
 OR { 1889}
   (( segid "T22D" and resid 70   and name HA  ))
   (( segid "T22D" and resid 73   and name HG1 ))
 ASSI { 1893}
   (( segid "T22D" and resid 65   and name HA  ))
   (( segid "T22D" and resid 66   and name HB  ))
      4.000     2.000     2.000 peak  1893 spectrum    1 weight  0.10000E+01 volume  0.19494E-02 ppm1      4.752 ppm2      1.861 CV     1
 ASSI { 1903}
   (( segid "T22D" and resid 68   and name HA  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      5.100     3.200     0.900 peak  1903 spectrum    1 weight  0.10000E+01 volume  0.43102E-03 ppm1      4.807 ppm2      2.489 CV     1
 ASSI { 1904}
   (( segid "T22D" and resid 68   and name HA  ))
   (( segid "T22D" and resid 76   and name HG2 ))
      3.800     1.800     1.800 peak  1904 spectrum    1 weight  0.10000E+01 volume  0.15743E-02 ppm1      4.807 ppm2      1.502 CV     1
 ASSI { 1906}
   (( segid "T22D" and resid 68   and name HA  ))
   (  segid "T22D" and resid 68   and name HG2%)
      2.300     0.700     0.700 peak  1906 spectrum    1 weight  0.10000E+01 volume  0.93332E-02 ppm1      4.806 ppm2      0.963 CV     1
 ASSI { 1907}
   (( segid "T22D" and resid 68   and name HA  ))
   (  segid "T22D" and resid 67   and name HG2%)
      3.300     1.400     1.400 peak  1907 spectrum    1 weight  0.10000E+01 volume  0.93540E-03 ppm1      4.807 ppm2      0.877 CV     1
 ASSI { 1908}
   (( segid "T22D" and resid 68   and name HA  ))
   (( segid "T22D" and resid 68   and name HB  ))
      2.200     0.600     0.600 peak  1908 spectrum    1 weight  0.10000E+01 volume  0.82218E-02 ppm1      4.808 ppm2      3.673 CV     1
 ASSI { 1909}
   (( segid "T22D" and resid 68   and name HA  ))
   (  segid "T22D" and resid 66   and name HG1%)
      3.400     1.500     1.500 peak  1909 spectrum    1 weight  0.10000E+01 volume  0.15880E-02 ppm1      4.802 ppm2      0.715 CV     1
 ASSI { 1910}
   (( segid "T22D" and resid 68   and name HA  ))
   (( segid "T22D" and resid 75   and name HA  ))
      2.200     0.600     0.600 peak  1910 spectrum    1 weight  0.10000E+01 volume  0.69420E-02 ppm1      4.811 ppm2      4.179 CV     1
 ASSI { 1911}
   (( segid "T22D" and resid 68   and name HA  ))
   (( segid "T22D" and resid 76   and name HG1 ))
      2.900     1.000     1.000 peak  1911 spectrum    1 weight  0.10000E+01 volume  0.10761E-02 ppm1      4.820 ppm2      1.733 CV     1
 ASSI { 1912}
   (( segid "T22D" and resid 68   and name HA  ))
   (( segid "T22D" and resid 73   and name HA  ))
      3.800     1.800     1.800 peak  1912 spectrum    1 weight  0.10000E+01 volume  0.13050E-02 ppm1      4.823 ppm2      3.979 CV     1
 ASSI { 1913}
   (( segid "T22D" and resid 68   and name HA  ))
   (( segid "T22D" and resid 76   and name HD2 ))
      4.100     2.100     1.900 peak  1913 spectrum    1 weight  0.10000E+01 volume  0.62231E-03 ppm1      4.812 ppm2      3.077 CV     1
 ASSI { 1914}
   (( segid "T22D" and resid 68   and name HA  ))
   (( segid "T22D" and resid 75   and name HB1 ))
      4.100     2.100     1.900 peak  1914 spectrum    1 weight  0.10000E+01 volume  0.11470E-02 ppm1      4.821 ppm2      4.026 CV     1
 ASSI { 1916}
   (( segid "T22D" and resid 53   and name HA  ))
   (( segid "T22D" and resid 53   and name HB2 ))
      2.500     0.800     0.800 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.69558E-02 ppm1      4.070 ppm2      2.250 CV     1
 ASSI { 1918}
   (( segid "T22D" and resid 84   and name HA  ))
   (( segid "T22D" and resid 84   and name HB1 ))
      2.600     0.900     0.900 peak  1918 spectrum    1 weight  0.10000E+01 volume  0.53482E-02 ppm1      4.081 ppm2      1.721 CV     1
 ASSI { 1919}
   (( segid "T22D" and resid 84   and name HA  ))
   (  segid "T22D" and resid 35   and name HG2%)
      2.600     2.600     3.400 peak  1919 spectrum    1 weight  0.10000E+01 volume  0.51159E-02 ppm1      4.072 ppm2      0.796 CV     1
 ASSI { 1922}
   (( segid "T22D" and resid 65   and name HA  ))
   (( segid "T22D" and resid 48   and name HB1 ))
      3.100     1.200     1.200 peak  1922 spectrum    1 weight  0.10000E+01 volume  0.90300E-03 ppm1      4.726 ppm2      3.000 CV     1
 ASSI { 1924}
   (( segid "T22D" and resid 65   and name HA  ))
   (( segid "T22D" and resid 48   and name HB2 ))
      5.000     3.100     1.000 peak  1924 spectrum    1 weight  0.10000E+01 volume  0.52010E-03 ppm1      4.729 ppm2      2.737 CV     1
 ASSI { 1928}
   (( segid "T22D" and resid 94   and name HA  ))
   (( segid "T22D" and resid 94   and name HG2 ))
      2.900     1.100     1.100 peak  1928 spectrum    1 weight  0.10000E+01 volume  0.33018E-02 ppm1      3.878 ppm2      1.568 CV     1
 ASSI { 1929}
   (( segid "T22D" and resid 94   and name HA  ))
   (( segid "T22D" and resid 94   and name HG1 ))
      3.100     1.200     1.200 peak  1929 spectrum    1 weight  0.10000E+01 volume  0.23133E-02 ppm1      3.885 ppm2      1.542 CV     1
 ASSI { 1930}
   (( segid "T22D" and resid 49   and name HA  ))
   (( segid "T22D" and resid 52   and name HB2 ))
      2.500     0.800     0.800 peak  1930 spectrum    1 weight  0.10000E+01 volume  0.45513E-02 ppm1      4.150 ppm2      3.590 CV     1
 OR { 1930}
   (( segid "T22D" and resid 49   and name HA  ))
   (( segid "T22D" and resid 52   and name HB1 ))
 ASSI { 1932}
   (( segid "T22D" and resid 49   and name HA  ))
   (( segid "T22D" and resid 49   and name HE2 ))
      4.200     2.200     1.800 peak  1932 spectrum    1 weight  0.10000E+01 volume  0.77110E-03 ppm1      4.166 ppm2      2.993 CV     1
 OR { 1932}
   (( segid "T22D" and resid 49   and name HA  ))
   (( segid "T22D" and resid 49   and name HE1 ))
 ASSI { 1935}
   (( segid "T22D" and resid 94   and name HA  ))
   (( segid "T22D" and resid 94   and name HB1 ))
      2.600     0.900     0.900 peak  1935 spectrum    1 weight  0.10000E+01 volume  0.67727E-02 ppm1      3.881 ppm2      1.816 CV     1
 ASSI { 1938}
   (( segid "T22D" and resid 94   and name HA  ))
   (( segid "T22D" and resid 95   and name HA  ))
      3.700     1.800     1.800 peak  1938 spectrum    1 weight  0.10000E+01 volume  0.71643E-03 ppm1      3.881 ppm2      5.134 CV     1
 ASSI { 1941}
   (( segid "T22D" and resid 93   and name HA  ))
   (( segid "T22D" and resid 94   and name HA  ))
      3.700     1.700     1.700 peak  1941 spectrum    1 weight  0.10000E+01 volume  0.75383E-03 ppm1      4.250 ppm2      3.882 CV     1
 ASSI { 1943}
   (( segid "T22D" and resid 111  and name HA  ))
   (( segid "T22D" and resid 33   and name HA  ))
      4.700     2.700     1.300 peak  1943 spectrum    1 weight  0.10000E+01 volume  0.49499E-03 ppm1      4.455 ppm2      3.739 CV     1
 ASSI { 1944}
   (( segid "T22D" and resid 111  and name HA  ))
   (  segid "T22D" and resid 111  and name HE% )
      4.800     2.900     1.200 peak  1944 spectrum    1 weight  0.10000E+01 volume  0.47873E-03 ppm1      4.428 ppm2      6.717 CV     1
 ASSI { 1948}
   (( segid "T22D" and resid 90   and name HA  ))
   (( segid "T22D" and resid 93   and name HB1 ))
      4.200     2.200     1.800 peak  1948 spectrum    1 weight  0.10000E+01 volume  0.17245E-02 ppm1      4.051 ppm2      3.036 CV     1
 ASSI { 1949}
   (( segid "T22D" and resid 111  and name HA  ))
   (( segid "T22D" and resid 111  and name HB1 ))
      2.400     0.700     0.700 peak  1949 spectrum    1 weight  0.10000E+01 volume  0.72243E-02 ppm1      4.436 ppm2      2.936 CV     1
 ASSI { 1950}
   (( segid "T22D" and resid 111  and name HA  ))
   (  segid "T22D" and resid 111  and name HD% )
      3.300     1.400     1.400 peak  1950 spectrum    1 weight  0.10000E+01 volume  0.29992E-02 ppm1      4.437 ppm2      7.096 CV     1
 ASSI { 1952}
   (( segid "T22D" and resid 39   and name HA  ))
   (  segid "T22D" and resid 107  and name HG2%)
      3.500     1.500     1.500 peak  1952 spectrum    1 weight  0.10000E+01 volume  0.86530E-03 ppm1      4.370 ppm2      1.046 CV     1
 OR { 1952}
   (( segid "T22D" and resid 39   and name HA  ))
   (  segid "T22D" and resid 107  and name HG1%)
 ASSI { 1953}
   (( segid "T22D" and resid 93   and name HA  ))
   (  segid "T22D" and resid 37   and name HG2%)
      3.800     1.800     1.800 peak  1953 spectrum    1 weight  0.10000E+01 volume  0.12465E-02 ppm1      4.265 ppm2      0.691 CV     1
 ASSI { 1954}
   (( segid "T22D" and resid 93   and name HA  ))
   (  segid "T22D" and resid 92   and name HB% )
      4.000     2.000     2.000 peak  1954 spectrum    1 weight  0.10000E+01 volume  0.51634E-03 ppm1      4.258 ppm2      1.421 CV     1
 ASSI { 1957}
   (( segid "T22D" and resid 90   and name HA  ))
   (( segid "T22D" and resid 90   and name HB1 ))
      2.500     0.800     0.800 peak  1957 spectrum    1 weight  0.10000E+01 volume  0.77252E-02 ppm1      4.047 ppm2      2.091 CV     1
 ASSI { 1959}
   (( segid "T22D" and resid 93   and name HA  ))
   (  segid "T22D" and resid 107  and name HG1%)
      2.600     0.900     0.900 peak  1959 spectrum    1 weight  0.10000E+01 volume  0.30231E-02 ppm1      4.260 ppm2      1.050 CV     1
 ASSI { 1961}
   (( segid "T22D" and resid 93   and name HA  ))
   (( segid "T22D" and resid 93   and name HB1 ))
      2.400     0.700     0.700 peak  1961 spectrum    1 weight  0.10000E+01 volume  0.43690E-02 ppm1      4.260 ppm2      3.038 CV     1
 ASSI { 1962}
   (( segid "T22D" and resid 99   and name HA  ))
   (  segid "T22D" and resid 99   and name HD1%)
      2.500     0.800     0.800 peak  1962 spectrum    1 weight  0.10000E+01 volume  0.39487E-02 ppm1      4.152 ppm2      0.706 CV     1
 ASSI { 1964}
   (( segid "T22D" and resid 39   and name HA  ))
   (( segid "T22D" and resid 39   and name HB  ))
      3.200     1.300     1.300 peak  1964 spectrum    1 weight  0.10000E+01 volume  0.94074E-03 ppm1      4.366 ppm2      1.441 CV     1
 ASSI { 1965}
   (( segid "T22D" and resid 99   and name HA  ))
   (  segid "T22D" and resid 99   and name HG2%)
      2.500     0.800     0.800 peak  1965 spectrum    1 weight  0.10000E+01 volume  0.48361E-02 ppm1      4.159 ppm2      0.551 CV     1
 ASSI { 1968}
   (( segid "T22D" and resid 90   and name HA  ))
   (( segid "T22D" and resid 93   and name HB2 ))
      2.700     0.900     0.900 peak  1968 spectrum    1 weight  0.10000E+01 volume  0.17277E-02 ppm1      4.044 ppm2      2.801 CV     1
 ASSI { 1970}
   (( segid "T22D" and resid 33   and name HA  ))
   (( segid "T22D" and resid 36   and name HB2 ))
      4.300     2.300     1.700 peak  1970 spectrum    1 weight  0.10000E+01 volume  0.44637E-03 ppm1      3.749 ppm2      2.054 CV     1
 ASSI { 1971}
   (( segid "T22D" and resid 33   and name HA  ))
   (  segid "T22D" and resid 111  and name HE% )
      4.400     2.400     1.600 peak  1971 spectrum    1 weight  0.10000E+01 volume  0.42323E-03 ppm1      3.739 ppm2      6.727 CV     1
 ASSI { 1975}
   (( segid "T22D" and resid 91   and name HA  ))
   (( segid "T22D" and resid 94   and name HB2 ))
      2.800     1.000     1.000 peak  1975 spectrum    1 weight  0.10000E+01 volume  0.22280E-02 ppm1      3.985 ppm2      1.905 CV     1
 ASSI { 1976}
   (( segid "T22D" and resid 33   and name HA  ))
   (( segid "T22D" and resid 111  and name HB1 ))
      2.900     1.100     1.100 peak  1976 spectrum    1 weight  0.10000E+01 volume  0.12998E-02 ppm1      3.747 ppm2      2.933 CV     1
 ASSI { 1977}
   (( segid "T22D" and resid 33   and name HA  ))
   (  segid "T22D" and resid 111  and name HD% )
      3.400     1.500     1.500 peak  1977 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      3.749 ppm2      7.094 CV     1
 ASSI { 1981}
   (( segid "T22D" and resid 91   and name HA  ))
   (( segid "T22D" and resid 91   and name HB1 ))
      2.600     0.800     0.800 peak  1981 spectrum    1 weight  0.10000E+01 volume  0.30460E-02 ppm1      3.976 ppm2      2.362 CV     1
 ASSI { 1983}
   (( segid "T22D" and resid 91   and name HA  ))
   (  segid "T22D" and resid 58   and name HD% )
      4.000     2.000     2.000 peak  1983 spectrum    1 weight  0.10000E+01 volume  0.68845E-03 ppm1      3.971 ppm2      7.356 CV     1
 ASSI { 1985}
   (( segid "T22D" and resid 33   and name HA  ))
   (( segid "T22D" and resid 111  and name HB2 ))
      3.600     1.600     1.600 peak  1985 spectrum    1 weight  0.10000E+01 volume  0.11640E-02 ppm1      3.750 ppm2      3.232 CV     1
 ASSI { 1986}
   (( segid "T22D" and resid 91   and name HA  ))
   (  segid "T22D" and resid 92   and name HB% )
      4.500     2.600     1.500 peak  1986 spectrum    1 weight  0.10000E+01 volume  0.54966E-03 ppm1      3.972 ppm2      1.408 CV     1
 ASSI { 1988}
   (( segid "T22D" and resid 91   and name HA  ))
   (( segid "T22D" and resid 91   and name HD1 ))
      3.200     1.300     1.300 peak  1988 spectrum    1 weight  0.10000E+01 volume  0.13127E-02 ppm1      3.978 ppm2      3.418 CV     1
 ASSI { 1990}
   (( segid "T22D" and resid 81   and name HA  ))
   (( segid "T22D" and resid 81   and name HB  ))
      3.100     1.200     1.200 peak  1990 spectrum    1 weight  0.10000E+01 volume  0.13788E-02 ppm1      4.788 ppm2      1.089 CV     1
 ASSI { 1991}
   (( segid "T22D" and resid 81   and name HA  ))
   (  segid "T22D" and resid 82   and name HG2%)
      4.900     3.000     1.100 peak  1991 spectrum    1 weight  0.10000E+01 volume  0.49666E-03 ppm1      4.803 ppm2      1.162 CV     1
 ASSI { 1993}
   (( segid "T22D" and resid 81   and name HA  ))
   (  segid "T22D" and resid 81   and name HG2%)
      2.600     0.800     0.800 peak  1993 spectrum    1 weight  0.10000E+01 volume  0.33956E-02 ppm1      4.805 ppm2      0.269 CV     1
 ASSI { 1994}
   (( segid "T22D" and resid 52   and name HA  ))
   (  segid "T22D" and resid 61   and name HG2%)
      3.600     1.600     1.600 peak  1994 spectrum    1 weight  0.10000E+01 volume  0.10166E-02 ppm1      3.749 ppm2      0.607 CV     1
 ASSI { 1995}
   (( segid "T22D" and resid 81   and name HA  ))
   (  segid "T22D" and resid 61   and name HG2%)
      3.500     1.600     1.600 peak  1995 spectrum    1 weight  0.10000E+01 volume  0.12414E-02 ppm1      4.800 ppm2      0.603 CV     1
 ASSI { 1996}
   (( segid "T22D" and resid 44   and name HA  ))
   (( segid "T22D" and resid 44   and name HB2 ))
      3.200     1.300     1.300 peak  1996 spectrum    1 weight  0.10000E+01 volume  0.19959E-02 ppm1      4.237 ppm2      2.814 CV     1
 ASSI { 1999}
   (( segid "T22D" and resid 81   and name HA  ))
   (  segid "T22D" and resid 64   and name HB% )
      3.200     1.300     1.300 peak  1999 spectrum    1 weight  0.10000E+01 volume  0.21415E-02 ppm1      4.804 ppm2      1.333 CV     1
 ASSI { 2000}
   (( segid "T22D" and resid 81   and name HA  ))
   (( segid "T22D" and resid 64   and name HA  ))
      2.400     0.700     0.700 peak  2000 spectrum    1 weight  0.10000E+01 volume  0.43911E-02 ppm1      4.804 ppm2      5.259 CV     1
 ASSI { 2001}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 52   and name HD2 ))
      3.600     1.600     1.600 peak  2001 spectrum    1 weight  0.10000E+01 volume  0.80809E-03 ppm1      3.749 ppm2      7.308 CV     1
 ASSI { 2002}
   (( segid "T22D" and resid 44   and name HA  ))
   (  segid "T22D" and resid 44   and name HE% )
      4.600     2.600     1.400 peak  2002 spectrum    1 weight  0.10000E+01 volume  0.90913E-03 ppm1      4.239 ppm2      6.023 CV     1
 ASSI { 2003}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 55   and name HB1 ))
      4.600     2.700     1.400 peak  2003 spectrum    1 weight  0.10000E+01 volume  0.77089E-03 ppm1      3.752 ppm2      2.859 CV     1
 ASSI { 2004}
   (( segid "T22D" and resid 52   and name HA  ))
   (  segid "T22D" and resid 81   and name HG2%)
      3.000     1.200     1.200 peak  2004 spectrum    1 weight  0.10000E+01 volume  0.24682E-02 ppm1      3.750 ppm2      0.286 CV     1
 ASSI { 2005}
   (( segid "T22D" and resid 81   and name HA  ))
   (  segid "T22D" and resid 81   and name HG1%)
      2.600     0.800     0.800 peak  2005 spectrum    1 weight  0.10000E+01 volume  0.37741E-02 ppm1      4.807 ppm2      0.528 CV     1
 ASSI { 2006}
   (( segid "T22D" and resid 91   and name HA  ))
   (( segid "T22D" and resid 91   and name HB2 ))
      2.800     1.000     1.000 peak  2006 spectrum    1 weight  0.10000E+01 volume  0.42765E-02 ppm1      3.983 ppm2      2.080 CV     1
 ASSI { 2007}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 52   and name HB1 ))
      2.200     0.600     0.600 peak  2007 spectrum    1 weight  0.10000E+01 volume  0.79307E-02 ppm1      3.750 ppm2      3.593 CV     1
 OR { 2007}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 52   and name HB2 ))
 ASSI { 2009}
   (( segid "T22D" and resid 44   and name HA  ))
   (( segid "T22D" and resid 75   and name HB1 ))
      3.200     1.300     1.300 peak  2009 spectrum    1 weight  0.10000E+01 volume  0.10248E-02 ppm1      4.231 ppm2      4.035 CV     1
 ASSI { 2014}
   (( segid "T22D" and resid 81   and name HA  ))
   (( segid "T22D" and resid 82   and name HB  ))
      4.400     2.500     1.600 peak  2014 spectrum    1 weight  0.10000E+01 volume  0.83765E-03 ppm1      4.819 ppm2      3.916 CV     1
 ASSI { 2018}
   (( segid "T22D" and resid 107  and name HA  ))
   (( segid "T22D" and resid 39   and name HA  ))
      2.900     1.000     1.000 peak  2018 spectrum    1 weight  0.10000E+01 volume  0.16263E-02 ppm1      5.168 ppm2      4.379 CV     1
 ASSI { 2019}
   (( segid "T22D" and resid 107  and name HA  ))
   (  segid "T22D" and resid 107  and name HG2%)
      2.700     0.900     0.900 peak  2019 spectrum    1 weight  0.10000E+01 volume  0.23363E-02 ppm1      5.161 ppm2      1.007 CV     1
 ASSI { 2025}
   (( segid "T22D" and resid 107  and name HA  ))
   (  segid "T22D" and resid 39   and name HG1%)
      3.100     1.200     1.200 peak  2025 spectrum    1 weight  0.10000E+01 volume  0.21091E-02 ppm1      5.172 ppm2      0.683 CV     1
 OR { 2025}
   (( segid "T22D" and resid 107  and name HA  ))
   (  segid "T22D" and resid 39   and name HG2%)
 ASSI { 2027}
   (( segid "T22D" and resid 52   and name HA  ))
   (  segid "T22D" and resid 51   and name HD1%)
      4.200     2.200     1.800 peak  2027 spectrum    1 weight  0.10000E+01 volume  0.84178E-03 ppm1      3.758 ppm2      0.550 CV     1
 ASSI { 2029}
   (( segid "T22D" and resid 32   and name HA  ))
   (( segid "T22D" and resid 36   and name HB2 ))
      3.500     1.500     1.500 peak  2029 spectrum    1 weight  0.10000E+01 volume  0.58157E-03 ppm1      4.664 ppm2      2.050 CV     1
 ASSI { 2030}
   (( segid "T22D" and resid 32   and name HA  ))
   (  segid "T22D" and resid 35   and name HG2%)
      3.900     1.900     1.900 peak  2030 spectrum    1 weight  0.10000E+01 volume  0.11412E-02 ppm1      4.667 ppm2      0.800 CV     1
 ASSI { 2031}
   (( segid "T22D" and resid 32   and name HA  ))
   (( segid "T22D" and resid 36   and name HB1 ))
      3.600     1.700     1.700 peak  2031 spectrum    1 weight  0.10000E+01 volume  0.12610E-02 ppm1      4.675 ppm2      1.785 CV     1
 ASSI { 2032}
   (( segid "T22D" and resid 32   and name HA  ))
   (( segid "T22D" and resid 31   and name HB2 ))
      3.000     3.000     3.000 peak  2032 spectrum    1 weight  0.10000E+01 volume  0.51680E-03 ppm1      4.668 ppm2      2.811 CV     1
 ASSI { 2033}
   (( segid "T22D" and resid 32   and name HA  ))
   (  segid "T22D" and resid 82   and name HG2%)
      3.400     1.500     1.500 peak  2033 spectrum    1 weight  0.10000E+01 volume  0.11431E-02 ppm1      4.674 ppm2      1.159 CV     1
 ASSI { 2034}
   (( segid "T22D" and resid 32   and name HA  ))
   (( segid "T22D" and resid 36   and name HG1 ))
      4.800     2.900     1.200 peak  2034 spectrum    1 weight  0.10000E+01 volume  0.46910E-03 ppm1      4.670 ppm2      0.949 CV     1
 ASSI { 2035}
   (( segid "T22D" and resid 32   and name HA  ))
   (( segid "T22D" and resid 33   and name HB1 ))
      4.600     2.700     1.400 peak  2035 spectrum    1 weight  0.10000E+01 volume  0.41739E-03 ppm1      4.670 ppm2      1.274 CV     1
 OR { 2035}
   (( segid "T22D" and resid 32   and name HA  ))
   (( segid "T22D" and resid 33   and name HG2 ))
 ASSI { 2036}
   (( segid "T22D" and resid 32   and name HA  ))
   (( segid "T22D" and resid 36   and name HD1 ))
      5.000     3.100     1.000 peak  2036 spectrum    1 weight  0.10000E+01 volume  0.42035E-03 ppm1      4.677 ppm2      1.528 CV     1
 ASSI { 2037}
   (( segid "T22D" and resid 100  and name HA  ))
   (  segid "T22D" and resid 54   and name HE% )
      3.700     1.700     1.700 peak  2037 spectrum    1 weight  0.10000E+01 volume  0.55725E-03 ppm1      3.765 ppm2      6.456 CV     1
 ASSI { 2038}
   (( segid "T22D" and resid 107  and name HA  ))
   (( segid "T22D" and resid 106  and name HB1 ))
      3.600     1.600     1.600 peak  2038 spectrum    1 weight  0.10000E+01 volume  0.79612E-03 ppm1      5.167 ppm2      2.797 CV     1
 OR { 2038}
   (( segid "T22D" and resid 107  and name HA  ))
   (( segid "T22D" and resid 106  and name HB2 ))
 ASSI { 2041}
   (( segid "T22D" and resid 35   and name HA  ))
   (  segid "T22D" and resid 109  and name HD2%)
      3.400     1.500     1.500 peak  2041 spectrum    1 weight  0.10000E+01 volume  0.11390E-02 ppm1      4.411 ppm2      0.895 CV     1
 ASSI { 2042}
   (( segid "T22D" and resid 61   and name HA  ))
   (  segid "T22D" and resid 64   and name HB% )
      4.900     3.000     1.100 peak  2042 spectrum    1 weight  0.10000E+01 volume  0.63795E-03 ppm1      4.112 ppm2      1.327 CV     1
 ASSI { 2043}
   (( segid "T22D" and resid 61   and name HA  ))
   (  segid "T22D" and resid 81   and name HG2%)
      4.100     2.100     1.900 peak  2043 spectrum    1 weight  0.10000E+01 volume  0.11908E-02 ppm1      4.115 ppm2      0.284 CV     1
 ASSI { 2047}
   (( segid "T22D" and resid 61   and name HA  ))
   (( segid "T22D" and resid 62   and name HB1 ))
      4.500     2.600     1.500 peak  2047 spectrum    1 weight  0.10000E+01 volume  0.10938E-02 ppm1      4.102 ppm2      1.706 CV     1
 ASSI { 2049}
   (( segid "T22D" and resid 35   and name HA  ))
   (( segid "T22D" and resid 35   and name HB  ))
      2.300     0.600     0.600 peak  2049 spectrum    1 weight  0.10000E+01 volume  0.70388E-02 ppm1      4.413 ppm2      4.583 CV     1
 ASSI { 2050}
   (( segid "T22D" and resid 61   and name HA  ))
   (  segid "T22D" and resid 83   and name HE% )
      3.200     1.300     1.300 peak  2050 spectrum    1 weight  0.10000E+01 volume  0.16590E-02 ppm1      4.116 ppm2      1.920 CV     1
 ASSI { 2056}
   (( segid "T22D" and resid 35   and name HA  ))
   (( segid "T22D" and resid 86   and name HA  ))
      2.900     1.000     1.000 peak  2056 spectrum    1 weight  0.10000E+01 volume  0.22078E-02 ppm1      4.405 ppm2      4.068 CV     1
 ASSI { 2058}
   (( segid "T22D" and resid 82   and name HA  ))
   (( segid "T22D" and resid 35   and name HB  ))
      3.500     1.500     1.500 peak  2058 spectrum    1 weight  0.10000E+01 volume  0.12719E-02 ppm1      5.247 ppm2      4.581 CV     1
 ASSI { 2060}
   (( segid "T22D" and resid 82   and name HA  ))
   (( segid "T22D" and resid 63   and name HB1 ))
      4.300     2.300     1.700 peak  2060 spectrum    1 weight  0.10000E+01 volume  0.57702E-03 ppm1      5.227 ppm2      1.995 CV     1
 OR { 2060}
   (( segid "T22D" and resid 82   and name HA  ))
   (( segid "T22D" and resid 63   and name HB2 ))
 ASSI { 2061}
   (( segid "T22D" and resid 82   and name HA  ))
   (( segid "T22D" and resid 81   and name HB  ))
      3.100     3.100     2.900 peak  2061 spectrum    1 weight  0.10000E+01 volume  0.50546E-03 ppm1      5.231 ppm2      1.069 CV     1
 ASSI { 2062}
   (( segid "T22D" and resid 82   and name HA  ))
   (  segid "T22D" and resid 81   and name HG1%)
      3.600     1.700     1.700 peak  2062 spectrum    1 weight  0.10000E+01 volume  0.54958E-03 ppm1      5.247 ppm2      0.526 CV     1
 ASSI { 2064}
   (( segid "T22D" and resid 72   and name HA  ))
   (( segid "T22D" and resid 74   and name HD2 ))
      4.400     2.500     1.600 peak  2064 spectrum    1 weight  0.10000E+01 volume  0.78403E-03 ppm1      4.367 ppm2      1.523 CV     1
 OR { 2064}
   (( segid "T22D" and resid 72   and name HA  ))
   (( segid "T22D" and resid 74   and name HD1 ))
 ASSI { 2065}
   (( segid "T22D" and resid 118  and name HA  ))
   (( segid "T22D" and resid 118  and name HB  ))
      2.300     0.700     0.700 peak  2065 spectrum    1 weight  0.10000E+01 volume  0.86272E-02 ppm1      4.342 ppm2      4.203 CV     1
 ASSI { 2067}
   (( segid "T22D" and resid 82   and name HA  ))
   (( segid "T22D" and resid 82   and name HB  ))
      3.100     1.200     1.200 peak  2067 spectrum    1 weight  0.10000E+01 volume  0.13099E-02 ppm1      5.243 ppm2      3.915 CV     1
 ASSI { 2071}
   (( segid "T22D" and resid 88   and name HA  ))
   (( segid "T22D" and resid 91   and name HG1 ))
      3.500     1.600     1.600 peak  2071 spectrum    1 weight  0.10000E+01 volume  0.56906E-03 ppm1      4.355 ppm2      1.710 CV     1
 ASSI { 2072}
   (( segid "T22D" and resid 37   and name HA  ))
   (( segid "T22D" and resid 38   and name HB1 ))
      4.700     2.800     1.300 peak  2072 spectrum    1 weight  0.10000E+01 volume  0.60192E-03 ppm1      4.209 ppm2      2.631 CV     1
 ASSI { 2073}
   (( segid "T22D" and resid 55   and name HA  ))
   (( segid "T22D" and resid 55   and name HB2 ))
      3.100     1.200     1.200 peak  2073 spectrum    1 weight  0.10000E+01 volume  0.14105E-02 ppm1      4.310 ppm2      3.252 CV     1
 ASSI { 2074}
   (( segid "T22D" and resid 37   and name HA  ))
   (( segid "T22D" and resid 37   and name HG12))
      2.800     1.000     1.000 peak  2074 spectrum    1 weight  0.10000E+01 volume  0.12575E-02 ppm1      4.196 ppm2      0.525 CV     1
 ASSI { 2075}
   (( segid "T22D" and resid 55   and name HA  ))
   (  segid "T22D" and resid 58   and name HD% )
      2.700     0.900     0.900 peak  2075 spectrum    1 weight  0.10000E+01 volume  0.24598E-02 ppm1      4.312 ppm2      7.365 CV     1
 ASSI { 2078}
   (( segid "T22D" and resid 55   and name HA  ))
   (  segid "T22D" and resid 55   and name HD% )
      3.100     1.200     1.200 peak  2078 spectrum    1 weight  0.10000E+01 volume  0.16670E-02 ppm1      4.308 ppm2      7.790 CV     1
 ASSI { 2079}
   (( segid "T22D" and resid 88   and name HA  ))
   (( segid "T22D" and resid 88   and name HB1 ))
      2.500     0.800     0.800 peak  2079 spectrum    1 weight  0.10000E+01 volume  0.35565E-02 ppm1      4.340 ppm2      3.861 CV     1
 ASSI { 2080}
   (( segid "T22D" and resid 55   and name HA  ))
   (( segid "T22D" and resid 55   and name HB1 ))
      2.700     0.900     0.900 peak  2080 spectrum    1 weight  0.10000E+01 volume  0.18570E-02 ppm1      4.311 ppm2      2.873 CV     1
 ASSI { 2081}
   (( segid "T22D" and resid 55   and name HA  ))
   (  segid "T22D" and resid 58   and name HE% )
      3.300     1.300     1.300 peak  2081 spectrum    1 weight  0.10000E+01 volume  0.87410E-03 ppm1      4.302 ppm2      6.971 CV     1
 ASSI { 2086}
   (( segid "T22D" and resid 88   and name HA  ))
   (( segid "T22D" and resid 88   and name HB2 ))
      2.900     1.100     1.100 peak  2086 spectrum    1 weight  0.10000E+01 volume  0.28019E-02 ppm1      4.347 ppm2      4.060 CV     1
 ASSI { 2091}
   (( segid "T22D" and resid 37   and name HA  ))
   (( segid "T22D" and resid 37   and name HB  ))
      3.100     1.200     1.200 peak  2091 spectrum    1 weight  0.10000E+01 volume  0.10650E-02 ppm1      4.200 ppm2      1.888 CV     1
 ASSI { 2092}
   (( segid "T22D" and resid 37   and name HA  ))
   (( segid "T22D" and resid 38   and name HB2 ))
      4.200     2.200     1.800 peak  2092 spectrum    1 weight  0.10000E+01 volume  0.96484E-03 ppm1      4.207 ppm2      2.795 CV     1
 ASSI { 2096}
   (( segid "T22D" and resid 66   and name HA  ))
   (( segid "T22D" and resid 66   and name HB  ))
      3.200     1.300     1.300 peak  2096 spectrum    1 weight  0.10000E+01 volume  0.12702E-02 ppm1      3.745 ppm2      1.858 CV     1
 ASSI { 2098}
   (( segid "T22D" and resid 54   and name HA  ))
   (( segid "T22D" and resid 53   and name HB1 ))
      2.900     2.900     3.100 peak  2098 spectrum    1 weight  0.10000E+01 volume  0.31382E-02 ppm1      4.118 ppm2      2.092 CV     1
 ASSI { 2100}
   (( segid "T22D" and resid 66   and name HA  ))
   (  segid "T22D" and resid 66   and name HG1%)
      2.600     0.900     0.900 peak  2100 spectrum    1 weight  0.10000E+01 volume  0.35312E-02 ppm1      3.741 ppm2      0.717 CV     1
 ASSI { 2103}
   (( segid "T22D" and resid 66   and name HA  ))
   (( segid "T22D" and resid 42   and name HB1 ))
      4.100     2.100     1.900 peak  2103 spectrum    1 weight  0.10000E+01 volume  0.45579E-03 ppm1      3.738 ppm2      1.175 CV     1
 ASSI { 2104}
   (( segid "T22D" and resid 66   and name HA  ))
   (( segid "T22D" and resid 79   and name HA2 ))
      3.000     1.100     1.100 peak  2104 spectrum    1 weight  0.10000E+01 volume  0.19626E-02 ppm1      3.753 ppm2      3.949 CV     1
 ASSI { 2109}
   (( segid "T22D" and resid 54   and name HA  ))
   (  segid "T22D" and resid 54   and name HD% )
      3.300     1.400     1.400 peak  2109 spectrum    1 weight  0.10000E+01 volume  0.13286E-02 ppm1      4.098 ppm2      6.361 CV     1
 ASSI { 2110}
   (( segid "T22D" and resid 66   and name HA  ))
   (  segid "T22D" and resid 51   and name HD1%)
      3.100     1.200     1.200 peak  2110 spectrum    1 weight  0.10000E+01 volume  0.12009E-02 ppm1      3.744 ppm2      0.559 CV     1
 ASSI { 2111}
   (( segid "T22D" and resid 66   and name HA  ))
   (  segid "T22D" and resid 42   and name HD1%)
      3.800     1.800     1.800 peak  2111 spectrum    1 weight  0.10000E+01 volume  0.75917E-03 ppm1      3.747 ppm2      0.453 CV     1
 ASSI { 2114}
   (( segid "T22D" and resid 66   and name HA  ))
   (( segid "T22D" and resid 67   and name HB  ))
      4.700     2.700     1.300 peak  2114 spectrum    1 weight  0.10000E+01 volume  0.67514E-03 ppm1      3.753 ppm2      0.980 CV     1
 ASSI { 2116}
   (( segid "T22D" and resid 98   and name HA  ))
   (( segid "T22D" and resid 97   and name HA  ))
      3.700     1.700     1.700 peak  2116 spectrum    1 weight  0.10000E+01 volume  0.55838E-03 ppm1      4.484 ppm2      6.044 CV     1
 ASSI { 2118}
   (( segid "T22D" and resid 88   and name HB2 ))
   (( segid "T22D" and resid 83   and name HG1 ))
      3.300     1.400     1.400 peak  2118 spectrum    1 weight  0.10000E+01 volume  0.72798E-03 ppm1      4.052 ppm2      2.245 CV     1
 ASSI { 2119}
   (( segid "T22D" and resid 88   and name HB1 ))
   (( segid "T22D" and resid 83   and name HG1 ))
      3.800     1.800     1.800 peak  2119 spectrum    1 weight  0.10000E+01 volume  0.45809E-03 ppm1      3.889 ppm2      2.239 CV     1
 ASSI { 2121}
   (( segid "T22D" and resid 88   and name HB1 ))
   (( segid "T22D" and resid 59   and name HA1 ))
      2.600     0.900     0.900 peak  2121 spectrum    1 weight  0.10000E+01 volume  0.12762E-02 ppm1      3.873 ppm2      4.595 CV     1
 ASSI { 2123}
   (( segid "T22D" and resid 88   and name HB2 ))
   (( segid "T22D" and resid 83   and name HB1 ))
      2.700     0.900     0.900 peak  2123 spectrum    1 weight  0.10000E+01 volume  0.13197E-02 ppm1      4.059 ppm2      2.558 CV     1
 ASSI { 2125}
   (( segid "T22D" and resid 88   and name HB1 ))
   (( segid "T22D" and resid 88   and name HB2 ))
      1.900     0.500     0.500 peak  2125 spectrum    1 weight  0.10000E+01 volume  0.62068E-02 ppm1      3.865 ppm2      4.056 CV     1
 ASSI { 2126}
   (( segid "T22D" and resid 88   and name HB1 ))
   (( segid "T22D" and resid 83   and name HB1 ))
      3.500     1.500     1.500 peak  2126 spectrum    1 weight  0.10000E+01 volume  0.10115E-02 ppm1      3.872 ppm2      2.558 CV     1
 ASSI { 2130}
   (( segid "T22D" and resid 98   and name HA  ))
   (( segid "T22D" and resid 98   and name HD1 ))
      3.500     1.500     1.500 peak  2130 spectrum    1 weight  0.10000E+01 volume  0.95296E-03 ppm1      4.441 ppm2      3.600 CV     1
 ASSI { 2132}
   (( segid "T22D" and resid 98   and name HA  ))
   (( segid "T22D" and resid 99   and name HG11))
      5.700     4.100     0.300 peak  2132 spectrum    1 weight  0.10000E+01 volume  0.46605E-03 ppm1      4.473 ppm2      1.465 CV     1
 ASSI { 2133}
   (( segid "T22D" and resid 98   and name HA  ))
   (( segid "T22D" and resid 98   and name HB2 ))
      2.600     0.900     0.900 peak  2133 spectrum    1 weight  0.10000E+01 volume  0.44950E-02 ppm1      4.468 ppm2      1.576 CV     1
 ASSI { 2134}
   (( segid "T22D" and resid 98   and name HA  ))
   (( segid "T22D" and resid 98   and name HB1 ))
      2.400     0.700     0.700 peak  2134 spectrum    1 weight  0.10000E+01 volume  0.43015E-02 ppm1      4.469 ppm2      2.126 CV     1
 ASSI { 2140}
   (( segid "T22D" and resid 116  and name HA  ))
   (  segid "T22D" and resid 118  and name HG2%)
      3.800     1.800     1.800 peak  2140 spectrum    1 weight  0.10000E+01 volume  0.68795E-03 ppm1      4.383 ppm2      1.177 CV     1
 ASSI { 2141}
   (( segid "T22D" and resid 116  and name HA  ))
   (( segid "T22D" and resid 116  and name HD1 ))
      3.600     1.600     1.600 peak  2141 spectrum    1 weight  0.10000E+01 volume  0.83127E-03 ppm1      4.392 ppm2      3.795 CV     1
 ASSI { 2142}
   (( segid "T22D" and resid 98   and name HA  ))
   (  segid "T22D" and resid 99   and name HD1%)
      4.800     2.900     1.200 peak  2142 spectrum    1 weight  0.10000E+01 volume  0.39690E-03 ppm1      4.444 ppm2      0.701 CV     1
 ASSI { 2144}
   (( segid "T22D" and resid 96   and name HA  ))
   (  segid "T22D" and resid 107  and name HG2%)
      3.400     1.400     1.400 peak  2144 spectrum    1 weight  0.10000E+01 volume  0.18516E-02 ppm1      4.696 ppm2      1.052 CV     1
 OR { 2144}
   (( segid "T22D" and resid 96   and name HA  ))
   (  segid "T22D" and resid 107  and name HG1%)
 ASSI { 2147}
   (( segid "T22D" and resid 96   and name HA  ))
   (( segid "T22D" and resid 96   and name HG2 ))
      3.700     1.700     1.700 peak  2147 spectrum    1 weight  0.10000E+01 volume  0.18062E-02 ppm1      4.703 ppm2      2.088 CV     1
 OR { 2147}
   (( segid "T22D" and resid 96   and name HA  ))
   (( segid "T22D" and resid 96   and name HG1 ))
 ASSI { 2149}
   (( segid "T22D" and resid 29   and name HB2 ))
   (( segid "T22D" and resid 29   and name HA  ))
      2.100     0.600     0.600 peak  2149 spectrum    1 weight  0.10000E+01 volume  0.16972E-01 ppm1      3.861 ppm2      4.415 CV     1
 OR { 2149}
   (( segid "T22D" and resid 29   and name HB1 ))
   (( segid "T22D" and resid 29   and name HA  ))
 ASSI { 2150}
   (( segid "T22D" and resid 75   and name HB1 ))
   (  segid "T22D" and resid 66   and name HG1%)
      3.400     1.400     1.400 peak  2150 spectrum    1 weight  0.10000E+01 volume  0.86584E-03 ppm1      4.032 ppm2      0.716 CV     1
 ASSI { 2152}
   (( segid "T22D" and resid 75   and name HB2 ))
   (( segid "T22D" and resid 44   and name HB2 ))
      5.000     3.100     1.000 peak  2152 spectrum    1 weight  0.10000E+01 volume  0.43127E-03 ppm1      4.224 ppm2      2.832 CV     1
 ASSI { 2153}
   (( segid "T22D" and resid 75   and name HB1 ))
   (( segid "T22D" and resid 44   and name HB1 ))
      3.700     1.700     1.700 peak  2153 spectrum    1 weight  0.10000E+01 volume  0.69061E-03 ppm1      4.021 ppm2      3.255 CV     1
 ASSI { 2154}
   (( segid "T22D" and resid 75   and name HB2 ))
   (( segid "T22D" and resid 44   and name HB1 ))
      3.600     1.600     1.600 peak  2154 spectrum    1 weight  0.10000E+01 volume  0.57856E-03 ppm1      4.215 ppm2      3.261 CV     1
 ASSI { 2155}
   (( segid "T22D" and resid 75   and name HB2 ))
   (  segid "T22D" and resid 68   and name HG2%)
      3.600     1.700     1.700 peak  2155 spectrum    1 weight  0.10000E+01 volume  0.15250E-02 ppm1      4.214 ppm2      0.965 CV     1
 ASSI { 2156}
   (( segid "T22D" and resid 75   and name HB1 ))
   (( segid "T22D" and resid 75   and name HB2 ))
      1.900     0.500     0.500 peak  2156 spectrum    1 weight  0.10000E+01 volume  0.81505E-02 ppm1      4.026 ppm2      4.218 CV     1
 ASSI { 2160}
   (( segid "T22D" and resid 75   and name HB1 ))
   (  segid "T22D" and resid 44   and name HD% )
      3.400     1.500     1.500 peak  2160 spectrum    1 weight  0.10000E+01 volume  0.12127E-02 ppm1      4.027 ppm2      6.826 CV     1
 ASSI { 2161}
   (( segid "T22D" and resid 75   and name HB2 ))
   (  segid "T22D" and resid 44   and name HD% )
      3.700     1.700     1.700 peak  2161 spectrum    1 weight  0.10000E+01 volume  0.72252E-03 ppm1      4.213 ppm2      6.815 CV     1
 ASSI { 2162}
   (( segid "T22D" and resid 50   and name HA  ))
   (( segid "T22D" and resid 49   and name HB2 ))
      3.000     3.000     3.000 peak  2162 spectrum    1 weight  0.10000E+01 volume  0.50955E-03 ppm1      4.194 ppm2      1.907 CV     1
 ASSI { 2163}
   (( segid "T22D" and resid 50   and name HA  ))
   (( segid "T22D" and resid 53   and name HB1 ))
      3.400     1.400     1.400 peak  2163 spectrum    1 weight  0.10000E+01 volume  0.28095E-02 ppm1      4.175 ppm2      2.061 CV     1
 ASSI { 2167}
   (( segid "T22D" and resid 50   and name HA  ))
   (( segid "T22D" and resid 50   and name HB  ))
      2.400     0.700     0.700 peak  2167 spectrum    1 weight  0.10000E+01 volume  0.68482E-02 ppm1      4.176 ppm2      4.488 CV     1
 ASSI { 2170}
   (( segid "T22D" and resid 46   and name HA  ))
   (( segid "T22D" and resid 45   and name HD2 ))
      2.800     2.800     3.200 peak  2170 spectrum    1 weight  0.10000E+01 volume  0.89387E-03 ppm1      4.024 ppm2      7.121 CV     1
 ASSI { 2171}
   (( segid "T22D" and resid 46   and name HA  ))
   (( segid "T22D" and resid 46   and name HB  ))
      2.700     0.900     0.900 peak  2171 spectrum    1 weight  0.10000E+01 volume  0.34733E-02 ppm1      4.019 ppm2      3.738 CV     1
 ASSI { 2172}
   (( segid "T22D" and resid 46   and name HA  ))
   (( segid "T22D" and resid 43   and name HG1 ))
      4.900     3.000     1.100 peak  2172 spectrum    1 weight  0.10000E+01 volume  0.47243E-03 ppm1      4.033 ppm2      2.232 CV     1
 ASSI { 2174}
   (( segid "T22D" and resid 46   and name HA  ))
   (( segid "T22D" and resid 50   and name HB  ))
      3.800     1.800     1.800 peak  2174 spectrum    1 weight  0.10000E+01 volume  0.94266E-03 ppm1      4.034 ppm2      4.487 CV     1
 ASSI { 2176}
   (( segid "T22D" and resid 50   and name HB  ))
   (( segid "T22D" and resid 49   and name HA  ))
      2.800     2.800     3.200 peak  2176 spectrum    1 weight  0.10000E+01 volume  0.77518E-02 ppm1      4.486 ppm2      4.178 CV     1
 ASSI { 2180}
   (( segid "T22D" and resid 46   and name HB  ))
   (( segid "T22D" and resid 43   and name HB2 ))
      4.200     2.200     1.800 peak  2180 spectrum    1 weight  0.10000E+01 volume  0.61576E-03 ppm1      3.726 ppm2      1.621 CV     1
 ASSI { 2181}
   (( segid "T22D" and resid 47   and name HB1 ))
   (( segid "T22D" and resid 47   and name HB2 ))
      1.800     0.400     0.400 peak  2181 spectrum    1 weight  0.10000E+01 volume  0.12075E-01 ppm1      3.987 ppm2      4.433 CV     1
 ASSI { 2185}
   (( segid "T22D" and resid 46   and name HB  ))
   (  segid "T22D" and resid 42   and name HD2%)
      3.700     1.700     1.700 peak  2185 spectrum    1 weight  0.10000E+01 volume  0.93832E-03 ppm1      3.737 ppm2      0.666 CV     1
 ASSI { 2186}
   (( segid "T22D" and resid 46   and name HB  ))
   (( segid "T22D" and resid 42   and name HB2 ))
      3.800     1.800     1.800 peak  2186 spectrum    1 weight  0.10000E+01 volume  0.14113E-02 ppm1      3.742 ppm2      0.942 CV     1
 ASSI { 2189}
   (( segid "T22D" and resid 46   and name HB  ))
   (  segid "T22D" and resid 66   and name HG2%)
      3.300     1.400     1.400 peak  2189 spectrum    1 weight  0.10000E+01 volume  0.93273E-03 ppm1      3.748 ppm2      0.595 CV     1
 ASSI { 2190}
   (( segid "T22D" and resid 32   and name HB  ))
   (( segid "T22D" and resid 36   and name HB2 ))
      2.500     0.800     0.800 peak  2190 spectrum    1 weight  0.10000E+01 volume  0.21795E-02 ppm1      4.636 ppm2      2.047 CV     1
 ASSI { 2191}
   (( segid "T22D" and resid 32   and name HB  ))
   (  segid "T22D" and resid 32   and name HG2%)
      2.100     0.500     0.500 peak  2191 spectrum    1 weight  0.10000E+01 volume  0.12747E-01 ppm1      4.638 ppm2      1.071 CV     1
 ASSI { 2192}
   (( segid "T22D" and resid 32   and name HB  ))
   (( segid "T22D" and resid 36   and name HB1 ))
      2.500     0.800     0.800 peak  2192 spectrum    1 weight  0.10000E+01 volume  0.33453E-02 ppm1      4.638 ppm2      1.783 CV     1
 ASSI { 2193}
   (( segid "T22D" and resid 32   and name HB  ))
   (( segid "T22D" and resid 36   and name HD1 ))
      3.200     1.300     1.300 peak  2193 spectrum    1 weight  0.10000E+01 volume  0.88740E-03 ppm1      4.631 ppm2      1.508 CV     1
 ASSI { 2194}
   (( segid "T22D" and resid 32   and name HB  ))
   (  segid "T22D" and resid 82   and name HG2%)
      3.300     3.300     2.700 peak  2194 spectrum    1 weight  0.10000E+01 volume  0.25849E-02 ppm1      4.631 ppm2      1.158 CV     1
 ASSI { 2195}
   (( segid "T22D" and resid 32   and name HB  ))
   (( segid "T22D" and resid 36   and name HG1 ))
      4.500     2.500     1.500 peak  2195 spectrum    1 weight  0.10000E+01 volume  0.50742E-03 ppm1      4.640 ppm2      0.979 CV     1
 ASSI { 2196}
   (( segid "T22D" and resid 32   and name HB  ))
   (( segid "T22D" and resid 36   and name HD2 ))
      3.200     1.300     1.300 peak  2196 spectrum    1 weight  0.10000E+01 volume  0.76714E-03 ppm1      4.635 ppm2      1.614 CV     1
 ASSI { 2197}
   (( segid "T22D" and resid 82   and name HB  ))
   (( segid "T22D" and resid 62   and name HA  ))
      4.200     2.300     1.800 peak  2197 spectrum    1 weight  0.10000E+01 volume  0.10554E-02 ppm1      3.907 ppm2      4.411 CV     1
 ASSI { 2198}
   (( segid "T22D" and resid 82   and name HB  ))
   (( segid "T22D" and resid 63   and name HA  ))
      4.100     2.100     1.900 peak  2198 spectrum    1 weight  0.10000E+01 volume  0.75750E-03 ppm1      3.914 ppm2      4.532 CV     1
 ASSI { 2199}
   (( segid "T22D" and resid 82   and name HB  ))
   (( segid "T22D" and resid 61   and name HG12))
      4.200     2.200     1.800 peak  2199 spectrum    1 weight  0.10000E+01 volume  0.52227E-03 ppm1      3.917 ppm2      0.934 CV     1
 ASSI { 2200}
   (( segid "T22D" and resid 82   and name HB  ))
   (  segid "T22D" and resid 61   and name HG2%)
      4.400     2.400     1.600 peak  2200 spectrum    1 weight  0.10000E+01 volume  0.52790E-03 ppm1      3.907 ppm2      0.588 CV     1
 ASSI { 2201}
   (( segid "T22D" and resid 82   and name HB  ))
   (  segid "T22D" and resid 81   and name HG1%)
      4.200     2.200     1.800 peak  2201 spectrum    1 weight  0.10000E+01 volume  0.56347E-03 ppm1      3.903 ppm2      0.525 CV     1
 ASSI { 2203}
   (( segid "T22D" and resid 82   and name HB  ))
   (  segid "T22D" and resid 32   and name HG2%)
      2.800     2.800     3.200 peak  2203 spectrum    1 weight  0.10000E+01 volume  0.78248E-03 ppm1      3.924 ppm2      1.068 CV     1
 ASSI { 2206}
   (( segid "T22D" and resid 82   and name HB  ))
   (( segid "T22D" and resid 63   and name HB1 ))
      2.700     0.900     0.900 peak  2206 spectrum    1 weight  0.10000E+01 volume  0.21376E-02 ppm1      3.916 ppm2      1.979 CV     1
 ASSI { 2207}
   (( segid "T22D" and resid 82   and name HB  ))
   (( segid "T22D" and resid 63   and name HB2 ))
      3.400     1.500     1.500 peak  2207 spectrum    1 weight  0.10000E+01 volume  0.27182E-02 ppm1      3.910 ppm2      2.106 CV     1
 ASSI { 2210}
   (( segid "T22D" and resid 35   and name HB  ))
   (( segid "T22D" and resid 83   and name HB2 ))
      3.300     1.400     1.400 peak  2210 spectrum    1 weight  0.10000E+01 volume  0.10865E-02 ppm1      4.581 ppm2      1.995 CV     1
 ASSI { 2217}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 72   and name HA  ))
      2.000     0.500     0.500 peak  2217 spectrum    1 weight  0.10000E+01 volume  0.18311E-01 ppm1      4.330 ppm2      4.366 CV     1
 ASSI { 2219}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 74   and name HE2 ))
      4.300     2.300     1.700 peak  2219 spectrum    1 weight  0.10000E+01 volume  0.41180E-03 ppm1      4.317 ppm2      2.847 CV     1
 ASSI { 2221}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 74   and name HB2 ))
      4.500     2.500     1.500 peak  2221 spectrum    1 weight  0.10000E+01 volume  0.52093E-03 ppm1      4.322 ppm2      1.773 CV     1
 ASSI { 2222}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 74   and name HG1 ))
      2.600     0.800     0.800 peak  2222 spectrum    1 weight  0.10000E+01 volume  0.26429E-02 ppm1      4.324 ppm2      1.380 CV     1
 OR { 2222}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 74   and name HG2 ))
 ASSI { 2223}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 73   and name HG1 ))
      4.400     2.400     1.600 peak  2223 spectrum    1 weight  0.10000E+01 volume  0.42202E-03 ppm1      4.337 ppm2      2.295 CV     1
 OR { 2223}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 73   and name HG2 ))
 ASSI { 2224}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 74   and name HB1 ))
      4.500     2.500     1.500 peak  2224 spectrum    1 weight  0.10000E+01 volume  0.13998E-02 ppm1      4.318 ppm2      1.575 CV     1
 ASSI { 2225}
   (( segid "T22D" and resid 72   and name HB  ))
   (( segid "T22D" and resid 74   and name HE1 ))
      4.400     2.400     1.600 peak  2225 spectrum    1 weight  0.10000E+01 volume  0.39881E-03 ppm1      4.311 ppm2      2.729 CV     1
 ASSI { 2226}
   (( segid "T22D" and resid 68   and name HB  ))
   (( segid "T22D" and resid 76   and name HG2 ))
      5.100     3.200     0.900 peak  2226 spectrum    1 weight  0.10000E+01 volume  0.43261E-03 ppm1      3.661 ppm2      1.499 CV     1
 ASSI { 2227}
   (( segid "T22D" and resid 68   and name HB  ))
   (( segid "T22D" and resid 69   and name HB1 ))
      4.300     2.300     1.700 peak  2227 spectrum    1 weight  0.10000E+01 volume  0.53098E-03 ppm1      3.663 ppm2      2.492 CV     1
 ASSI { 2228}
   (( segid "T22D" and resid 68   and name HB  ))
   (( segid "T22D" and resid 75   and name HA  ))
      3.400     1.400     1.400 peak  2228 spectrum    1 weight  0.10000E+01 volume  0.19909E-02 ppm1      3.673 ppm2      4.182 CV     1
 ASSI { 2231}
   (( segid "T22D" and resid 68   and name HB  ))
   (( segid "T22D" and resid 73   and name HG2 ))
      4.300     2.300     1.700 peak  2231 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      3.668 ppm2      2.291 CV     1
 OR { 2231}
   (( segid "T22D" and resid 68   and name HB  ))
   (( segid "T22D" and resid 73   and name HG1 ))
 ASSI { 2234}
   (  segid "T22D" and resid 44   and name HE% )
   (( segid "T22D" and resid 77   and name HA1 ))
      3.200     1.200     1.200 peak  2234 spectrum    1 weight  0.10000E+01 volume  0.10882E-02 ppm1      6.019 ppm2      3.238 CV     1
 ASSI { 2236}
   (  segid "T22D" and resid 44   and name HE% )
   (( segid "T22D" and resid 77   and name HA2 ))
      3.300     1.400     1.400 peak  2236 spectrum    1 weight  0.10000E+01 volume  0.15775E-02 ppm1      6.015 ppm2      4.249 CV     1
 ASSI { 2237}
   (  segid "T22D" and resid 44   and name HE% )
   (( segid "3T5T" and resid 1    and name H1' ))
      3.500     1.500     1.500 peak  2237 spectrum    1 weight  0.10000E+01 volume  0.86597E-03 ppm1      6.028 ppm2      6.171 CV     1
 ASSI { 2239}
   (  segid "T22D" and resid 44   and name HE% )
   (  segid "T22D" and resid 78   and name HE% )
      3.800     3.800     2.200 peak  2239 spectrum    1 weight  0.10000E+01 volume  0.74854E-03 ppm1      6.020 ppm2      6.611 CV     1
 ASSI { 2242}
   (  segid "T22D" and resid 44   and name HE% )
   (( segid "T22D" and resid 44   and name HB2 ))
      4.600     2.600     1.400 peak  2242 spectrum    1 weight  0.10000E+01 volume  0.57156E-03 ppm1      6.024 ppm2      2.810 CV     1
 ASSI { 2245}
   (  segid "T22D" and resid 54   and name HE% )
   (  segid "T22D" and resid 58   and name HE% )
      3.400     1.400     1.400 peak  2245 spectrum    1 weight  0.10000E+01 volume  0.10526E-02 ppm1      6.448 ppm2      6.962 CV     1
 ASSI { 2248}
   (  segid "T22D" and resid 54   and name HE% )
   (  segid "T22D" and resid 54   and name HD% )
      2.700     0.900     0.900 peak  2248 spectrum    1 weight  0.10000E+01 volume  0.26293E-02 ppm1      6.457 ppm2      6.351 CV     1
 ASSI { 2249}
   (  segid "T22D" and resid 54   and name HE% )
   (  segid "T22D" and resid 55   and name HE% )
      3.800     1.800     1.800 peak  2249 spectrum    1 weight  0.10000E+01 volume  0.80304E-03 ppm1      6.444 ppm2      7.301 CV     1
 ASSI { 2252}
   (  segid "T22D" and resid 54   and name HE% )
   (( segid "T22D" and resid 98   and name HB1 ))
      3.700     1.700     1.700 peak  2252 spectrum    1 weight  0.10000E+01 volume  0.53353E-03 ppm1      6.456 ppm2      2.120 CV     1
 ASSI { 2253}
   (  segid "T22D" and resid 54   and name HE% )
   (( segid "T22D" and resid 92   and name HA  ))
      4.600     2.700     1.400 peak  2253 spectrum    1 weight  0.10000E+01 volume  0.29863E-03 ppm1      6.451 ppm2      1.931 CV     1
 ASSI { 2255}
   (  segid "T22D" and resid 54   and name HE% )
   (( segid "T22D" and resid 98   and name HG1 ))
      4.500     2.500     1.500 peak  2255 spectrum    1 weight  0.10000E+01 volume  0.29444E-03 ppm1      6.437 ppm2      1.995 CV     1
 OR { 2255}
   (  segid "T22D" and resid 54   and name HE% )
   (( segid "T22D" and resid 98   and name HG2 ))
 ASSI { 2257}
   (  segid "T22D" and resid 54   and name HE% )
   (( segid "T22D" and resid 98   and name HA  ))
      4.900     3.000     1.100 peak  2257 spectrum    1 weight  0.10000E+01 volume  0.43386E-03 ppm1      6.435 ppm2      4.468 CV     1
 ASSI { 2258}
   (  segid "T22D" and resid 54   and name HE% )
   (( segid "T22D" and resid 55   and name HZ  ))
      4.100     2.100     1.900 peak  2258 spectrum    1 weight  0.10000E+01 volume  0.43820E-03 ppm1      6.437 ppm2      7.193 CV     1
 ASSI { 2259}
   (  segid "T22D" and resid 54   and name HE% )
   (  segid "T22D" and resid 55   and name HD% )
      4.500     2.500     1.500 peak  2259 spectrum    1 weight  0.10000E+01 volume  0.47160E-03 ppm1      6.428 ppm2      7.772 CV     1
 ASSI { 2261}
   (  segid "T22D" and resid 54   and name HE% )
   (( segid "T22D" and resid 54   and name HA  ))
      4.200     2.200     1.800 peak  2261 spectrum    1 weight  0.10000E+01 volume  0.61726E-03 ppm1      6.441 ppm2      4.096 CV     1
 ASSI { 2263}
   (  segid "T22D" and resid 78   and name HE% )
   (  segid "T22D" and resid 78   and name HD% )
      3.400     1.400     1.400 peak  2263 spectrum    1 weight  0.10000E+01 volume  0.66017E-03 ppm1      6.613 ppm2      6.378 CV     1
 ASSI { 2264}
   (  segid "T22D" and resid 78   and name HE% )
   (( segid "T22D" and resid 76   and name HB1 ))
      3.100     1.200     1.200 peak  2264 spectrum    1 weight  0.10000E+01 volume  0.94787E-03 ppm1      6.606 ppm2      1.350 CV     1
 ASSI { 2266}
   (  segid "T22D" and resid 78   and name HE% )
   (( segid "3T5T" and resid 4    and name H1' ))
      3.000     3.000     3.000 peak  2266 spectrum    1 weight  0.10000E+01 volume  0.57519E-03 ppm1      6.611 ppm2      6.280 CV     1
 ASSI { 2268}
   (  segid "T22D" and resid 78   and name HE% )
   (  segid "T22D" and resid 67   and name HD1%)
      5.000     3.100     1.000 peak  2268 spectrum    1 weight  0.10000E+01 volume  0.54082E-03 ppm1      6.620 ppm2      0.765 CV     1
 ASSI { 2272}
   (  segid "T22D" and resid 111  and name HE% )
   (( segid "T22D" and resid 112  and name HB1 ))
      4.200     2.200     1.800 peak  2272 spectrum    1 weight  0.10000E+01 volume  0.13371E-02 ppm1      6.723 ppm2      1.485 CV     1
 ASSI { 2275}
   (  segid "T22D" and resid 111  and name HE% )
   (( segid "T22D" and resid 109  and name HB2 ))
      2.800     1.000     1.000 peak  2275 spectrum    1 weight  0.10000E+01 volume  0.17640E-02 ppm1      6.721 ppm2      1.889 CV     1
 ASSI { 2276}
   (  segid "T22D" and resid 111  and name HE% )
   (( segid "T22D" and resid 109  and name HB1 ))
      3.000     1.100     1.100 peak  2276 spectrum    1 weight  0.10000E+01 volume  0.19891E-02 ppm1      6.728 ppm2      1.798 CV     1
 ASSI { 2277}
   (  segid "T22D" and resid 111  and name HE% )
   (  segid "T22D" and resid 34   and name HE% )
      3.300     1.400     1.400 peak  2277 spectrum    1 weight  0.10000E+01 volume  0.14396E-02 ppm1      6.717 ppm2      7.305 CV     1
 ASSI { 2280}
   (  segid "T22D" and resid 111  and name HE% )
   (( segid "T22D" and resid 34   and name HA  ))
      3.500     1.500     1.500 peak  2280 spectrum    1 weight  0.10000E+01 volume  0.21266E-02 ppm1      6.709 ppm2      4.968 CV     1
 ASSI { 2281}
   (  segid "T22D" and resid 111  and name HE% )
   (  segid "T22D" and resid 111  and name HD% )
      1.900     0.500     0.500 peak  2281 spectrum    1 weight  0.10000E+01 volume  0.17944E-01 ppm1      6.727 ppm2      7.096 CV     1
 ASSI { 2282}
   (  segid "T22D" and resid 111  and name HE% )
   (  segid "T22D" and resid 34   and name HD% )
      2.500     2.500     3.500 peak  2282 spectrum    1 weight  0.10000E+01 volume  0.17631E-02 ppm1      6.727 ppm2      7.235 CV     1
 ASSI { 2292}
   (( segid "T22D" and resid 45   and name HD2 ))
   (( segid "T22D" and resid 45   and name HB2 ))
      3.400     1.500     1.500 peak  2292 spectrum    1 weight  0.10000E+01 volume  0.79099E-03 ppm1      7.118 ppm2      3.436 CV     1
 ASSI { 2299}
   (( segid "T22D" and resid 38   and name HZ  ))
   (  segid "T22D" and resid 38   and name HE% )
      3.300     1.400     1.400 peak  2299 spectrum    1 weight  0.10000E+01 volume  0.80179E-03 ppm1      5.403 ppm2      6.381 CV     1
 ASSI { 2301}
   (( segid "T22D" and resid 38   and name HZ  ))
   (  segid "T22D" and resid 38   and name HD% )
      4.800     2.900     1.200 peak  2301 spectrum    1 weight  0.10000E+01 volume  0.30720E-03 ppm1      5.389 ppm2      6.706 CV     1
 ASSI { 2302}
   (( segid "T22D" and resid 38   and name HZ  ))
   (( segid "3T5T" and resid 4    and name H8  ))
      4.300     2.300     1.700 peak  2302 spectrum    1 weight  0.10000E+01 volume  0.36017E-03 ppm1      5.364 ppm2      7.837 CV     1
 ASSI { 2305}
   (( segid "T22D" and resid 38   and name HZ  ))
   (( segid "3T5T" and resid 5    and name H73 ))
      4.500     2.500     1.500 peak  2305 spectrum    1 weight  0.10000E+01 volume  0.57418E-03 ppm1      5.416 ppm2      1.150 CV     1
 OR { 2305}
   (( segid "T22D" and resid 38   and name HZ  ))
   (( segid "3T5T" and resid 5    and name H72 ))
 OR { 2305}
   (( segid "T22D" and resid 38   and name HZ  ))
   (( segid "3T5T" and resid 5    and name H71 ))
 ASSI { 2306}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "3T5T" and resid 6    and name H5''))
      4.600     2.700     1.400 peak  2306 spectrum    1 weight  0.10000E+01 volume  0.44358E-03 ppm1      7.299 ppm2      4.243 CV     1
 ASSI { 2307}
   (( segid "T22D" and resid 80   and name HZ  ))
   (  segid "T22D" and resid 78   and name HD% )
      3.300     3.300     2.700 peak  2307 spectrum    1 weight  0.10000E+01 volume  0.34118E-03 ppm1      7.305 ppm2      6.368 CV     1
 ASSI { 2308}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "3T5T" and resid 5    and name H1' ))
      2.100     0.600     0.600 peak  2308 spectrum    1 weight  0.10000E+01 volume  0.29866E-02 ppm1      7.309 ppm2      6.572 CV     1
 ASSI { 2309}
   (( segid "T22D" and resid 80   and name HZ  ))
   (  segid "T22D" and resid 80   and name HE% )
      2.600     0.900     0.900 peak  2309 spectrum    1 weight  0.10000E+01 volume  0.20000E-02 ppm1      7.308 ppm2      7.146 CV     1
 ASSI { 2310}
   (( segid "T22D" and resid 80   and name HZ  ))
   (  segid "T22D" and resid 78   and name HE% )
      3.600     1.600     1.600 peak  2310 spectrum    1 weight  0.10000E+01 volume  0.95821E-03 ppm1      7.308 ppm2      6.628 CV     1
 ASSI { 2312}
   (( segid "T22D" and resid 80   and name HZ  ))
   (  segid "T22D" and resid 38   and name HD% )
      3.800     1.800     1.800 peak  2312 spectrum    1 weight  0.10000E+01 volume  0.35472E-03 ppm1      7.313 ppm2      6.675 CV     1
 ASSI { 2313}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "3T5T" and resid 6    and name H5' ))
      3.900     1.900     1.900 peak  2313 spectrum    1 weight  0.10000E+01 volume  0.44454E-03 ppm1      7.304 ppm2      4.423 CV     1
 ASSI { 2314}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "3T5T" and resid 5    and name H4' ))
      3.700     1.700     1.700 peak  2314 spectrum    1 weight  0.10000E+01 volume  0.93336E-03 ppm1      7.301 ppm2      4.595 CV     1
 ASSI { 2315}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "T22D" and resid 67   and name HG11))
      4.700     2.700     1.300 peak  2315 spectrum    1 weight  0.10000E+01 volume  0.33378E-03 ppm1      7.292 ppm2      1.341 CV     1
 OR { 2315}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "T22D" and resid 67   and name HG12))
 ASSI { 2316}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "3T5T" and resid 5    and name H2' ))
      5.900     4.400     0.100 peak  2316 spectrum    1 weight  0.10000E+01 volume  0.28910E-03 ppm1      7.292 ppm2      2.115 CV     1
 ASSI { 2317}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "T22D" and resid 38   and name HB1 ))
      5.500     3.800     0.500 peak  2317 spectrum    1 weight  0.10000E+01 volume  0.27565E-03 ppm1      7.306 ppm2      2.629 CV     1
 ASSI { 2320}
   (( segid "T22D" and resid 55   and name HZ  ))
   (  segid "T22D" and resid 55   and name HD% )
      4.000     2.000     2.000 peak  2320 spectrum    1 weight  0.10000E+01 volume  0.60767E-03 ppm1      7.159 ppm2      7.785 CV     1
 ASSI { 2321}
   (( segid "T22D" and resid 55   and name HZ  ))
   (  segid "T22D" and resid 55   and name HE% )
      2.000     0.500     0.500 peak  2321 spectrum    1 weight  0.10000E+01 volume  0.96238E-02 ppm1      7.195 ppm2      7.308 CV     1
 ASSI { 2322}
   (( segid "T22D" and resid 55   and name HZ  ))
   (  segid "T22D" and resid 39   and name HG1%)
      2.700     0.900     0.900 peak  2322 spectrum    1 weight  0.10000E+01 volume  0.16108E-02 ppm1      7.173 ppm2      0.678 CV     1
 ASSI { 2326}
   (  segid "T22D" and resid 80   and name HE% )
   (  segid "T22D" and resid 80   and name HD% )
      2.600     0.900     0.900 peak  2326 spectrum    1 weight  0.10000E+01 volume  0.25311E-02 ppm1      7.151 ppm2      6.584 CV     1
 ASSI { 2328}
   (( segid "T22D" and resid 58   and name HZ  ))
   (  segid "T22D" and resid 92   and name HB% )
      4.000     2.000     2.000 peak  2328 spectrum    1 weight  0.10000E+01 volume  0.63065E-03 ppm1      7.302 ppm2      1.427 CV     1
 ASSI { 2334}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "T22D" and resid 80   and name HB2 ))
      4.700     2.700     1.300 peak  2334 spectrum    1 weight  0.10000E+01 volume  0.44829E-03 ppm1      7.156 ppm2      2.768 CV     1
 ASSI { 2338}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "3T5T" and resid 6    and name H5''))
      4.400     2.400     1.600 peak  2338 spectrum    1 weight  0.10000E+01 volume  0.76551E-03 ppm1      7.145 ppm2      4.245 CV     1
 ASSI { 2339}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "T22D" and resid 110  and name HA  ))
      4.300     2.300     1.700 peak  2339 spectrum    1 weight  0.10000E+01 volume  0.57110E-03 ppm1      7.145 ppm2      4.125 CV     1
 ASSI { 2340}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "3T5T" and resid 6    and name H5' ))
      3.300     1.400     1.400 peak  2340 spectrum    1 weight  0.10000E+01 volume  0.61242E-03 ppm1      7.134 ppm2      4.424 CV     1
 ASSI { 2341}
   (  segid "T22D" and resid 80   and name HE% )
   (  segid "T22D" and resid 78   and name HE% )
      3.300     1.400     1.400 peak  2341 spectrum    1 weight  0.10000E+01 volume  0.11424E-02 ppm1      7.141 ppm2      6.660 CV     1
 ASSI { 2344}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "T22D" and resid 37   and name HA  ))
      4.600     2.600     1.400 peak  2344 spectrum    1 weight  0.10000E+01 volume  0.40711E-03 ppm1      7.140 ppm2      4.212 CV     1
 ASSI { 2346}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "3T5T" and resid 5    and name H4' ))
      3.200     1.300     1.300 peak  2346 spectrum    1 weight  0.10000E+01 volume  0.14694E-02 ppm1      7.138 ppm2      4.607 CV     1
 ASSI { 2347}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "3T5T" and resid 6    and name H4' ))
      3.700     1.700     1.700 peak  2347 spectrum    1 weight  0.10000E+01 volume  0.12820E-02 ppm1      7.138 ppm2      4.582 CV     1
 ASSI { 2349}
   (  segid "T22D" and resid 80   and name HE% )
   (  segid "T22D" and resid 67   and name HD1%)
      3.800     1.800     1.800 peak  2349 spectrum    1 weight  0.10000E+01 volume  0.11491E-02 ppm1      7.148 ppm2      0.763 CV     1
 ASSI { 2351}
   (( segid "T22D" and resid 58   and name HZ  ))
   (  segid "T22D" and resid 58   and name HE% )
      2.600     0.900     0.900 peak  2351 spectrum    1 weight  0.10000E+01 volume  0.34722E-02 ppm1      7.272 ppm2      6.966 CV     1
 ASSI { 2352}
   (( segid "T22D" and resid 58   and name HZ  ))
   (  segid "T22D" and resid 54   and name HE% )
      3.700     1.700     1.700 peak  2352 spectrum    1 weight  0.10000E+01 volume  0.48903E-03 ppm1      7.274 ppm2      6.450 CV     1
 ASSI { 2354}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "3T5T" and resid 4    and name H1' ))
      4.200     2.300     1.800 peak  2354 spectrum    1 weight  0.10000E+01 volume  0.38711E-03 ppm1      6.403 ppm2      6.284 CV     1
 ASSI { 2355}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "3T5T" and resid 5    and name H1' ))
      4.300     2.300     1.700 peak  2355 spectrum    1 weight  0.10000E+01 volume  0.28030E-03 ppm1      6.417 ppm2      6.597 CV     1
 ASSI { 2358}
   (  segid "T22D" and resid 38   and name HD% )
   (( segid "3T5T" and resid 5    and name H72 ))
      4.000     2.000     2.000 peak  2358 spectrum    1 weight  0.10000E+01 volume  0.45062E-03 ppm1      6.692 ppm2      1.165 CV     1
 OR { 2358}
   (  segid "T22D" and resid 38   and name HD% )
   (( segid "3T5T" and resid 5    and name H73 ))
 OR { 2358}
   (  segid "T22D" and resid 38   and name HD% )
   (( segid "3T5T" and resid 5    and name H71 ))
 ASSI { 2362}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "T22D" and resid 79   and name HA1 ))
      4.700     2.800     1.300 peak  2362 spectrum    1 weight  0.10000E+01 volume  0.34494E-03 ppm1      6.380 ppm2      3.800 CV     1
 ASSI { 2363}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "3T5T" and resid 6    and name H5' ))
      4.100     2.100     1.900 peak  2363 spectrum    1 weight  0.10000E+01 volume  0.39402E-03 ppm1      6.367 ppm2      4.427 CV     1
 ASSI { 2364}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "T22D" and resid 39   and name HA  ))
      4.200     2.200     1.800 peak  2364 spectrum    1 weight  0.10000E+01 volume  0.37752E-03 ppm1      6.358 ppm2      4.382 CV     1
 ASSI { 2365}
   (  segid "T22D" and resid 80   and name HD% )
   (( segid "T22D" and resid 38   and name HA  ))
      3.100     1.200     1.200 peak  2365 spectrum    1 weight  0.10000E+01 volume  0.10679E-02 ppm1      6.598 ppm2      4.589 CV     1
 ASSI { 2368}
   (  segid "T22D" and resid 80   and name HD% )
   (( segid "3T5T" and resid 6    and name H5' ))
      4.300     2.300     1.700 peak  2368 spectrum    1 weight  0.10000E+01 volume  0.54554E-03 ppm1      6.607 ppm2      4.428 CV     1
 ASSI { 2369}
   (  segid "T22D" and resid 80   and name HD% )
   (( segid "T22D" and resid 36   and name HG2 ))
      3.700     1.700     1.700 peak  2369 spectrum    1 weight  0.10000E+01 volume  0.32595E-03 ppm1      6.600 ppm2      1.377 CV     1
 ASSI { 2373}
   (  segid "T22D" and resid 80   and name HD% )
   (  segid "T22D" and resid 65   and name HG2%)
      3.400     1.500     1.500 peak  2373 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      6.591 ppm2      0.937 CV     1
 ASSI { 2374}
   (  segid "T22D" and resid 80   and name HD% )
   (( segid "T22D" and resid 80   and name HB2 ))
      2.800     1.000     1.000 peak  2374 spectrum    1 weight  0.10000E+01 volume  0.19857E-02 ppm1      6.600 ppm2      2.780 CV     1
 ASSI { 2375}
   (  segid "T22D" and resid 80   and name HD% )
   (( segid "T22D" and resid 110  and name HA  ))
      4.500     2.500     1.500 peak  2375 spectrum    1 weight  0.10000E+01 volume  0.54107E-03 ppm1      6.599 ppm2      4.130 CV     1
 ASSI { 2376}
   (  segid "T22D" and resid 55   and name HE% )
   (( segid "T22D" and resid 51   and name HB1 ))
      3.300     1.400     1.400 peak  2376 spectrum    1 weight  0.10000E+01 volume  0.10542E-02 ppm1      7.316 ppm2      1.926 CV     1
 ASSI { 2380}
   (  segid "T22D" and resid 38   and name HD% )
   (( segid "3T5T" and resid 5    and name H1' ))
      3.200     1.300     1.300 peak  2380 spectrum    1 weight  0.10000E+01 volume  0.22259E-02 ppm1      6.675 ppm2      6.595 CV     1
 ASSI { 2382}
   (  segid "T22D" and resid 38   and name HD% )
   (  segid "T22D" and resid 38   and name HE% )
      3.100     1.200     1.200 peak  2382 spectrum    1 weight  0.10000E+01 volume  0.11583E-02 ppm1      6.661 ppm2      6.392 CV     1
 ASSI { 2388}
   (  segid "T22D" and resid 55   and name HE% )
   (  segid "T22D" and resid 55   and name HD% )
      2.500     0.800     0.800 peak  2388 spectrum    1 weight  0.10000E+01 volume  0.28320E-02 ppm1      7.308 ppm2      7.781 CV     1
 ASSI { 2393}
   (  segid "T22D" and resid 44   and name HD% )
   (( segid "T22D" and resid 44   and name HA  ))
      2.400     0.700     0.700 peak  2393 spectrum    1 weight  0.10000E+01 volume  0.42856E-02 ppm1      6.822 ppm2      4.236 CV     1
 ASSI { 2394}
   (  segid "T22D" and resid 44   and name HD% )
   (( segid "T22D" and resid 45   and name HD2 ))
      2.900     2.900     3.100 peak  2394 spectrum    1 weight  0.10000E+01 volume  0.66551E-03 ppm1      6.835 ppm2      7.083 CV     1
 ASSI { 2398}
   (  segid "T22D" and resid 58   and name HD% )
   (( segid "T22D" and resid 55   and name HB2 ))
      4.800     2.800     1.200 peak  2398 spectrum    1 weight  0.10000E+01 volume  0.45154E-03 ppm1      7.340 ppm2      3.258 CV     1
 ASSI { 2400}
   (  segid "T22D" and resid 58   and name HD% )
   (  segid "T22D" and resid 58   and name HE% )
      3.000     1.200     1.200 peak  2400 spectrum    1 weight  0.10000E+01 volume  0.13779E-02 ppm1      7.364 ppm2      6.968 CV     1
 ASSI { 2409}
   (  segid "T22D" and resid 55   and name HD% )
   (  segid "T22D" and resid 58   and name HD% )
      3.600     1.700     1.700 peak  2409 spectrum    1 weight  0.10000E+01 volume  0.83724E-03 ppm1      7.772 ppm2      7.370 CV     1
 ASSI { 2414}
   (  segid "T22D" and resid 55   and name HD% )
   (  segid "T22D" and resid 37   and name HD1%)
      3.200     1.300     1.300 peak  2414 spectrum    1 weight  0.10000E+01 volume  0.87214E-03 ppm1      7.780 ppm2      0.693 CV     1
 ASSI { 2416}
   (  segid "T22D" and resid 55   and name HD% )
   (  segid "T22D" and resid 83   and name HE% )
      3.600     1.600     1.600 peak  2416 spectrum    1 weight  0.10000E+01 volume  0.88786E-03 ppm1      7.766 ppm2      1.932 CV     1
 ASSI { 2419}
   (  segid "T22D" and resid 55   and name HD% )
   (  segid "T22D" and resid 54   and name HD% )
      4.100     2.100     1.900 peak  2419 spectrum    1 weight  0.10000E+01 volume  0.34021E-03 ppm1      7.751 ppm2      6.340 CV     1
 ASSI { 2425}
   (  segid "T22D" and resid 55   and name HD% )
   (( segid "T22D" and resid 51   and name HA  ))
      3.300     1.400     1.400 peak  2425 spectrum    1 weight  0.10000E+01 volume  0.62785E-03 ppm1      7.777 ppm2      4.139 CV     1
 ASSI { 2427}
   (  segid "T22D" and resid 111  and name HD% )
   (( segid "T22D" and resid 109  and name HG  ))
      5.300     3.500     0.700 peak  2427 spectrum    1 weight  0.10000E+01 volume  0.44420E-03 ppm1      7.097 ppm2      2.078 CV     1
 ASSI { 2435}
   (  segid "T22D" and resid 111  and name HD% )
   (( segid "T22D" and resid 109  and name HB2 ))
      3.500     1.500     1.500 peak  2435 spectrum    1 weight  0.10000E+01 volume  0.13067E-02 ppm1      7.092 ppm2      1.892 CV     1
 ASSI { 2439}
   (  segid "T22D" and resid 111  and name HD% )
   (  segid "T22D" and resid 114  and name HB% )
      4.000     2.000     2.000 peak  2439 spectrum    1 weight  0.10000E+01 volume  0.13292E-02 ppm1      7.097 ppm2      1.269 CV     1
 ASSI {    9}
   (( segid "3T5T" and resid 1    and name H1' ))
   (( segid "3T5T" and resid 1    and name H3' ))
      3.500     1.500     1.500 peak     9 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      6.162 ppm2      4.853 CV     1
 ASSI {   10}
   (( segid "3T5T" and resid 1    and name H1' ))
   (( segid "3T5T" and resid 1    and name H4' ))
      2.700     0.900     0.900 peak    10 spectrum    1 weight  0.10000E+01 volume  0.41047E-02 ppm1      6.162 ppm2      4.284 CV     1
 ASSI {   12}
   (( segid "3T5T" and resid 1    and name H1' ))
   (( segid "3T5T" and resid 1    and name H8  ))
      2.700     2.700     3.300 peak    12 spectrum    1 weight  0.10000E+01 volume  0.61726E-02 ppm1      6.160 ppm2      8.004 CV     1
 ASSI {   31}
   (( segid "3T5T" and resid 1    and name H3' ))
   (( segid "3T5T" and resid 1    and name H4' ))
      2.600     0.800     0.800 peak    31 spectrum    1 weight  0.10000E+01 volume  0.50288E-02 ppm1      4.854 ppm2      4.285 CV     1
 ASSI {   33}
   (( segid "3T5T" and resid 1    and name H3' ))
   (( segid "3T5T" and resid 1    and name H5''))
      2.700     0.900     0.900 peak    33 spectrum    1 weight  0.10000E+01 volume  0.32254E-02 ppm1      4.855 ppm2      3.797 CV     1
 ASSI {   34}
   (( segid "3T5T" and resid 1    and name H3' ))
   (( segid "3T5T" and resid 1    and name H8  ))
      3.600     1.600     1.600 peak    34 spectrum    1 weight  0.10000E+01 volume  0.21919E-02 ppm1      4.860 ppm2      8.006 CV     1
 ASSI {   38}
   (( segid "3T5T" and resid 1    and name H4' ))
   (( segid "3T5T" and resid 1    and name H5' ))
      2.500     0.800     0.800 peak    38 spectrum    1 weight  0.10000E+01 volume  0.76292E-02 ppm1      4.285 ppm2      3.823 CV     1
 ASSI {   41}
   (( segid "3T5T" and resid 1    and name H5' ))
   (( segid "3T5T" and resid 1    and name H1' ))
      3.200     1.300     1.300 peak    41 spectrum    1 weight  0.10000E+01 volume  0.23258E-02 ppm1      3.805 ppm2      6.160 CV     1
 ASSI {   44}
   (( segid "3T5T" and resid 1    and name H5' ))
   (( segid "3T5T" and resid 1    and name H3' ))
      2.700     0.900     0.900 peak    44 spectrum    1 weight  0.10000E+01 volume  0.85788E-02 ppm1      3.809 ppm2      4.853 CV     1
 ASSI {   45}
   (( segid "3T5T" and resid 1    and name H5' ))
   (( segid "3T5T" and resid 1    and name H8  ))
      2.700     0.900     0.900 peak    45 spectrum    1 weight  0.10000E+01 volume  0.37539E-02 ppm1      3.808 ppm2      8.006 CV     1
 ASSI {   46}
   (( segid "3T5T" and resid 1    and name H5''))
   (( segid "3T5T" and resid 1    and name H4' ))
      1.900     0.500     0.500 peak    46 spectrum    1 weight  0.10000E+01 volume  0.22728E-01 ppm1      3.812 ppm2      4.284 CV     1
 ASSI {   51}
   (( segid "3T5T" and resid 1    and name H8  ))
   (( segid "3T5T" and resid 1    and name H4' ))
      3.600     1.600     1.600 peak    51 spectrum    1 weight  0.10000E+01 volume  0.15624E-02 ppm1      8.013 ppm2      4.284 CV     1
 ASSI {   54}
   (( segid "3T5T" and resid 2    and name H1' ))
   (( segid "3T5T" and resid 2    and name H2''))
      2.400     0.700     0.700 peak    54 spectrum    1 weight  0.10000E+01 volume  0.60354E-02 ppm1      6.193 ppm2      2.499 CV     1
 ASSI {   55}
   (( segid "3T5T" and resid 2    and name H1' ))
   (( segid "3T5T" and resid 2    and name H3' ))
      3.300     1.400     1.400 peak    55 spectrum    1 weight  0.10000E+01 volume  0.27768E-02 ppm1      6.186 ppm2      4.969 CV     1
 ASSI {   58}
   (( segid "3T5T" and resid 2    and name H1' ))
   (( segid "3T5T" and resid 2    and name H8  ))
      2.900     1.000     1.000 peak    58 spectrum    1 weight  0.10000E+01 volume  0.55454E-02 ppm1      6.188 ppm2      8.075 CV     1
 ASSI {   59}
   (( segid "3T5T" and resid 2    and name H1' ))
   (( segid "3T5T" and resid 3    and name H5' ))
      3.500     1.500     1.500 peak    59 spectrum    1 weight  0.10000E+01 volume  0.10963E-02 ppm1      6.179 ppm2      3.914 CV     1
 ASSI {   61}
   (( segid "3T5T" and resid 2    and name H2' ))
   (( segid "3T5T" and resid 2    and name H1' ))
      2.900     1.000     1.000 peak    61 spectrum    1 weight  0.10000E+01 volume  0.53553E-02 ppm1      2.775 ppm2      6.188 CV     1
 ASSI {   62}
   (( segid "3T5T" and resid 2    and name H2' ))
   (( segid "3T5T" and resid 2    and name H2''))
      2.100     0.500     0.500 peak    62 spectrum    1 weight  0.10000E+01 volume  0.58761E-02 ppm1      2.773 ppm2      2.503 CV     1
 ASSI {   63}
   (( segid "3T5T" and resid 2    and name H2' ))
   (( segid "3T5T" and resid 2    and name H3' ))
      2.400     0.700     0.700 peak    63 spectrum    1 weight  0.10000E+01 volume  0.50208E-02 ppm1      2.775 ppm2      4.966 CV     1
 ASSI {   66}
   (( segid "3T5T" and resid 2    and name H2' ))
   (( segid "3T5T" and resid 2    and name H8  ))
      2.200     0.600     0.600 peak    66 spectrum    1 weight  0.10000E+01 volume  0.78094E-02 ppm1      2.775 ppm2      8.075 CV     1
 ASSI {   67}
   (( segid "3T5T" and resid 2    and name H2' ))
   (( segid "3T5T" and resid 3    and name H5' ))
      4.200     2.200     1.800 peak    67 spectrum    1 weight  0.10000E+01 volume  0.71730E-03 ppm1      2.774 ppm2      3.915 CV     1
 ASSI {   68}
   (( segid "3T5T" and resid 2    and name H2' ))
   (( segid "3T5T" and resid 3    and name H72 ))
      4.200     2.200     1.800 peak    68 spectrum    1 weight  0.10000E+01 volume  0.90037E-03 ppm1      2.764 ppm2      1.898 CV     1
 OR {   68}
   (( segid "3T5T" and resid 2    and name H2' ))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {   68}
   (( segid "3T5T" and resid 2    and name H2' ))
   (( segid "3T5T" and resid 3    and name H73 ))
 ASSI {   71}
   (( segid "3T5T" and resid 2    and name H2''))
   (( segid "3T5T" and resid 2    and name H3' ))
      2.700     0.900     0.900 peak    71 spectrum    1 weight  0.10000E+01 volume  0.48895E-02 ppm1      2.502 ppm2      4.968 CV     1
 ASSI {   73}
   (( segid "3T5T" and resid 2    and name H2''))
   (( segid "3T5T" and resid 2    and name H8  ))
      3.000     1.200     1.200 peak    73 spectrum    1 weight  0.10000E+01 volume  0.77423E-02 ppm1      2.501 ppm2      8.075 CV     1
 ASSI {   74}
   (( segid "3T5T" and resid 2    and name H2''))
   (( segid "3T5T" and resid 3    and name H5' ))
      3.900     1.900     1.900 peak    74 spectrum    1 weight  0.10000E+01 volume  0.77998E-03 ppm1      2.522 ppm2      3.922 CV     1
 ASSI {   75}
   (( segid "3T5T" and resid 2    and name H2''))
   (( segid "3T5T" and resid 3    and name H71 ))
      3.200     1.300     1.300 peak    75 spectrum    1 weight  0.10000E+01 volume  0.18500E-02 ppm1      2.505 ppm2      1.900 CV     1
 OR {   75}
   (( segid "3T5T" and resid 2    and name H2''))
   (( segid "3T5T" and resid 3    and name H72 ))
 OR {   75}
   (( segid "3T5T" and resid 2    and name H2''))
   (( segid "3T5T" and resid 3    and name H73 ))
 ASSI {   82}
   (( segid "3T5T" and resid 2    and name H3' ))
   (( segid "3T5T" and resid 2    and name H8  ))
      3.700     1.700     1.700 peak    82 spectrum    1 weight  0.10000E+01 volume  0.36471E-02 ppm1      4.971 ppm2      8.076 CV     1
 ASSI {   83}
   (( segid "3T5T" and resid 2    and name H3' ))
   (( segid "3T5T" and resid 3    and name H5' ))
      3.600     1.600     1.600 peak    83 spectrum    1 weight  0.10000E+01 volume  0.12485E-02 ppm1      4.970 ppm2      3.916 CV     1
 ASSI {   84}
   (( segid "3T5T" and resid 2    and name H4' ))
   (( segid "3T5T" and resid 2    and name H1' ))
      3.100     1.200     1.200 peak    84 spectrum    1 weight  0.10000E+01 volume  0.18358E-02 ppm1      4.122 ppm2      6.189 CV     1
 ASSI {   85}
   (( segid "3T5T" and resid 2    and name H4' ))
   (( segid "3T5T" and resid 2    and name H2' ))
      3.900     1.900     1.900 peak    85 spectrum    1 weight  0.10000E+01 volume  0.73786E-03 ppm1      4.142 ppm2      2.773 CV     1
 ASSI {   86}
   (( segid "3T5T" and resid 2    and name H4' ))
   (( segid "3T5T" and resid 2    and name H3' ))
      2.700     0.900     0.900 peak    86 spectrum    1 weight  0.10000E+01 volume  0.33987E-02 ppm1      4.126 ppm2      4.966 CV     1
 ASSI {   88}
   (( segid "3T5T" and resid 2    and name H4' ))
   (( segid "3T5T" and resid 2    and name H8  ))
      4.100     2.200     1.900 peak    88 spectrum    1 weight  0.10000E+01 volume  0.87272E-03 ppm1      4.118 ppm2      8.076 CV     1
 ASSI {   89}
   (( segid "3T5T" and resid 2    and name H4' ))
   (( segid "3T5T" and resid 3    and name H2' ))
      3.700     1.700     1.700 peak    89 spectrum    1 weight  0.10000E+01 volume  0.10195E-02 ppm1      4.112 ppm2      2.024 CV     1
 ASSI {   90}
   (( segid "3T5T" and resid 2    and name H4' ))
   (( segid "3T5T" and resid 3    and name H72 ))
      3.500     1.500     1.500 peak    90 spectrum    1 weight  0.10000E+01 volume  0.13264E-02 ppm1      4.111 ppm2      1.898 CV     1
 OR {   90}
   (( segid "3T5T" and resid 2    and name H4' ))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {   90}
   (( segid "3T5T" and resid 2    and name H4' ))
   (( segid "3T5T" and resid 3    and name H73 ))
 ASSI {  110}
   (( segid "3T5T" and resid 3    and name H1' ))
   (( segid "3T5T" and resid 3    and name H3' ))
      3.900     1.900     1.900 peak   110 spectrum    1 weight  0.10000E+01 volume  0.10779E-02 ppm1      6.054 ppm2      4.793 CV     1
 ASSI {  111}
   (( segid "3T5T" and resid 3    and name H1' ))
   (( segid "3T5T" and resid 3    and name H4' ))
      2.900     1.000     1.000 peak   111 spectrum    1 weight  0.10000E+01 volume  0.27728E-02 ppm1      6.071 ppm2      4.219 CV     1
 ASSI {  113}
   (( segid "3T5T" and resid 3    and name H1' ))
   (( segid "3T5T" and resid 3    and name H6  ))
      3.000     1.100     1.100 peak   113 spectrum    1 weight  0.10000E+01 volume  0.23301E-02 ppm1      6.071 ppm2      7.324 CV     1
 ASSI {  114}
   (( segid "3T5T" and resid 3    and name H1' ))
   (( segid "3T5T" and resid 4    and name H3' ))
      4.100     2.100     1.900 peak   114 spectrum    1 weight  0.10000E+01 volume  0.64883E-03 ppm1      6.069 ppm2      5.352 CV     1
 ASSI {  116}
   (( segid "3T5T" and resid 3    and name H2' ))
   (( segid "3T5T" and resid 3    and name H1' ))
      3.400     1.400     1.400 peak   116 spectrum    1 weight  0.10000E+01 volume  0.22978E-02 ppm1      2.009 ppm2      6.073 CV     1
 ASSI {  117}
   (( segid "3T5T" and resid 3    and name H2' ))
   (( segid "3T5T" and resid 3    and name H2''))
      2.700     0.900     0.900 peak   117 spectrum    1 weight  0.10000E+01 volume  0.14954E-02 ppm1      2.007 ppm2      2.715 CV     1
 ASSI {  118}
   (( segid "3T5T" and resid 3    and name H2' ))
   (( segid "3T5T" and resid 3    and name H4' ))
      3.500     1.500     1.500 peak   118 spectrum    1 weight  0.10000E+01 volume  0.15033E-02 ppm1      2.021 ppm2      4.213 CV     1
 ASSI {  119}
   (( segid "3T5T" and resid 3    and name H2' ))
   (( segid "3T5T" and resid 3    and name H5''))
      3.500     1.600     1.600 peak   119 spectrum    1 weight  0.10000E+01 volume  0.10993E-02 ppm1      2.015 ppm2      3.921 CV     1
 OR {  119}
   (( segid "3T5T" and resid 3    and name H2' ))
   (( segid "3T5T" and resid 3    and name H5' ))
 ASSI {  120}
   (( segid "3T5T" and resid 3    and name H2' ))
   (( segid "3T5T" and resid 3    and name H6  ))
      2.800     1.000     1.000 peak   120 spectrum    1 weight  0.10000E+01 volume  0.28183E-02 ppm1      2.014 ppm2      7.324 CV     1
 ASSI {  121}
   (( segid "3T5T" and resid 3    and name H2''))
   (( segid "3T5T" and resid 3    and name H1' ))
      2.900     1.100     1.100 peak   121 spectrum    1 weight  0.10000E+01 volume  0.19264E-02 ppm1      2.705 ppm2      6.068 CV     1
 ASSI {  123}
   (( segid "3T5T" and resid 3    and name H2''))
   (( segid "3T5T" and resid 3    and name H5''))
      4.300     2.300     1.700 peak   123 spectrum    1 weight  0.10000E+01 volume  0.10786E-02 ppm1      2.738 ppm2      3.913 CV     1
 OR {  123}
   (( segid "3T5T" and resid 3    and name H2''))
   (( segid "3T5T" and resid 3    and name H5' ))
 ASSI {  124}
   (( segid "3T5T" and resid 3    and name H2''))
   (( segid "3T5T" and resid 3    and name H6  ))
      3.700     1.700     1.700 peak   124 spectrum    1 weight  0.10000E+01 volume  0.18651E-02 ppm1      2.711 ppm2      7.324 CV     1
 ASSI {  125}
   (( segid "3T5T" and resid 3    and name H2''))
   (( segid "3T5T" and resid 3    and name H72 ))
      2.700     2.700     3.300 peak   125 spectrum    1 weight  0.10000E+01 volume  0.95287E-03 ppm1      2.719 ppm2      1.898 CV     1
 OR {  125}
   (( segid "3T5T" and resid 3    and name H2''))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {  125}
   (( segid "3T5T" and resid 3    and name H2''))
   (( segid "3T5T" and resid 3    and name H73 ))
 ASSI {  126}
   (( segid "3T5T" and resid 3    and name H3' ))
   (( segid "3T5T" and resid 3    and name H4' ))
      3.500     1.500     1.500 peak   126 spectrum    1 weight  0.10000E+01 volume  0.80150E-03 ppm1      4.806 ppm2      4.216 CV     1
 ASSI {  127}
   (( segid "3T5T" and resid 3    and name H3' ))
   (( segid "3T5T" and resid 3    and name H5''))
      3.200     1.200     1.200 peak   127 spectrum    1 weight  0.10000E+01 volume  0.16050E-02 ppm1      4.807 ppm2      3.919 CV     1
 OR {  127}
   (( segid "3T5T" and resid 3    and name H3' ))
   (( segid "3T5T" and resid 3    and name H5' ))
 ASSI {  130}
   (( segid "3T5T" and resid 3    and name H4' ))
   (( segid "3T5T" and resid 3    and name H2''))
      4.000     2.000     2.000 peak   130 spectrum    1 weight  0.10000E+01 volume  0.83974E-03 ppm1      4.226 ppm2      2.714 CV     1
 ASSI {  132}
   (( segid "3T5T" and resid 3    and name H4' ))
   (( segid "3T5T" and resid 4    and name H1' ))
      3.200     3.200     2.800 peak   132 spectrum    1 weight  0.10000E+01 volume  0.17146E-02 ppm1      4.206 ppm2      6.269 CV     1
 ASSI {  133}
   (( segid "3T5T" and resid 3    and name H4' ))
   (( segid "3T5T" and resid 4    and name H3' ))
      3.400     3.400     2.600 peak   133 spectrum    1 weight  0.10000E+01 volume  0.24966E-02 ppm1      4.237 ppm2      5.359 CV     1
 ASSI {  134}
   (( segid "3T5T" and resid 3    and name H5' ))
   (( segid "3T5T" and resid 2    and name H3' ))
      3.700     1.700     1.700 peak   134 spectrum    1 weight  0.10000E+01 volume  0.95317E-03 ppm1      3.908 ppm2      4.968 CV     1
 OR {  134}
   (( segid "3T5T" and resid 3    and name H5''))
   (( segid "3T5T" and resid 2    and name H3' ))
 ASSI {  135}
   (( segid "3T5T" and resid 3    and name H5' ))
   (( segid "3T5T" and resid 3    and name H1' ))
      3.900     1.900     1.900 peak   135 spectrum    1 weight  0.10000E+01 volume  0.10043E-02 ppm1      3.924 ppm2      6.072 CV     1
 OR {  135}
   (( segid "3T5T" and resid 3    and name H5''))
   (( segid "3T5T" and resid 3    and name H1' ))
 ASSI {  138}
   (( segid "3T5T" and resid 3    and name H5''))
   (( segid "3T5T" and resid 3    and name H4' ))
      2.300     0.600     0.600 peak   138 spectrum    1 weight  0.10000E+01 volume  0.10003E-01 ppm1      3.916 ppm2      4.213 CV     1
 OR {  138}
   (( segid "3T5T" and resid 3    and name H5' ))
   (( segid "3T5T" and resid 3    and name H4' ))
 ASSI {  139}
   (( segid "3T5T" and resid 3    and name H5' ))
   (( segid "3T5T" and resid 3    and name H6  ))
      3.100     1.200     1.200 peak   139 spectrum    1 weight  0.10000E+01 volume  0.18174E-02 ppm1      3.922 ppm2      7.324 CV     1
 OR {  139}
   (( segid "3T5T" and resid 3    and name H5''))
   (( segid "3T5T" and resid 3    and name H6  ))
 ASSI {  140}
   (( segid "3T5T" and resid 3    and name H5' ))
   (( segid "3T5T" and resid 3    and name H72 ))
      4.100     2.100     1.900 peak   140 spectrum    1 weight  0.10000E+01 volume  0.69941E-03 ppm1      3.922 ppm2      1.894 CV     1
 OR {  140}
   (( segid "3T5T" and resid 3    and name H5' ))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {  140}
   (( segid "3T5T" and resid 3    and name H5' ))
   (( segid "3T5T" and resid 3    and name H73 ))
 OR {  140}
   (( segid "3T5T" and resid 3    and name H5''))
   (( segid "3T5T" and resid 3    and name H72 ))
 OR {  140}
   (( segid "3T5T" and resid 3    and name H5''))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {  140}
   (( segid "3T5T" and resid 3    and name H5''))
   (( segid "3T5T" and resid 3    and name H73 ))
 ASSI {  144}
   (( segid "3T5T" and resid 3    and name H6  ))
   (( segid "3T5T" and resid 3    and name H4' ))
      3.500     1.600     1.600 peak   144 spectrum    1 weight  0.10000E+01 volume  0.11697E-02 ppm1      7.326 ppm2      4.214 CV     1
 ASSI {  146}
   (( segid "3T5T" and resid 3    and name H6  ))
   (( segid "3T5T" and resid 3    and name H72 ))
      2.600     0.800     0.800 peak   146 spectrum    1 weight  0.10000E+01 volume  0.61155E-02 ppm1      7.322 ppm2      1.897 CV     1
 OR {  146}
   (( segid "3T5T" and resid 3    and name H6  ))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {  146}
   (( segid "3T5T" and resid 3    and name H6  ))
   (( segid "3T5T" and resid 3    and name H73 ))
 ASSI {  147}
   (( segid "3T5T" and resid 3    and name H72 ))
   (( segid "3T5T" and resid 2    and name H1' ))
      2.700     0.900     0.900 peak   147 spectrum    1 weight  0.10000E+01 volume  0.50137E-02 ppm1      1.898 ppm2      6.187 CV     1
 OR {  147}
   (( segid "3T5T" and resid 3    and name H71 ))
   (( segid "3T5T" and resid 2    and name H1' ))
 OR {  147}
   (( segid "3T5T" and resid 3    and name H73 ))
   (( segid "3T5T" and resid 2    and name H1' ))
 ASSI {  151}
   (( segid "3T5T" and resid 3    and name H72 ))
   (( segid "3T5T" and resid 2    and name H8  ))
      2.800     2.800     3.200 peak   151 spectrum    1 weight  0.10000E+01 volume  0.84495E-03 ppm1      1.893 ppm2      8.075 CV     1
 OR {  151}
   (( segid "3T5T" and resid 3    and name H71 ))
   (( segid "3T5T" and resid 2    and name H8  ))
 OR {  151}
   (( segid "3T5T" and resid 3    and name H73 ))
   (( segid "3T5T" and resid 2    and name H8  ))
 ASSI {  152}
   (( segid "3T5T" and resid 3    and name H72 ))
   (( segid "3T5T" and resid 3    and name H1' ))
      2.600     2.600     3.400 peak   152 spectrum    1 weight  0.10000E+01 volume  0.13545E-02 ppm1      1.899 ppm2      6.074 CV     1
 OR {  152}
   (( segid "3T5T" and resid 3    and name H73 ))
   (( segid "3T5T" and resid 3    and name H1' ))
 OR {  152}
   (( segid "3T5T" and resid 3    and name H71 ))
   (( segid "3T5T" and resid 3    and name H1' ))
 ASSI {  153}
   (( segid "3T5T" and resid 3    and name H72 ))
   (( segid "3T5T" and resid 3    and name H2' ))
      2.700     2.700     3.300 peak   153 spectrum    1 weight  0.10000E+01 volume  0.11788E-02 ppm1      1.898 ppm2      2.017 CV     1
 OR {  153}
   (( segid "3T5T" and resid 3    and name H71 ))
   (( segid "3T5T" and resid 3    and name H2' ))
 OR {  153}
   (( segid "3T5T" and resid 3    and name H73 ))
   (( segid "3T5T" and resid 3    and name H2' ))
 ASSI {  155}
   (( segid "3T5T" and resid 3    and name H72 ))
   (( segid "3T5T" and resid 3    and name H4' ))
      2.800     2.800     3.200 peak   155 spectrum    1 weight  0.10000E+01 volume  0.89533E-03 ppm1      1.905 ppm2      4.215 CV     1
 OR {  155}
   (( segid "3T5T" and resid 3    and name H71 ))
   (( segid "3T5T" and resid 3    and name H4' ))
 OR {  155}
   (( segid "3T5T" and resid 3    and name H73 ))
   (( segid "3T5T" and resid 3    and name H4' ))
 ASSI {  156}
   (( segid "3T5T" and resid 3    and name H72 ))
   (( segid "3T5T" and resid 3    and name H5' ))
      2.800     2.800     3.200 peak   156 spectrum    1 weight  0.10000E+01 volume  0.82539E-03 ppm1      1.894 ppm2      3.914 CV     1
 OR {  156}
   (( segid "3T5T" and resid 3    and name H71 ))
   (( segid "3T5T" and resid 3    and name H5' ))
 OR {  156}
   (( segid "3T5T" and resid 3    and name H73 ))
   (( segid "3T5T" and resid 3    and name H5' ))
 ASSI {  162}
   (( segid "3T5T" and resid 4    and name H1' ))
   (( segid "3T5T" and resid 4    and name H8  ))
      2.600     0.900     0.900 peak   162 spectrum    1 weight  0.10000E+01 volume  0.40996E-02 ppm1      6.266 ppm2      7.840 CV     1
 ASSI {  165}
   (( segid "3T5T" and resid 4    and name H2' ))
   (( segid "3T5T" and resid 4    and name H1' ))
      3.300     1.300     1.300 peak   165 spectrum    1 weight  0.10000E+01 volume  0.20645E-02 ppm1      2.027 ppm2      6.267 CV     1
 ASSI {  166}
   (( segid "3T5T" and resid 4    and name H2' ))
   (( segid "3T5T" and resid 4    and name H2''))
      2.600     0.800     0.800 peak   166 spectrum    1 weight  0.10000E+01 volume  0.12594E-02 ppm1      2.032 ppm2      2.258 CV     1
 ASSI {  167}
   (( segid "3T5T" and resid 4    and name H2' ))
   (( segid "3T5T" and resid 4    and name H3' ))
      2.900     1.100     1.100 peak   167 spectrum    1 weight  0.10000E+01 volume  0.14369E-02 ppm1      2.034 ppm2      5.356 CV     1
 ASSI {  168}
   (( segid "3T5T" and resid 4    and name H2' ))
   (( segid "3T5T" and resid 4    and name H4' ))
      3.700     1.700     1.700 peak   168 spectrum    1 weight  0.10000E+01 volume  0.11272E-02 ppm1      2.021 ppm2      4.158 CV     1
 ASSI {  169}
   (( segid "3T5T" and resid 4    and name H2' ))
   (( segid "3T5T" and resid 4    and name H8  ))
      3.800     1.800     1.800 peak   169 spectrum    1 weight  0.10000E+01 volume  0.13404E-02 ppm1      2.032 ppm2      7.841 CV     1
 ASSI {  170}
   (( segid "3T5T" and resid 4    and name H2' ))
   (( segid "3T5T" and resid 5    and name H72 ))
      3.400     1.400     1.400 peak   170 spectrum    1 weight  0.10000E+01 volume  0.77527E-03 ppm1      2.056 ppm2      1.143 CV     1
 OR {  170}
   (( segid "3T5T" and resid 4    and name H2' ))
   (( segid "3T5T" and resid 5    and name H73 ))
 OR {  170}
   (( segid "3T5T" and resid 4    and name H2' ))
   (( segid "3T5T" and resid 5    and name H71 ))
 ASSI {  171}
   (( segid "3T5T" and resid 4    and name H2''))
   (( segid "3T5T" and resid 4    and name H1' ))
      2.600     0.800     0.800 peak   171 spectrum    1 weight  0.10000E+01 volume  0.28123E-02 ppm1      2.255 ppm2      6.267 CV     1
 ASSI {  173}
   (( segid "3T5T" and resid 4    and name H2''))
   (( segid "3T5T" and resid 4    and name H3' ))
      3.200     1.300     1.300 peak   173 spectrum    1 weight  0.10000E+01 volume  0.14824E-02 ppm1      2.249 ppm2      5.359 CV     1
 ASSI {  174}
   (( segid "3T5T" and resid 4    and name H2''))
   (( segid "3T5T" and resid 4    and name H4' ))
      3.400     1.500     1.500 peak   174 spectrum    1 weight  0.10000E+01 volume  0.14503E-02 ppm1      2.288 ppm2      4.154 CV     1
 ASSI {  175}
   (( segid "3T5T" and resid 4    and name H2''))
   (( segid "3T5T" and resid 4    and name H8  ))
      3.600     1.600     1.600 peak   175 spectrum    1 weight  0.10000E+01 volume  0.15486E-02 ppm1      2.249 ppm2      7.843 CV     1
 ASSI {  177}
   (( segid "3T5T" and resid 4    and name H2''))
   (( segid "3T5T" and resid 5    and name H73 ))
      3.800     1.800     1.800 peak   177 spectrum    1 weight  0.10000E+01 volume  0.71021E-03 ppm1      2.267 ppm2      1.146 CV     1
 OR {  177}
   (( segid "3T5T" and resid 4    and name H2''))
   (( segid "3T5T" and resid 5    and name H72 ))
 OR {  177}
   (( segid "3T5T" and resid 4    and name H2''))
   (( segid "3T5T" and resid 5    and name H71 ))
 ASSI {  179}
   (( segid "3T5T" and resid 4    and name H3' ))
   (( segid "3T5T" and resid 4    and name H1' ))
      3.600     1.600     1.600 peak   179 spectrum    1 weight  0.10000E+01 volume  0.13220E-02 ppm1      5.360 ppm2      6.267 CV     1
 ASSI {  184}
   (( segid "3T5T" and resid 4    and name H4' ))
   (( segid "3T5T" and resid 3    and name H1' ))
      3.200     1.300     1.300 peak   184 spectrum    1 weight  0.10000E+01 volume  0.15050E-02 ppm1      4.172 ppm2      6.064 CV     1
 ASSI {  185}
   (( segid "3T5T" and resid 4    and name H4' ))
   (( segid "3T5T" and resid 3    and name H6  ))
      3.700     3.700     2.300 peak   185 spectrum    1 weight  0.10000E+01 volume  0.87410E-03 ppm1      4.156 ppm2      7.324 CV     1
 ASSI {  186}
   (( segid "3T5T" and resid 4    and name H4' ))
   (( segid "3T5T" and resid 4    and name H1' ))
      3.000     1.100     1.100 peak   186 spectrum    1 weight  0.10000E+01 volume  0.18203E-02 ppm1      4.140 ppm2      6.264 CV     1
 ASSI {  188}
   (( segid "3T5T" and resid 4    and name H4' ))
   (( segid "3T5T" and resid 4    and name H3' ))
      3.100     1.200     1.200 peak   188 spectrum    1 weight  0.10000E+01 volume  0.18294E-02 ppm1      4.162 ppm2      5.364 CV     1
 ASSI {  194}
   (( segid "3T5T" and resid 5    and name H1' ))
   (( segid "3T5T" and resid 5    and name H3' ))
      3.400     1.400     1.400 peak   194 spectrum    1 weight  0.10000E+01 volume  0.16746E-02 ppm1      6.560 ppm2      5.119 CV     1
 ASSI {  195}
   (( segid "3T5T" and resid 5    and name H1' ))
   (( segid "3T5T" and resid 5    and name H6  ))
      3.000     1.100     1.100 peak   195 spectrum    1 weight  0.10000E+01 volume  0.16181E-02 ppm1      6.567 ppm2      7.123 CV     1
 ASSI {  196}
   (( segid "3T5T" and resid 5    and name H2' ))
   (( segid "3T5T" and resid 5    and name H1' ))
      3.000     1.100     1.100 peak   196 spectrum    1 weight  0.10000E+01 volume  0.28779E-02 ppm1      2.114 ppm2      6.561 CV     1
 ASSI {  197}
   (( segid "3T5T" and resid 5    and name H2' ))
   (( segid "3T5T" and resid 5    and name H2''))
      2.300     0.700     0.700 peak   197 spectrum    1 weight  0.10000E+01 volume  0.29938E-02 ppm1      2.107 ppm2      2.438 CV     1
 ASSI {  198}
   (( segid "3T5T" and resid 5    and name H2' ))
   (( segid "3T5T" and resid 5    and name H3' ))
      2.700     0.900     0.900 peak   198 spectrum    1 weight  0.10000E+01 volume  0.28242E-02 ppm1      2.105 ppm2      5.120 CV     1
 ASSI {  199}
   (( segid "3T5T" and resid 5    and name H2' ))
   (( segid "3T5T" and resid 5    and name H6  ))
      2.700     0.900     0.900 peak   199 spectrum    1 weight  0.10000E+01 volume  0.29425E-02 ppm1      2.110 ppm2      7.120 CV     1
 ASSI {  200}
   (( segid "3T5T" and resid 5    and name H2' ))
   (( segid "3T5T" and resid 5    and name H71 ))
      2.600     2.600     3.400 peak   200 spectrum    1 weight  0.10000E+01 volume  0.14067E-02 ppm1      2.108 ppm2      1.144 CV     1
 OR {  200}
   (( segid "3T5T" and resid 5    and name H2' ))
   (( segid "3T5T" and resid 5    and name H73 ))
 OR {  200}
   (( segid "3T5T" and resid 5    and name H2' ))
   (( segid "3T5T" and resid 5    and name H72 ))
 ASSI {  201}
   (( segid "3T5T" and resid 5    and name H2''))
   (( segid "3T5T" and resid 5    and name H1' ))
      2.400     0.700     0.700 peak   201 spectrum    1 weight  0.10000E+01 volume  0.35600E-02 ppm1      2.434 ppm2      6.563 CV     1
 ASSI {  203}
   (( segid "3T5T" and resid 5    and name H2''))
   (( segid "3T5T" and resid 5    and name H3' ))
      2.900     1.000     1.000 peak   203 spectrum    1 weight  0.10000E+01 volume  0.29367E-02 ppm1      2.438 ppm2      5.123 CV     1
 ASSI {  204}
   (( segid "3T5T" and resid 5    and name H2''))
   (( segid "3T5T" and resid 5    and name H6  ))
      3.600     1.700     1.700 peak   204 spectrum    1 weight  0.10000E+01 volume  0.25249E-02 ppm1      2.430 ppm2      7.120 CV     1
 ASSI {  211}
   (( segid "3T5T" and resid 5    and name H3' ))
   (( segid "3T5T" and resid 5    and name H6  ))
      3.600     1.600     1.600 peak   211 spectrum    1 weight  0.10000E+01 volume  0.20398E-02 ppm1      5.128 ppm2      7.121 CV     1
 ASSI {  212}
   (( segid "3T5T" and resid 5    and name H4' ))
   (( segid "3T5T" and resid 5    and name H1' ))
      3.100     1.200     1.200 peak   212 spectrum    1 weight  0.10000E+01 volume  0.12784E-02 ppm1      4.573 ppm2      6.562 CV     1
 ASSI {  213}
   (( segid "3T5T" and resid 5    and name H4' ))
   (( segid "3T5T" and resid 5    and name H3' ))
      2.800     1.000     1.000 peak   213 spectrum    1 weight  0.10000E+01 volume  0.29855E-02 ppm1      4.585 ppm2      5.120 CV     1
 ASSI {  216}
   (( segid "3T5T" and resid 5    and name H4' ))
   (( segid "3T5T" and resid 5    and name H6  ))
      3.700     1.700     1.700 peak   216 spectrum    1 weight  0.10000E+01 volume  0.92589E-03 ppm1      4.556 ppm2      7.120 CV     1
 ASSI {  222}
   (( segid "3T5T" and resid 5    and name H5''))
   (( segid "3T5T" and resid 5    and name H5' ))
      2.400     0.700     0.700 peak   222 spectrum    1 weight  0.10000E+01 volume  0.24664E-02 ppm1      4.097 ppm2      3.017 CV     1
 ASSI {  228}
   (( segid "3T5T" and resid 5    and name H6  ))
   (( segid "3T5T" and resid 4    and name H1' ))
      3.000     3.000     3.000 peak   228 spectrum    1 weight  0.10000E+01 volume  0.60104E-03 ppm1      7.147 ppm2      6.269 CV     1
 ASSI {  236}
   (( segid "3T5T" and resid 5    and name H72 ))
   (( segid "3T5T" and resid 4    and name H1' ))
      3.100     1.200     1.200 peak   236 spectrum    1 weight  0.10000E+01 volume  0.49299E-03 ppm1      1.152 ppm2      6.273 CV     1
 OR {  236}
   (( segid "3T5T" and resid 5    and name H73 ))
   (( segid "3T5T" and resid 4    and name H1' ))
 OR {  236}
   (( segid "3T5T" and resid 5    and name H71 ))
   (( segid "3T5T" and resid 4    and name H1' ))
 ASSI {  238}
   (( segid "3T5T" and resid 5    and name H73 ))
   (( segid "3T5T" and resid 4    and name H3' ))
      3.500     1.500     1.500 peak   238 spectrum    1 weight  0.10000E+01 volume  0.10574E-02 ppm1      1.141 ppm2      5.366 CV     1
 OR {  238}
   (( segid "3T5T" and resid 5    and name H72 ))
   (( segid "3T5T" and resid 4    and name H3' ))
 OR {  238}
   (( segid "3T5T" and resid 5    and name H71 ))
   (( segid "3T5T" and resid 4    and name H3' ))
 ASSI {  239}
   (( segid "3T5T" and resid 5    and name H72 ))
   (( segid "3T5T" and resid 4    and name H8  ))
      2.800     2.800     3.200 peak   239 spectrum    1 weight  0.10000E+01 volume  0.90133E-03 ppm1      1.146 ppm2      7.833 CV     1
 OR {  239}
   (( segid "3T5T" and resid 5    and name H73 ))
   (( segid "3T5T" and resid 4    and name H8  ))
 OR {  239}
   (( segid "3T5T" and resid 5    and name H71 ))
   (( segid "3T5T" and resid 4    and name H8  ))
 ASSI {  241}
   (( segid "3T5T" and resid 5    and name H71 ))
   (( segid "3T5T" and resid 5    and name H2''))
      2.700     2.700     3.300 peak   241 spectrum    1 weight  0.10000E+01 volume  0.96555E-03 ppm1      1.150 ppm2      2.437 CV     1
 OR {  241}
   (( segid "3T5T" and resid 5    and name H73 ))
   (( segid "3T5T" and resid 5    and name H2''))
 OR {  241}
   (( segid "3T5T" and resid 5    and name H72 ))
   (( segid "3T5T" and resid 5    and name H2''))
 ASSI {  242}
   (( segid "3T5T" and resid 5    and name H71 ))
   (( segid "3T5T" and resid 5    and name H6  ))
      2.400     0.700     0.700 peak   242 spectrum    1 weight  0.10000E+01 volume  0.90158E-02 ppm1      1.142 ppm2      7.121 CV     1
 OR {  242}
   (( segid "3T5T" and resid 5    and name H73 ))
   (( segid "3T5T" and resid 5    and name H6  ))
 OR {  242}
   (( segid "3T5T" and resid 5    and name H72 ))
   (( segid "3T5T" and resid 5    and name H6  ))
 ASSI {  245}
   (( segid "3T5T" and resid 6    and name H1' ))
   (( segid "3T5T" and resid 6    and name H3' ))
      3.200     1.300     1.300 peak   245 spectrum    1 weight  0.10000E+01 volume  0.32473E-02 ppm1      6.362 ppm2      5.024 CV     1
 ASSI {  247}
   (( segid "3T5T" and resid 6    and name H1' ))
   (( segid "3T5T" and resid 6    and name H8  ))
      3.100     1.200     1.200 peak   247 spectrum    1 weight  0.10000E+01 volume  0.33831E-02 ppm1      6.360 ppm2      7.795 CV     1
 ASSI {  248}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 6    and name H5' ))
      3.700     1.700     1.700 peak   248 spectrum    1 weight  0.10000E+01 volume  0.10071E-02 ppm1      2.645 ppm2      4.418 CV     1
 OR {  248}
   (( segid "3T5T" and resid 6    and name H2''))
   (( segid "3T5T" and resid 6    and name H5' ))
 ASSI {  249}
   (( segid "3T5T" and resid 6    and name H2''))
   (( segid "3T5T" and resid 7    and name H5''))
      3.800     1.800     1.800 peak   249 spectrum    1 weight  0.10000E+01 volume  0.88148E-03 ppm1      2.622 ppm2      4.155 CV     1
 OR {  249}
   (( segid "3T5T" and resid 6    and name H2''))
   (( segid "3T5T" and resid 7    and name H5' ))
 OR {  249}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 7    and name H5''))
 OR {  249}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 7    and name H5' ))
 ASSI {  250}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 6    and name H1' ))
      2.900     1.100     1.100 peak   250 spectrum    1 weight  0.10000E+01 volume  0.48052E-02 ppm1      2.570 ppm2      6.363 CV     1
 ASSI {  251}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 6    and name H3' ))
      2.400     0.700     0.700 peak   251 spectrum    1 weight  0.10000E+01 volume  0.54474E-02 ppm1      2.573 ppm2      5.025 CV     1
 ASSI {  252}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 6    and name H4' ))
      3.200     1.300     1.300 peak   252 spectrum    1 weight  0.10000E+01 volume  0.22960E-02 ppm1      2.588 ppm2      4.553 CV     1
 ASSI {  253}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 6    and name H5' ))
      3.500     1.500     1.500 peak   253 spectrum    1 weight  0.10000E+01 volume  0.11550E-02 ppm1      2.579 ppm2      4.411 CV     1
 ASSI {  254}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 6    and name H5''))
      3.300     1.400     1.400 peak   254 spectrum    1 weight  0.10000E+01 volume  0.18874E-02 ppm1      2.582 ppm2      4.239 CV     1
 ASSI {  255}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 6    and name H8  ))
      2.300     0.700     0.700 peak   255 spectrum    1 weight  0.10000E+01 volume  0.65129E-02 ppm1      2.571 ppm2      7.794 CV     1
 ASSI {  256}
   (( segid "3T5T" and resid 6    and name H2' ))
   (( segid "3T5T" and resid 7    and name H6  ))
      3.800     1.800     1.800 peak   256 spectrum    1 weight  0.10000E+01 volume  0.83202E-03 ppm1      2.567 ppm2      7.899 CV     1
 ASSI {  257}
   (( segid "3T5T" and resid 6    and name H2''))
   (( segid "3T5T" and resid 6    and name H1' ))
      2.300     0.700     0.700 peak   257 spectrum    1 weight  0.10000E+01 volume  0.70167E-02 ppm1      2.650 ppm2      6.363 CV     1
 ASSI {  258}
   (( segid "3T5T" and resid 6    and name H2''))
   (( segid "3T5T" and resid 6    and name H3' ))
      2.600     0.800     0.800 peak   258 spectrum    1 weight  0.10000E+01 volume  0.60717E-02 ppm1      2.649 ppm2      5.024 CV     1
 ASSI {  259}
   (( segid "3T5T" and resid 6    and name H2''))
   (( segid "3T5T" and resid 6    and name H4' ))
      3.300     1.400     1.400 peak   259 spectrum    1 weight  0.10000E+01 volume  0.19562E-02 ppm1      2.656 ppm2      4.550 CV     1
 ASSI {  261}
   (( segid "3T5T" and resid 6    and name H2''))
   (( segid "3T5T" and resid 6    and name H8  ))
      3.400     1.400     1.400 peak   261 spectrum    1 weight  0.10000E+01 volume  0.64524E-02 ppm1      2.652 ppm2      7.795 CV     1
 ASSI {  265}
   (( segid "3T5T" and resid 6    and name H3' ))
   (( segid "3T5T" and resid 6    and name H4' ))
      2.500     0.800     0.800 peak   265 spectrum    1 weight  0.10000E+01 volume  0.45371E-02 ppm1      5.028 ppm2      4.552 CV     1
 ASSI {  268}
   (( segid "3T5T" and resid 6    and name H3' ))
   (( segid "3T5T" and resid 6    and name H8  ))
      3.500     1.500     1.500 peak   268 spectrum    1 weight  0.10000E+01 volume  0.31250E-02 ppm1      5.027 ppm2      7.794 CV     1
 ASSI {  270}
   (( segid "3T5T" and resid 6    and name H4' ))
   (( segid "3T5T" and resid 6    and name H1' ))
      2.800     1.000     1.000 peak   270 spectrum    1 weight  0.10000E+01 volume  0.28950E-02 ppm1      4.560 ppm2      6.362 CV     1
 ASSI {  274}
   (( segid "3T5T" and resid 6    and name H4' ))
   (( segid "3T5T" and resid 6    and name H5''))
      2.400     0.700     0.700 peak   274 spectrum    1 weight  0.10000E+01 volume  0.60659E-02 ppm1      4.551 ppm2      4.239 CV     1
 ASSI {  275}
   (( segid "3T5T" and resid 6    and name H4' ))
   (( segid "3T5T" and resid 6    and name H8  ))
      3.500     1.500     1.500 peak   275 spectrum    1 weight  0.10000E+01 volume  0.16734E-02 ppm1      4.551 ppm2      7.794 CV     1
 ASSI {  276}
   (( segid "3T5T" and resid 6    and name H5' ))
   (( segid "3T5T" and resid 5    and name H3' ))
      3.100     3.100     2.900 peak   276 spectrum    1 weight  0.10000E+01 volume  0.12710E-02 ppm1      4.425 ppm2      5.117 CV     1
 ASSI {  277}
   (( segid "3T5T" and resid 6    and name H5' ))
   (( segid "3T5T" and resid 6    and name H3' ))
      3.400     1.500     1.500 peak   277 spectrum    1 weight  0.10000E+01 volume  0.26331E-02 ppm1      4.417 ppm2      5.026 CV     1
 ASSI {  278}
   (( segid "3T5T" and resid 6    and name H5' ))
   (( segid "3T5T" and resid 6    and name H4' ))
      2.600     0.800     0.800 peak   278 spectrum    1 weight  0.10000E+01 volume  0.47031E-02 ppm1      4.426 ppm2      4.552 CV     1
 ASSI {  279}
   (( segid "3T5T" and resid 6    and name H5' ))
   (( segid "3T5T" and resid 6    and name H5''))
      2.200     0.600     0.600 peak   279 spectrum    1 weight  0.10000E+01 volume  0.45388E-02 ppm1      4.419 ppm2      4.242 CV     1
 ASSI {  280}
   (( segid "3T5T" and resid 6    and name H5' ))
   (( segid "3T5T" and resid 6    and name H8  ))
      3.000     1.100     1.100 peak   280 spectrum    1 weight  0.10000E+01 volume  0.19133E-02 ppm1      4.415 ppm2      7.795 CV     1
 ASSI {  281}
   (( segid "3T5T" and resid 6    and name H5''))
   (( segid "3T5T" and resid 5    and name H3' ))
      2.600     2.600     3.400 peak   281 spectrum    1 weight  0.10000E+01 volume  0.11922E-02 ppm1      4.225 ppm2      5.119 CV     1
 ASSI {  283}
   (( segid "3T5T" and resid 6    and name H5''))
   (( segid "3T5T" and resid 6    and name H2''))
      3.800     1.800     1.800 peak   283 spectrum    1 weight  0.10000E+01 volume  0.20105E-02 ppm1      4.233 ppm2      2.650 CV     1
 ASSI {  284}
   (( segid "3T5T" and resid 6    and name H5''))
   (( segid "3T5T" and resid 6    and name H3' ))
      2.400     0.700     0.700 peak   284 spectrum    1 weight  0.10000E+01 volume  0.48390E-02 ppm1      4.234 ppm2      5.025 CV     1
 ASSI {  287}
   (( segid "3T5T" and resid 6    and name H5''))
   (( segid "3T5T" and resid 6    and name H8  ))
      3.300     1.400     1.400 peak   287 spectrum    1 weight  0.10000E+01 volume  0.22940E-02 ppm1      4.234 ppm2      7.793 CV     1
 ASSI {  299}
   (( segid "3T5T" and resid 7    and name H1' ))
   (( segid "3T5T" and resid 7    and name H5  ))
      3.900     1.900     1.900 peak   299 spectrum    1 weight  0.10000E+01 volume  0.97906E-03 ppm1      6.356 ppm2      6.043 CV     1
 ASSI {  300}
   (( segid "3T5T" and resid 7    and name H1' ))
   (( segid "3T5T" and resid 7    and name H6  ))
      3.000     1.100     1.100 peak   300 spectrum    1 weight  0.10000E+01 volume  0.32921E-02 ppm1      6.356 ppm2      7.902 CV     1
 ASSI {  301}
   (( segid "3T5T" and resid 7    and name H2' ))
   (( segid "3T5T" and resid 7    and name H1' ))
      2.700     0.900     0.900 peak   301 spectrum    1 weight  0.10000E+01 volume  0.75504E-02 ppm1      2.315 ppm2      6.353 CV     1
 ASSI {  302}
   (( segid "3T5T" and resid 7    and name H2' ))
   (( segid "3T5T" and resid 7    and name H2''))
      1.600     0.300     0.600 peak   302 spectrum    1 weight  0.10000E+01 volume  0.26731E-01 ppm1      2.312 ppm2      2.425 CV     1
 ASSI {  303}
   (( segid "3T5T" and resid 7    and name H2' ))
   (( segid "3T5T" and resid 7    and name H3' ))
      2.100     0.600     0.600 peak   303 spectrum    1 weight  0.10000E+01 volume  0.10610E-01 ppm1      2.316 ppm2      4.603 CV     1
 ASSI {  304}
   (( segid "3T5T" and resid 7    and name H2' ))
   (( segid "3T5T" and resid 7    and name H4' ))
      3.300     1.300     1.300 peak   304 spectrum    1 weight  0.10000E+01 volume  0.25738E-02 ppm1      2.312 ppm2      4.224 CV     1
 ASSI {  305}
   (( segid "3T5T" and resid 7    and name H2' ))
   (( segid "3T5T" and resid 7    and name H5  ))
      4.000     2.000     2.000 peak   305 spectrum    1 weight  0.10000E+01 volume  0.10535E-02 ppm1      2.321 ppm2      6.046 CV     1
 ASSI {  306}
   (( segid "3T5T" and resid 7    and name H2' ))
   (( segid "3T5T" and resid 7    and name H6  ))
      2.100     0.600     0.600 peak   306 spectrum    1 weight  0.10000E+01 volume  0.10726E-01 ppm1      2.316 ppm2      7.901 CV     1
 ASSI {  307}
   (( segid "3T5T" and resid 7    and name H2''))
   (( segid "3T5T" and resid 7    and name H1' ))
      2.100     0.500     0.500 peak   307 spectrum    1 weight  0.10000E+01 volume  0.14889E-01 ppm1      2.430 ppm2      6.352 CV     1
 ASSI {  309}
   (( segid "3T5T" and resid 7    and name H2''))
   (( segid "3T5T" and resid 7    and name H3' ))
      2.600     0.800     0.800 peak   309 spectrum    1 weight  0.10000E+01 volume  0.69491E-02 ppm1      2.427 ppm2      4.601 CV     1
 ASSI {  310}
   (( segid "3T5T" and resid 7    and name H2''))
   (( segid "3T5T" and resid 7    and name H4' ))
      3.100     1.200     1.200 peak   310 spectrum    1 weight  0.10000E+01 volume  0.31505E-02 ppm1      2.427 ppm2      4.222 CV     1
 ASSI {  311}
   (( segid "3T5T" and resid 7    and name H2''))
   (( segid "3T5T" and resid 7    and name H6  ))
      3.500     1.500     1.500 peak   311 spectrum    1 weight  0.10000E+01 volume  0.44349E-02 ppm1      2.426 ppm2      7.901 CV     1
 ASSI {  312}
   (( segid "3T5T" and resid 7    and name H3' ))
   (( segid "3T5T" and resid 7    and name H1' ))
      3.500     1.500     1.500 peak   312 spectrum    1 weight  0.10000E+01 volume  0.20852E-02 ppm1      4.600 ppm2      6.349 CV     1
 ASSI {  315}
   (( segid "3T5T" and resid 7    and name H3' ))
   (( segid "3T5T" and resid 7    and name H4' ))
      2.400     0.700     0.700 peak   315 spectrum    1 weight  0.10000E+01 volume  0.79408E-02 ppm1      4.595 ppm2      4.226 CV     1
 ASSI {  317}
   (( segid "3T5T" and resid 7    and name H3' ))
   (( segid "3T5T" and resid 7    and name H6  ))
      3.100     1.200     1.200 peak   317 spectrum    1 weight  0.10000E+01 volume  0.31924E-02 ppm1      4.596 ppm2      7.902 CV     1
 ASSI {  318}
   (( segid "3T5T" and resid 7    and name H4' ))
   (( segid "3T5T" and resid 7    and name H1' ))
      2.600     0.800     0.800 peak   318 spectrum    1 weight  0.10000E+01 volume  0.59203E-02 ppm1      4.232 ppm2      6.357 CV     1
 ASSI {  322}
   (( segid "3T5T" and resid 7    and name H4' ))
   (( segid "3T5T" and resid 7    and name H6  ))
      3.200     1.300     1.300 peak   322 spectrum    1 weight  0.10000E+01 volume  0.24537E-02 ppm1      4.238 ppm2      7.901 CV     1
 ASSI {  324}
   (( segid "3T5T" and resid 7    and name H5''))
   (( segid "3T5T" and resid 6    and name H2''))
      3.500     1.600     1.600 peak   324 spectrum    1 weight  0.10000E+01 volume  0.97218E-03 ppm1      4.142 ppm2      2.647 CV     1
 OR {  324}
   (( segid "3T5T" and resid 7    and name H5' ))
   (( segid "3T5T" and resid 6    and name H2''))
 ASSI {  325}
   (( segid "3T5T" and resid 7    and name H5''))
   (( segid "3T5T" and resid 6    and name H3' ))
      3.000     1.100     1.100 peak   325 spectrum    1 weight  0.10000E+01 volume  0.19976E-02 ppm1      4.140 ppm2      5.026 CV     1
 OR {  325}
   (( segid "3T5T" and resid 7    and name H5' ))
   (( segid "3T5T" and resid 6    and name H3' ))
 ASSI {  326}
   (( segid "3T5T" and resid 7    and name H5' ))
   (( segid "3T5T" and resid 6    and name H4' ))
      3.400     1.400     1.400 peak   326 spectrum    1 weight  0.10000E+01 volume  0.15644E-02 ppm1      4.148 ppm2      4.552 CV     1
 OR {  326}
   (( segid "3T5T" and resid 7    and name H5''))
   (( segid "3T5T" and resid 6    and name H4' ))
 ASSI {  327}
   (( segid "3T5T" and resid 7    and name H5''))
   (( segid "3T5T" and resid 6    and name H8  ))
      2.800     2.800     3.200 peak   327 spectrum    1 weight  0.10000E+01 volume  0.82235E-03 ppm1      4.151 ppm2      7.788 CV     1
 OR {  327}
   (( segid "3T5T" and resid 7    and name H5' ))
   (( segid "3T5T" and resid 6    and name H8  ))
 ASSI {  328}
   (( segid "3T5T" and resid 7    and name H5''))
   (( segid "3T5T" and resid 7    and name H1' ))
      3.300     1.400     1.400 peak   328 spectrum    1 weight  0.10000E+01 volume  0.27477E-02 ppm1      4.174 ppm2      6.354 CV     1
 OR {  328}
   (( segid "3T5T" and resid 7    and name H5' ))
   (( segid "3T5T" and resid 7    and name H1' ))
 ASSI {  329}
   (( segid "3T5T" and resid 7    and name H5''))
   (( segid "3T5T" and resid 7    and name H2' ))
      3.700     1.700     1.700 peak   329 spectrum    1 weight  0.10000E+01 volume  0.96042E-03 ppm1      4.138 ppm2      2.304 CV     1
 OR {  329}
   (( segid "3T5T" and resid 7    and name H5' ))
   (( segid "3T5T" and resid 7    and name H2' ))
 ASSI {  330}
   (( segid "3T5T" and resid 7    and name H5''))
   (( segid "3T5T" and resid 7    and name H3' ))
      2.500     0.800     0.800 peak   330 spectrum    1 weight  0.10000E+01 volume  0.53670E-02 ppm1      4.142 ppm2      4.598 CV     1
 OR {  330}
   (( segid "3T5T" and resid 7    and name H5' ))
   (( segid "3T5T" and resid 7    and name H3' ))
 ASSI {  331}
   (( segid "3T5T" and resid 7    and name H5''))
   (( segid "3T5T" and resid 7    and name H6  ))
      3.200     1.300     1.300 peak   331 spectrum    1 weight  0.10000E+01 volume  0.16023E-02 ppm1      4.155 ppm2      7.901 CV     1
 OR {  331}
   (( segid "3T5T" and resid 7    and name H5' ))
   (( segid "3T5T" and resid 7    and name H6  ))
 ASSI {  332}
   (( segid "3T5T" and resid 7    and name H6  ))
   (( segid "3T5T" and resid 6    and name H3' ))
      3.000     1.100     1.100 peak   332 spectrum    1 weight  0.10000E+01 volume  0.19940E-02 ppm1      7.902 ppm2      5.024 CV     1
 ASSI {  338}
   (( segid "3T5T" and resid 7    and name H6  ))
   (( segid "3T5T" and resid 7    and name H5  ))
      2.200     0.600     0.600 peak   338 spectrum    1 weight  0.10000E+01 volume  0.12048E-01 ppm1      7.901 ppm2      6.043 CV     1
 ASSI {    3}
   (  segid "T22D" and resid 44   and name HE% )
   (( segid "3T5T" and resid 1    and name H8  ))
      3.700     1.700     1.700 peak     3 spectrum    1 weight  0.10000E+01 volume  0.70479E-03 ppm1      6.019 ppm2      8.012 CV     1
 ASSI {    4}
   (( segid "T22D" and resid 41   and name HA1 ))
   (( segid "3T5T" and resid 3    and name H73 ))
      3.600     1.600     1.600 peak     4 spectrum    1 weight  0.10000E+01 volume  0.21650E-02 ppm1      4.064 ppm2      1.909 CV     1
 OR {    4}
   (( segid "T22D" and resid 41   and name HA1 ))
   (( segid "3T5T" and resid 3    and name H71 ))
 OR {    4}
   (( segid "T22D" and resid 41   and name HA1 ))
   (( segid "3T5T" and resid 3    and name H72 ))
 ASSI {    5}
   (( segid "T22D" and resid 41   and name HA2 ))
   (( segid "3T5T" and resid 3    and name H73 ))
      2.900     1.000     1.000 peak     5 spectrum    1 weight  0.10000E+01 volume  0.21390E-02 ppm1      3.967 ppm2      1.906 CV     1
 OR {    5}
   (( segid "T22D" and resid 41   and name HA2 ))
   (( segid "3T5T" and resid 3    and name H72 ))
 OR {    5}
   (( segid "T22D" and resid 41   and name HA2 ))
   (( segid "3T5T" and resid 3    and name H71 ))
 ASSI {    6}
   (( segid "T22D" and resid 38   and name HZ  ))
   (( segid "3T5T" and resid 4    and name H1' ))
      3.500     1.600     1.600 peak     6 spectrum    1 weight  0.10000E+01 volume  0.80892E-03 ppm1      5.386 ppm2      6.279 CV     1
 ASSI {    7}
   (( segid "T22D" and resid 78   and name HB1 ))
   (( segid "3T5T" and resid 4    and name H1' ))
      3.500     1.500     1.500 peak     7 spectrum    1 weight  0.10000E+01 volume  0.90596E-03 ppm1      2.426 ppm2      6.262 CV     1
 ASSI {   10}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "3T5T" and resid 5    and name H1' ))
      3.200     1.300     1.300 peak    10 spectrum    1 weight  0.10000E+01 volume  0.33570E-02 ppm1      7.148 ppm2      6.574 CV     1
 ASSI {   12}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "3T5T" and resid 5    and name H6  ))
      3.700     1.800     1.800 peak    12 spectrum    1 weight  0.10000E+01 volume  0.79107E-03 ppm1      6.399 ppm2      7.129 CV     1
 ASSI {   13}
   (( segid "T22D" and resid 38   and name HZ  ))
   (( segid "3T5T" and resid 5    and name H6  ))
      3.600     1.600     1.600 peak    13 spectrum    1 weight  0.10000E+01 volume  0.89553E-03 ppm1      5.398 ppm2      7.124 CV     1
 ASSI {   14}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "3T5T" and resid 5    and name H72 ))
      3.600     1.600     1.600 peak    14 spectrum    1 weight  0.10000E+01 volume  0.12943E-02 ppm1      6.400 ppm2      1.152 CV     1
 OR {   14}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "3T5T" and resid 5    and name H73 ))
 OR {   14}
   (  segid "T22D" and resid 38   and name HE% )
   (( segid "3T5T" and resid 5    and name H71 ))
 ASSI {   18}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "3T5T" and resid 6    and name H1' ))
      3.400     1.500     1.500 peak    18 spectrum    1 weight  0.10000E+01 volume  0.12998E-02 ppm1      0.949 ppm2      6.369 CV     1
 OR {   18}
   (  segid "T22D" and resid 65   and name HG1%)
   (( segid "3T5T" and resid 6    and name H1' ))
 ASSI {   21}
   (  segid "T22D" and resid 80   and name HD% )
   (( segid "3T5T" and resid 6    and name H1' ))
      3.600     1.600     1.600 peak    21 spectrum    1 weight  0.10000E+01 volume  0.12889E-02 ppm1      6.613 ppm2      6.368 CV     1
 ASSI {   22}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "3T5T" and resid 6    and name H1' ))
      3.900     1.900     1.900 peak    22 spectrum    1 weight  0.10000E+01 volume  0.58594E-03 ppm1      7.165 ppm2      6.372 CV     1
 ASSI {   23}
   (( segid "T22D" and resid 36   and name HE2 ))
   (( segid "3T5T" and resid 6    and name H8  ))
      3.900     1.900     1.900 peak    23 spectrum    1 weight  0.10000E+01 volume  0.63019E-03 ppm1      2.253 ppm2      7.803 CV     1
 ASSI {   24}
   (  segid "T22D" and resid 67   and name HD1%)
   (( segid "3T5T" and resid 6    and name H8  ))
      3.500     1.500     1.500 peak    24 spectrum    1 weight  0.10000E+01 volume  0.10496E-02 ppm1      0.773 ppm2      7.804 CV     1
 ASSI {   25}
   (  segid "T22D" and resid 80   and name HD% )
   (( segid "3T5T" and resid 6    and name H8  ))
      3.400     1.500     1.500 peak    25 spectrum    1 weight  0.10000E+01 volume  0.12140E-02 ppm1      6.597 ppm2      7.803 CV     1
 ASSI {   26}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "3T5T" and resid 6    and name H8  ))
      3.000     1.100     1.100 peak    26 spectrum    1 weight  0.10000E+01 volume  0.18261E-02 ppm1      7.164 ppm2      7.802 CV     1
 ASSI {   27}
   (( segid "T22D" and resid 80   and name HZ  ))
   (( segid "3T5T" and resid 6    and name H8  ))
      3.100     1.200     1.200 peak    27 spectrum    1 weight  0.10000E+01 volume  0.14451E-02 ppm1      7.305 ppm2      7.798 CV     1
 ASSI {   12}
   (( segid "3T5T" and resid 5    and name H4' ))
   (( segid "T22D" and resid 78   and name HH  ))
      3.200     1.300     1.300 peak    12 spectrum    1 weight  0.10000E+01 volume  0.16371E-02 ppm1      4.575 ppm2      9.598 CV     1
 ASSI {   14}
   (( segid "3T5T" and resid 5    and name H6  ))
   (( segid "3T5T" and resid 5    and name H3  ))
      3.700     1.700     1.700 peak    14 spectrum    1 weight  0.10000E+01 volume  0.78019E-03 ppm1      7.121 ppm2     11.237 CV     1
 ASSI {   15}
   (( segid "3T5T" and resid 6    and name H5' ))
   (( segid "T22D" and resid 78   and name HH  ))
      4.000     2.000     2.000 peak    15 spectrum    1 weight  0.10000E+01 volume  0.53474E-03 ppm1      4.455 ppm2      9.600 CV     1
 ASSI {   16}
   (( segid "3T5T" and resid 6    and name H5''))
   (( segid "T22D" and resid 78   and name HH  ))
      3.900     1.900     1.900 peak    16 spectrum    1 weight  0.10000E+01 volume  0.80033E-03 ppm1      4.216 ppm2      9.593 CV     1
 ASSI {   17}
   (( segid "3T5T" and resid 6    and name H8  ))
   (( segid "3T5T" and resid 5    and name H1' ))
      3.400     1.500     1.500 peak    17 spectrum    1 weight  0.10000E+01 volume  0.21349E-02 ppm1      7.796 ppm2      6.573 CV     1
 ASSI {   22}
   (( segid "T22D" and resid 44   and name HB1 ))
   (  segid "T22D" and resid 44   and name HD% )
      2.600     0.800     0.800 peak    22 spectrum    1 weight  0.10000E+01 volume  0.74766E-02 ppm1      3.256 ppm2      6.803 CV     1
 ASSI {   23}
   (( segid "T22D" and resid 44   and name HB2 ))
   (  segid "T22D" and resid 44   and name HD% )
      2.500     0.800     0.800 peak    23 spectrum    1 weight  0.10000E+01 volume  0.51881E-02 ppm1      2.822 ppm2      6.802 CV     1
 ASSI {   25}
   (  segid "T22D" and resid 44   and name HE% )
   (  segid "T22D" and resid 44   and name HD% )
      2.000     0.500     0.500 peak    25 spectrum    1 weight  0.10000E+01 volume  0.19016E-01 ppm1      5.995 ppm2      6.802 CV     1
 ASSI {   26}
   (  segid "T22D" and resid 67   and name HG2%)
   (( segid "T22D" and resid 78   and name HH  ))
      3.800     1.800     1.800 peak    26 spectrum    1 weight  0.10000E+01 volume  0.13478E-02 ppm1      0.869 ppm2      9.593 CV     1
 ASSI {   27}
   (( segid "T22D" and resid 76   and name HD1 ))
   (( segid "T22D" and resid 78   and name HH  ))
      3.500     1.600     1.600 peak    27 spectrum    1 weight  0.10000E+01 volume  0.58198E-03 ppm1      3.383 ppm2      9.606 CV     1
 ASSI {   28}
   (( segid "T22D" and resid 76   and name HD2 ))
   (( segid "T22D" and resid 78   and name HH  ))
      4.700     2.700     1.300 peak    28 spectrum    1 weight  0.10000E+01 volume  0.50225E-03 ppm1      3.050 ppm2      9.606 CV     1
 ASSI {   29}
   (  segid "T22D" and resid 78   and name HE% )
   (( segid "T22D" and resid 78   and name HH  ))
      3.300     1.400     1.400 peak    29 spectrum    1 weight  0.10000E+01 volume  0.10571E-02 ppm1      6.601 ppm2      9.596 CV     1
 ASSI {   31}
   (( segid "T22D" and resid 78   and name HH  ))
   (  segid "T22D" and resid 80   and name HE% )
      4.200     2.200     1.800 peak    31 spectrum    1 weight  0.10000E+01 volume  0.62031E-03 ppm1      9.606 ppm2      7.132 CV     1
 ASSI {   36}
   (( segid "T22D" and resid 111  and name HB1 ))
   (  segid "T22D" and resid 111  and name HE% )
      3.700     1.800     1.800 peak    36 spectrum    1 weight  0.10000E+01 volume  0.21624E-02 ppm1      2.933 ppm2      6.706 CV     1
 ASSI {   37}
   (( segid "T22D" and resid 111  and name HB2 ))
   (  segid "T22D" and resid 111  and name HE% )
      3.500     1.600     1.600 peak    37 spectrum    1 weight  0.10000E+01 volume  0.32285E-02 ppm1      3.224 ppm2      6.704 CV     1
!
!Ambiguous restraints
!
 ASSI {    3}
   (( segid "T22D" and resid 66   and name HN  ))
   (( segid "T22D" and resid 48   and name HA  ))
      3.500     1.500     1.500 peak     3 spectrum    1 weight  0.10000E+01 volume  0.13550E-02 ppm1      8.450 ppm2      4.069 CV     1
 OR {    3}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 89   and name HA  ))
 OR {    3}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 61   and name HA  ))
 OR {    3}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 88   and name HB2 ))
 ASSI {    7}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 35   and name HA  ))
      3.300     1.400     1.400 peak     7 spectrum    1 weight  0.10000E+01 volume  0.95012E-03 ppm1      8.450 ppm2      4.400 CV     1
 OR {    7}
   (( segid "T22D" and resid 66   and name HN  ))
   (( segid "T22D" and resid 47   and name HB2 ))
 ASSI {   11}
   (( segid "T22D" and resid 83   and name HN  ))
   (( segid "T22D" and resid 61   and name HG11))
      4.300     2.300     1.700 peak    11 spectrum    1 weight  0.10000E+01 volume  0.45100E-03 ppm1      8.451 ppm2      1.533 CV     1
 OR {   11}
   (( segid "T22D" and resid 83   and name HN  ))
   (  segid "T22D" and resid 87   and name HB% )
 OR {   11}
   (( segid "T22D" and resid 66   and name HN  ))
   (( segid "T22D" and resid 76   and name HG2 ))
 ASSI {   12}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 91   and name HG1 ))
      4.500     2.500     1.500 peak    12 spectrum    1 weight  0.10000E+01 volume  0.68123E-03 ppm1      8.561 ppm2      1.739 CV     1
 OR {   12}
   (( segid "T22D" and resid 90   and name HN  ))
   (( segid "T22D" and resid 37   and name HG11))
 ASSI {   15}
   (( segid "T22D" and resid 94   and name HN  ))
   (  segid "T22D" and resid 92   and name HB% )
      3.200     1.300     1.300 peak    15 spectrum    1 weight  0.10000E+01 volume  0.88094E-03 ppm1      7.059 ppm2      1.463 CV     1
 OR {   15}
   (( segid "T22D" and resid 114  and name HN  ))
   (( segid "T22D" and resid 112  and name HB1 ))
 OR {   15}
   (( segid "T22D" and resid 114  and name HN  ))
   (( segid "T22D" and resid 115  and name HG1 ))
 OR {   15}
   (( segid "T22D" and resid 114  and name HN  ))
   (( segid "T22D" and resid 115  and name HG2 ))
 ASSI {   23}
   (( segid "T22D" and resid 33   and name HN  ))
   (( segid "T22D" and resid 34   and name HA  ))
      3.900     1.900     1.900 peak    23 spectrum    1 weight  0.10000E+01 volume  0.11160E-02 ppm1      8.055 ppm2      4.962 CV     1
 OR {   23}
   (( segid "T22D" and resid 33   and name HN  ))
   (( segid "T22D" and resid 36   and name HA  ))
 ASSI {   41}
   (( segid "T22D" and resid 35   and name HN  ))
   (( segid "T22D" and resid 36   and name HB2 ))
      4.500     2.500     1.500 peak    41 spectrum    1 weight  0.10000E+01 volume  0.61297E-03 ppm1      7.456 ppm2      2.014 CV     1
 OR {   41}
   (( segid "T22D" and resid 35   and name HN  ))
   (( segid "T22D" and resid 83   and name HB2 ))
 ASSI {   50}
   (( segid "T22D" and resid 36   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
      4.300     2.300     1.700 peak    50 spectrum    1 weight  0.10000E+01 volume  0.74483E-03 ppm1      7.902 ppm2      1.574 CV     1
 OR {   50}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 36   and name HD2 ))
 ASSI {   52}
   (( segid "T22D" and resid 36   and name HN  ))
   (( segid "T22D" and resid 36   and name HG1 ))
      4.100     2.100     1.900 peak    52 spectrum    1 weight  0.10000E+01 volume  0.79157E-03 ppm1      7.897 ppm2      0.930 CV     1
 OR {   52}
   (( segid "T22D" and resid 36   and name HN  ))
   (  segid "T22D" and resid 109  and name HD2%)
 ASSI {   72}
   (( segid "T22D" and resid 38   and name HN  ))
   (( segid "T22D" and resid 39   and name HA  ))
      3.800     1.800     1.800 peak    72 spectrum    1 weight  0.10000E+01 volume  0.64428E-03 ppm1      9.270 ppm2      4.422 CV     1
 OR {   72}
   (( segid "T22D" and resid 38   and name HN  ))
   (( segid "T22D" and resid 111  and name HA  ))
 OR {   72}
   (( segid "T22D" and resid 38   and name HN  ))
   (( segid "T22D" and resid 35   and name HA  ))
 ASSI {  101}
   (( segid "T22D" and resid 42   and name HN  ))
   (( segid "T22D" and resid 40   and name HA1 ))
      4.700     2.800     1.300 peak   101 spectrum    1 weight  0.10000E+01 volume  0.41889E-03 ppm1      7.694 ppm2      3.771 CV     1
 OR {  101}
   (( segid "T22D" and resid 42   and name HN  ))
   (( segid "T22D" and resid 43   and name HD1 ))
 OR {  101}
   (( segid "T22D" and resid 42   and name HN  ))
   (( segid "T22D" and resid 46   and name HB  ))
 ASSI {  107}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 116  and name HA  ))
      4.000     2.000     2.000 peak   107 spectrum    1 weight  0.10000E+01 volume  0.39268E-03 ppm1      8.298 ppm2      4.434 CV     1
 OR {  107}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 111  and name HA  ))
 OR {  107}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 117  and name HA  ))
 ASSI {  114}
   (( segid "T22D" and resid 46   and name HN  ))
   (( segid "T22D" and resid 44   and name HA  ))
      3.700     1.700     1.700 peak   114 spectrum    1 weight  0.10000E+01 volume  0.59241E-03 ppm1      7.279 ppm2      4.218 CV     1
 OR {  114}
   (( segid "T22D" and resid 46   and name HN  ))
   (( segid "T22D" and resid 75   and name HB2 ))
 OR {  114}
   (( segid "T22D" and resid 46   and name HN  ))
   (( segid "T22D" and resid 77   and name HA2 ))
 ASSI {  119}
   (( segid "T22D" and resid 47   and name HN  ))
   (  segid "T22D" and resid 66   and name HG2%)
      4.000     2.000     2.000 peak   119 spectrum    1 weight  0.10000E+01 volume  0.54741E-03 ppm1      8.420 ppm2      0.581 CV     1
 OR {  119}
   (( segid "T22D" and resid 47   and name HN  ))
   (  segid "T22D" and resid 51   and name HD1%)
 ASSI {  120}
   (( segid "T22D" and resid 47   and name HN  ))
   (( segid "T22D" and resid 50   and name HA  ))
      4.300     2.300     1.700 peak   120 spectrum    1 weight  0.10000E+01 volume  0.73115E-03 ppm1      8.427 ppm2      4.197 CV     1
 OR {  120}
   (( segid "T22D" and resid 47   and name HN  ))
   (( segid "T22D" and resid 49   and name HA  ))
 ASSI {  165}
   (( segid "T22D" and resid 52   and name HN  ))
   (( segid "T22D" and resid 49   and name HB2 ))
      2.800     2.800     3.200 peak   165 spectrum    1 weight  0.10000E+01 volume  0.27141E-02 ppm1      8.546 ppm2      1.865 CV     1
 OR {  165}
   (( segid "T22D" and resid 52   and name HN  ))
   (( segid "T22D" and resid 66   and name HB  ))
 OR {  165}
   (( segid "T22D" and resid 52   and name HN  ))
   (( segid "T22D" and resid 37   and name HB  ))
 ASSI {  166}
   (( segid "T22D" and resid 52   and name HN  ))
   (  segid "T22D" and resid 51   and name HD1%)
      4.700     2.800     1.300 peak   166 spectrum    1 weight  0.10000E+01 volume  0.56238E-03 ppm1      8.549 ppm2      0.542 CV     1
 OR {  166}
   (( segid "T22D" and resid 52   and name HN  ))
   (  segid "T22D" and resid 81   and name HG1%)
 ASSI {  167}
   (( segid "T22D" and resid 52   and name HN  ))
   (( segid "T22D" and resid 51   and name HG  ))
      4.700     2.700     1.300 peak   167 spectrum    1 weight  0.10000E+01 volume  0.48261E-03 ppm1      8.543 ppm2      1.495 CV     1
 OR {  167}
   (( segid "T22D" and resid 52   and name HN  ))
   (( segid "T22D" and resid 61   and name HB  ))
 ASSI {  174}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 53   and name HA  ))
      2.500     0.800     0.800 peak   174 spectrum    1 weight  0.10000E+01 volume  0.50579E-02 ppm1      8.534 ppm2      4.096 CV     1
 OR {  174}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 54   and name HA  ))
 ASSI {  175}
   (( segid "T22D" and resid 53   and name HN  ))
   (  segid "T22D" and resid 64   and name HB% )
      4.400     2.400     1.600 peak   175 spectrum    1 weight  0.10000E+01 volume  0.88911E-03 ppm1      8.534 ppm2      1.292 CV     1
 OR {  175}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 51   and name HB2 ))
 OR {  175}
   (( segid "T22D" and resid 53   and name HN  ))
   (  segid "T22D" and resid 50   and name HG2%)
 ASSI {  178}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 51   and name HB1 ))
      4.200     2.200     1.800 peak   178 spectrum    1 weight  0.10000E+01 volume  0.47627E-03 ppm1      8.538 ppm2      1.896 CV     1
 OR {  178}
   (( segid "T22D" and resid 53   and name HN  ))
   (( segid "T22D" and resid 49   and name HB2 ))
 ASSI {  206}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 53   and name HA  ))
      3.400     1.400     1.400 peak   206 spectrum    1 weight  0.10000E+01 volume  0.15442E-02 ppm1      8.427 ppm2      4.081 CV     1
 OR {  206}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 54   and name HA  ))
 OR {  206}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 57   and name HA  ))
 ASSI {  207}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 61   and name HG11))
      4.200     2.200     1.800 peak   207 spectrum    1 weight  0.10000E+01 volume  0.58874E-03 ppm1      8.431 ppm2      1.503 CV     1
 OR {  207}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 57   and name HG1 ))
 OR {  207}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 61   and name HB  ))
 ASSI {  208}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 59   and name HN  ))
      4.700     2.800     1.300 peak   208 spectrum    1 weight  0.10000E+01 volume  0.38288E-03 ppm1      8.429 ppm2      7.299 CV     1
 OR {  208}
   (( segid "T22D" and resid 56   and name HN  ))
   (( segid "T22D" and resid 52   and name HD2 ))
 OR {  208}
   (( segid "T22D" and resid 56   and name HN  ))
   (  segid "T22D" and resid 55   and name HE% )
 ASSI {  219}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 53   and name HB1 ))
      3.700     3.700     2.300 peak   219 spectrum    1 weight  0.10000E+01 volume  0.53294E-03 ppm1      6.708 ppm2      2.028 CV     1
 OR {  219}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 91   and name HB2 ))
 OR {  219}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 98   and name HG1 ))
 OR {  219}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 98   and name HG2 ))
 OR {  219}
   (( segid "T22D" and resid 57   and name HN  ))
   (( segid "T22D" and resid 83   and name HB2 ))
 ASSI {  235}
   (( segid "T22D" and resid 58   and name HN  ))
   (( segid "T22D" and resid 59   and name HA2 ))
      4.900     3.000     1.100 peak   235 spectrum    1 weight  0.10000E+01 volume  0.46985E-03 ppm1      7.642 ppm2      3.842 CV     1
 OR {  235}
   (( segid "T22D" and resid 58   and name HN  ))
   (( segid "T22D" and resid 88   and name HB1 ))
 ASSI {  256}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 61   and name HB  ))
      5.100     3.300     0.900 peak   256 spectrum    1 weight  0.10000E+01 volume  0.24676E-03 ppm1      8.211 ppm2      1.447 CV     1
 OR {  256}
   (( segid "T22D" and resid 60   and name HN  ))
   (  segid "T22D" and resid 92   and name HB% )
 OR {  256}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 99   and name HG11))
 ASSI {  258}
   (( segid "T22D" and resid 60   and name HN  ))
   (( segid "T22D" and resid 88   and name HB2 ))
      3.900     1.900     1.900 peak   258 spectrum    1 weight  0.10000E+01 volume  0.10235E-02 ppm1      8.213 ppm2      4.052 CV     1
 OR {  258}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 96   and name HD1 ))
 ASSI {  288}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 63   and name HA  ))
      4.500     2.600     1.500 peak   288 spectrum    1 weight  0.10000E+01 volume  0.43152E-03 ppm1      9.148 ppm2      4.579 CV     1
 OR {  288}
   (( segid "T22D" and resid 62   and name HN  ))
   (( segid "T22D" and resid 35   and name HB  ))
 ASSI {  326}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 80   and name HN  ))
      3.000     1.200     1.200 peak   326 spectrum    1 weight  0.10000E+01 volume  0.18392E-02 ppm1      8.917 ppm2      8.412 CV     1
 OR {  326}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 66   and name HN  ))
 ASSI {  327}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 51   and name HD1%)
      3.000     1.100     1.100 peak   327 spectrum    1 weight  0.10000E+01 volume  0.25435E-02 ppm1      8.919 ppm2      0.552 CV     1
 OR {  327}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 66   and name HG2%)
 OR {  327}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 81   and name HG1%)
 ASSI {  328}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 67   and name HD1%)
      4.200     2.200     1.800 peak   328 spectrum    1 weight  0.10000E+01 volume  0.72498E-03 ppm1      8.921 ppm2      0.731 CV     1
 OR {  328}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 66   and name HG1%)
 OR {  328}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 39   and name HG1%)
 ASSI {  329}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 81   and name HB  ))
      4.200     2.200     1.800 peak   329 spectrum    1 weight  0.10000E+01 volume  0.69036E-03 ppm1      8.920 ppm2      1.118 CV     1
 OR {  329}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 67   and name HG12))
 OR {  329}
   (( segid "T22D" and resid 65   and name HN  ))
   (  segid "T22D" and resid 82   and name HG2%)
 ASSI {  332}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 63   and name HA  ))
      4.700     2.800     1.300 peak   332 spectrum    1 weight  0.10000E+01 volume  0.51163E-03 ppm1      8.918 ppm2      4.575 CV     1
 OR {  332}
   (( segid "T22D" and resid 65   and name HN  ))
   (( segid "T22D" and resid 38   and name HA  ))
 ASSI {  349}
   (( segid "T22D" and resid 67   and name HN  ))
   (( segid "T22D" and resid 76   and name HB1 ))
      4.000     2.000     2.000 peak   349 spectrum    1 weight  0.10000E+01 volume  0.12940E-02 ppm1      8.347 ppm2      1.337 CV     1
 OR {  349}
   (( segid "T22D" and resid 67   and name HN  ))
   (( segid "T22D" and resid 51   and name HB2 ))
 OR {  349}
   (( segid "T22D" and resid 67   and name HN  ))
   (  segid "T22D" and resid 64   and name HB% )
 ASSI {  351}
   (( segid "T22D" and resid 67   and name HN  ))
   (( segid "T22D" and resid 67   and name HB  ))
      2.600     0.800     0.800 peak   351 spectrum    1 weight  0.10000E+01 volume  0.28386E-02 ppm1      8.342 ppm2      0.940 CV     1
 OR {  351}
   (( segid "T22D" and resid 67   and name HN  ))
   (  segid "T22D" and resid 68   and name HG2%)
 ASSI {  352}
   (( segid "T22D" and resid 67   and name HN  ))
   (  segid "T22D" and resid 66   and name HG1%)
      2.700     0.900     0.900 peak   352 spectrum    1 weight  0.10000E+01 volume  0.30147E-02 ppm1      8.342 ppm2      0.724 CV     1
 OR {  352}
   (( segid "T22D" and resid 67   and name HN  ))
   (  segid "T22D" and resid 67   and name HD1%)
 ASSI {  357}
   (( segid "T22D" and resid 68   and name HN  ))
   (  segid "T22D" and resid 68   and name HG2%)
      2.700     0.900     0.900 peak   357 spectrum    1 weight  0.10000E+01 volume  0.37688E-02 ppm1      7.928 ppm2      0.947 CV     1
 OR {  357}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "T22D" and resid 67   and name HB  ))
 ASSI {  361}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "3T5T" and resid 6    and name H4' ))
      3.900     1.900     1.900 peak   361 spectrum    1 weight  0.10000E+01 volume  0.65062E-03 ppm1      7.927 ppm2      4.584 CV     1
 OR {  361}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "T22D" and resid 69   and name HA  ))
 OR {  361}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "T22D" and resid 76   and name HA  ))
 ASSI {  362}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "3T5T" and resid 6    and name H5''))
      4.100     2.100     1.900 peak   362 spectrum    1 weight  0.10000E+01 volume  0.12759E-02 ppm1      7.927 ppm2      4.272 CV     1
 OR {  362}
   (( segid "T22D" and resid 68   and name HN  ))
   (( segid "T22D" and resid 44   and name HA  ))
 ASSI {  366}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 76   and name HG2 ))
      3.600     1.700     1.700 peak   366 spectrum    1 weight  0.10000E+01 volume  0.86680E-03 ppm1      8.604 ppm2      1.516 CV     1
 OR {  366}
   (( segid "T22D" and resid 69   and name HN  ))
   (( segid "T22D" and resid 74   and name HD1 ))
 ASSI {  438}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 74   and name HG1 ))
      3.100     3.100     2.900 peak   438 spectrum    1 weight  0.10000E+01 volume  0.70684E-03 ppm1      8.725 ppm2      1.373 CV     1
 OR {  438}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 74   and name HG2 ))
 OR {  438}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 76   and name HB1 ))
 ASSI {  439}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 73   and name HB2 ))
      3.200     3.200     2.800 peak   439 spectrum    1 weight  0.10000E+01 volume  0.41397E-03 ppm1      8.718 ppm2      2.404 CV     1
 OR {  439}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 73   and name HB1 ))
 OR {  439}
   (( segid "T22D" and resid 75   and name HN  ))
   (( segid "T22D" and resid 78   and name HB1 ))
 ASSI {  448}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 74   and name HA  ))
      3.000     3.000     3.000 peak   448 spectrum    1 weight  0.10000E+01 volume  0.64583E-03 ppm1      9.135 ppm2      4.372 CV     1
 OR {  448}
   (( segid "T22D" and resid 76   and name HN  ))
   (( segid "T22D" and resid 39   and name HA  ))
 ASSI {  487}
   (( segid "T22D" and resid 79   and name HN  ))
   (( segid "T22D" and resid 42   and name HB2 ))
      4.700     2.700     1.300 peak   487 spectrum    1 weight  0.10000E+01 volume  0.46293E-03 ppm1      8.769 ppm2      0.924 CV     1
 OR {  487}
   (( segid "T22D" and resid 79   and name HN  ))
   (  segid "T22D" and resid 51   and name HD2%)
 ASSI {  488}
   (( segid "T22D" and resid 79   and name HN  ))
   (  segid "T22D" and resid 39   and name HG1%)
      4.300     2.300     1.700 peak   488 spectrum    1 weight  0.10000E+01 volume  0.61405E-03 ppm1      8.770 ppm2      0.680 CV     1
 OR {  488}
   (( segid "T22D" and resid 79   and name HN  ))
   (  segid "T22D" and resid 66   and name HG1%)
 ASSI {  509}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 81   and name HG1%)
      3.500     1.500     1.500 peak   509 spectrum    1 weight  0.10000E+01 volume  0.18032E-02 ppm1      8.813 ppm2      0.540 CV     1
 OR {  509}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 37   and name HG12))
 ASSI {  512}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 65   and name HG2%)
      4.300     2.300     1.700 peak   512 spectrum    1 weight  0.10000E+01 volume  0.56376E-03 ppm1      8.804 ppm2      0.902 CV     1
 OR {  512}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 51   and name HD2%)
 OR {  512}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 61   and name HG12))
 OR {  512}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 109  and name HD2%)
 ASSI {  513}
   (( segid "T22D" and resid 81   and name HN  ))
   (  segid "T22D" and resid 110  and name HB% )
      3.500     1.500     1.500 peak   513 spectrum    1 weight  0.10000E+01 volume  0.37472E-03 ppm1      8.801 ppm2      1.677 CV     1
 OR {  513}
   (( segid "T22D" and resid 81   and name HN  ))
   (( segid "T22D" and resid 62   and name HB1 ))
 ASSI {  526}
   (( segid "T22D" and resid 82   and name HN  ))
   (( segid "T22D" and resid 63   and name HA  ))
      4.200     2.200     1.800 peak   526 spectrum    1 weight  0.10000E+01 volume  0.50554E-03 ppm1      9.569 ppm2      4.582 CV     1
 OR {  526}
   (( segid "T22D" and resid 82   and name HN  ))
   (( segid "T22D" and resid 35   and name HB  ))
 ASSI {  543}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 61   and name HG11))
      3.000     3.000     3.000 peak   543 spectrum    1 weight  0.10000E+01 volume  0.77644E-03 ppm1      8.346 ppm2      1.538 CV     1
 OR {  543}
   (( segid "T22D" and resid 84   and name HN  ))
   (( segid "T22D" and resid 61   and name HB  ))
 OR {  543}
   (( segid "T22D" and resid 84   and name HN  ))
   (  segid "T22D" and resid 87   and name HB% )
 ASSI {  555}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 88   and name HB2 ))
      2.800     1.000     1.000 peak   555 spectrum    1 weight  0.10000E+01 volume  0.32543E-02 ppm1      7.733 ppm2      4.076 CV     1
 OR {  555}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 84   and name HA  ))
 OR {  555}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 89   and name HA  ))
 ASSI {  556}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 88   and name HB1 ))
      4.600     2.700     1.400 peak   556 spectrum    1 weight  0.10000E+01 volume  0.38728E-03 ppm1      7.736 ppm2      3.876 CV     1
 OR {  556}
   (( segid "T22D" and resid 85   and name HN  ))
   (( segid "T22D" and resid 59   and name HA2 ))
 ASSI {  557}
   (( segid "T22D" and resid 85   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
      4.800     2.900     1.200 peak   557 spectrum    1 weight  0.10000E+01 volume  0.41509E-03 ppm1      7.740 ppm2      1.554 CV     1
 OR {  557}
   (( segid "T22D" and resid 85   and name HN  ))
   (  segid "T22D" and resid 87   and name HB% )
 ASSI {  576}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 86   and name HA  ))
      3.500     1.500     1.500 peak   576 spectrum    1 weight  0.10000E+01 volume  0.10530E-02 ppm1      8.678 ppm2      4.046 CV     1
 OR {  576}
   (( segid "T22D" and resid 87   and name HN  ))
   (( segid "T22D" and resid 88   and name HB2 ))
 ASSI {  586}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 91   and name HG1 ))
      4.100     2.100     1.900 peak   586 spectrum    1 weight  0.10000E+01 volume  0.49253E-03 ppm1      8.355 ppm2      1.706 CV     1
 OR {  586}
   (( segid "T22D" and resid 88   and name HN  ))
   (( segid "T22D" and resid 37   and name HG11))
 ASSI {  597}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 88   and name HB2 ))
      2.300     0.700     0.700 peak   597 spectrum    1 weight  0.10000E+01 volume  0.56630E-02 ppm1      7.572 ppm2      4.062 CV     1
 OR {  597}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 89   and name HA  ))
 OR {  597}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 86   and name HA  ))
 ASSI {  599}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 83   and name HG1 ))
      3.200     1.300     1.300 peak   599 spectrum    1 weight  0.10000E+01 volume  0.12019E-02 ppm1      7.577 ppm2      2.227 CV     1
 OR {  599}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 90   and name HB2 ))
 ASSI {  600}
   (( segid "T22D" and resid 89   and name HN  ))
   (  segid "T22D" and resid 83   and name HE% )
      3.700     1.700     1.700 peak   600 spectrum    1 weight  0.10000E+01 volume  0.10133E-02 ppm1      7.570 ppm2      1.902 CV     1
 OR {  600}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 92   and name HA  ))
 OR {  600}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 37   and name HB  ))
 ASSI {  602}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 88   and name HA  ))
      4.000     2.000     2.000 peak   602 spectrum    1 weight  0.10000E+01 volume  0.48624E-03 ppm1      7.568 ppm2      4.387 CV     1
 OR {  602}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 35   and name HA  ))
 ASSI {  603}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 87   and name HA  ))
      3.600     1.600     1.600 peak   603 spectrum    1 weight  0.10000E+01 volume  0.10348E-02 ppm1      7.574 ppm2      4.248 CV     1
 OR {  603}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 37   and name HA  ))
 ASSI {  604}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 91   and name HG1 ))
      4.400     2.400     1.600 peak   604 spectrum    1 weight  0.10000E+01 volume  0.64683E-03 ppm1      7.568 ppm2      1.740 CV     1
 OR {  604}
   (( segid "T22D" and resid 89   and name HN  ))
   (( segid "T22D" and resid 37   and name HG11))
 ASSI {  612}
   (( segid "T22D" and resid 90   and name HN  ))
   (  segid "T22D" and resid 34   and name HE% )
      4.300     2.300     1.700 peak   612 spectrum    1 weight  0.10000E+01 volume  0.51843E-03 ppm1      8.560 ppm2      7.352 CV     1
 OR {  612}
   (( segid "T22D" and resid 90   and name HN  ))
   (  segid "T22D" and resid 58   and name HD% )
 ASSI {  625}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 94   and name HB2 ))
      3.900     1.900     1.900 peak   625 spectrum    1 weight  0.10000E+01 volume  0.10030E-02 ppm1      7.888 ppm2      1.894 CV     1
 OR {  625}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 92   and name HA  ))
 OR {  625}
   (( segid "T22D" and resid 91   and name HN  ))
   (  segid "T22D" and resid 83   and name HE% )
 ASSI {  626}
   (( segid "T22D" and resid 91   and name HN  ))
   (  segid "T22D" and resid 87   and name HB% )
      4.100     2.100     1.900 peak   626 spectrum    1 weight  0.10000E+01 volume  0.68594E-03 ppm1      7.894 ppm2      1.564 CV     1
 OR {  626}
   (( segid "T22D" and resid 91   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
 OR {  626}
   (( segid "T22D" and resid 91   and name HN  ))
   (( segid "T22D" and resid 94   and name HG2 ))
 ASSI {  633}
   (( segid "T22D" and resid 92   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
      3.700     1.700     1.700 peak   633 spectrum    1 weight  0.10000E+01 volume  0.10846E-02 ppm1      7.918 ppm2      1.584 CV     1
 OR {  633}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 94   and name HG1 ))
 OR {  633}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 94   and name HG2 ))
 ASSI {  636}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 83   and name HG2 ))
      4.100     2.100     1.900 peak   636 spectrum    1 weight  0.10000E+01 volume  0.34801E-03 ppm1      7.921 ppm2      2.519 CV     1
 OR {  636}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 90   and name HG2 ))
 OR {  636}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 95   and name HB1 ))
 ASSI {  637}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 93   and name HA  ))
      4.300     2.300     1.700 peak   637 spectrum    1 weight  0.10000E+01 volume  0.60016E-03 ppm1      7.918 ppm2      4.278 CV     1
 OR {  637}
   (( segid "T22D" and resid 92   and name HN  ))
   (( segid "T22D" and resid 55   and name HA  ))
 ASSI {  640}
   (( segid "T22D" and resid 92   and name HN  ))
   (  segid "T22D" and resid 58   and name HD% )
      4.100     2.100     1.900 peak   640 spectrum    1 weight  0.10000E+01 volume  0.54574E-03 ppm1      7.915 ppm2      7.342 CV     1
 OR {  640}
   (( segid "T22D" and resid 92   and name HN  ))
   (  segid "T22D" and resid 55   and name HE% )
 ASSI {  650}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 90   and name HG2 ))
      3.200     1.300     1.300 peak   650 spectrum    1 weight  0.10000E+01 volume  0.24832E-02 ppm1      7.177 ppm2      2.542 CV     1
 OR {  650}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 95   and name HB1 ))
 ASSI {  651}
   (( segid "T22D" and resid 93   and name HN  ))
   (  segid "T22D" and resid 89   and name HB% )
      4.300     2.300     1.700 peak   651 spectrum    1 weight  0.10000E+01 volume  0.57798E-03 ppm1      7.179 ppm2      1.585 CV     1
 OR {  651}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 94   and name HG1 ))
 OR {  651}
   (( segid "T22D" and resid 93   and name HN  ))
   (( segid "T22D" and resid 94   and name HG2 ))
 ASSI {  692}
   (( segid "T22D" and resid 97   and name HD21))
   (( segid "T22D" and resid 104  and name HG2 ))
      3.500     1.500     1.500 peak   692 spectrum    1 weight  0.10000E+01 volume  0.82473E-03 ppm1      8.154 ppm2      1.291 CV     1
 OR {  692}
   (( segid "T22D" and resid 97   and name HD21))
   (  segid "T22D" and resid 105  and name HB% )
 ASSI {  716}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 100  and name HG11))
      3.100     1.200     1.200 peak   716 spectrum    1 weight  0.10000E+01 volume  0.17016E-02 ppm1      8.359 ppm2      0.739 CV     1
 OR {  716}
   (( segid "T22D" and resid 100  and name HN  ))
   (  segid "T22D" and resid 99   and name HD1%)
 ASSI {  719}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 99   and name HB  ))
      4.400     2.400     1.600 peak   719 spectrum    1 weight  0.10000E+01 volume  0.49741E-03 ppm1      8.358 ppm2      1.786 CV     1
 OR {  719}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 103  and name HG2 ))
 ASSI {  720}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 103  and name HB1 ))
      4.100     2.100     1.900 peak   720 spectrum    1 weight  0.10000E+01 volume  0.47368E-03 ppm1      8.359 ppm2      1.630 CV     1
 OR {  720}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 104  and name HB2 ))
 OR {  720}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 104  and name HB1 ))
 OR {  720}
   (( segid "T22D" and resid 100  and name HN  ))
   (( segid "T22D" and resid 104  and name HD1 ))
 ASSI {  777}
   (( segid "T22D" and resid 105  and name HN  ))
   (  segid "T22D" and resid 99   and name HD1%)
      4.600     2.600     1.400 peak   777 spectrum    1 weight  0.10000E+01 volume  0.52210E-03 ppm1      8.991 ppm2      0.680 CV     1
 OR {  777}
   (( segid "T22D" and resid 105  and name HN  ))
   (  segid "T22D" and resid 42   and name HD2%)
 ASSI {  781}
   (( segid "T22D" and resid 29   and name HN  ))
   (( segid "T22D" and resid 30   and name HG2 ))
      4.200     2.200     1.800 peak   781 spectrum    1 weight  0.10000E+01 volume  0.46793E-03 ppm1      8.211 ppm2      1.648 CV     1
 OR {  781}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 104  and name HD2 ))
 OR {  781}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 104  and name HD1 ))
 OR {  781}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 104  and name HB2 ))
 OR {  781}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 104  and name HB1 ))
 ASSI {  782}
   (( segid "T22D" and resid 106  and name HN  ))
   (( segid "T22D" and resid 39   and name HB  ))
      3.600     1.600     1.600 peak   782 spectrum    1 weight  0.10000E+01 volume  0.38934E-03 ppm1      8.213 ppm2      1.485 CV     1
 OR {  782}
   (( segid "T22D" and resid 106  and name HN  ))
   (( segid "T22D" and resid 103  and name HG1 ))
 OR {  782}
   (( segid "T22D" and resid 29   and name HN  ))
   (  segid "T22D" and resid 33   and name HE% )
 OR {  782}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 99   and name HG11))
 OR {  782}
   (( segid "T22D" and resid 29   and name HN  ))
   (( segid "T22D" and resid 36   and name HD1 ))
 OR {  782}
   (( segid "T22D" and resid 97   and name HN  ))
   (( segid "T22D" and resid 103  and name HG1 ))
 ASSI {  837}
   (( segid "T22D" and resid 109  and name HN  ))
   (  segid "T22D" and resid 112  and name HD1%)
      3.000     1.100     1.100 peak   837 spectrum    1 weight  0.10000E+01 volume  0.19985E-02 ppm1      9.361 ppm2      0.932 CV     1
 OR {  837}
   (( segid "T22D" and resid 109  and name HN  ))
   (  segid "T22D" and resid 109  and name HD2%)
 ASSI {  854}
   (( segid "T22D" and resid 111  and name HN  ))
   (  segid "T22D" and resid 114  and name HB% )
      4.000     2.000     2.000 peak   854 spectrum    1 weight  0.10000E+01 volume  0.94954E-03 ppm1      9.065 ppm2      1.298 CV     1
 OR {  854}
   (( segid "T22D" and resid 111  and name HN  ))
   (  segid "T22D" and resid 109  and name HD1%)
 OR {  854}
   (( segid "T22D" and resid 111  and name HN  ))
   (( segid "T22D" and resid 33   and name HG2 ))
 ASSI {  887}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 115  and name HB1 ))
      3.900     1.900     1.900 peak   887 spectrum    1 weight  0.10000E+01 volume  0.12977E-02 ppm1      8.337 ppm2      1.790 CV     1
 OR {  887}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 43   and name HG2 ))
 ASSI {  889}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 114  and name HN  ))
      4.400     2.500     1.600 peak   889 spectrum    1 weight  0.10000E+01 volume  0.72931E-03 ppm1      8.339 ppm2      7.040 CV     1
 OR {  889}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 113  and name HN  ))
 ASSI {  890}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 42   and name HA  ))
      3.700     3.700     2.300 peak   890 spectrum    1 weight  0.10000E+01 volume  0.11141E-02 ppm1      8.340 ppm2      4.345 CV     1
 OR {  890}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 118  and name HA  ))
 OR {  890}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 74   and name HA  ))
 ASSI {  891}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 75   and name HB2 ))
      4.100     2.100     1.900 peak   891 spectrum    1 weight  0.10000E+01 volume  0.85988E-03 ppm1      8.341 ppm2      4.188 CV     1
 OR {  891}
   (( segid "T22D" and resid 115  and name HN  ))
   (( segid "T22D" and resid 113  and name HA1 ))
 OR {  891}
   (( segid "T22D" and resid 44   and name HN  ))
   (( segid "T22D" and resid 75   and name HA  ))
 ASSI {  896}
   (( segid "T22D" and resid 117  and name HN  ))
   (( segid "T22D" and resid 117  and name HB2 ))
      3.200     1.300     1.300 peak   896 spectrum    1 weight  0.10000E+01 volume  0.13249E-02 ppm1      8.545 ppm2      1.855 CV     1
 OR {  896}
   (( segid "T22D" and resid 117  and name HN  ))
   (( segid "T22D" and resid 116  and name HB2 ))
 ASSI {   32}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 104  and name HG2 ))
      3.500     1.600     1.600 peak    32 spectrum    1 weight  0.10000E+01 volume  0.30722E-02 ppm1      0.712 ppm2      1.286 CV     1
 OR {   32}
   (  segid "T22D" and resid 99   and name HD1%)
   (  segid "T22D" and resid 105  and name HB% )
 OR {   32}
   (  segid "T22D" and resid 99   and name HD1%)
   (( segid "T22D" and resid 100  and name HB  ))
 ASSI {   77}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 81   and name HB  ))
      3.300     1.300     1.300 peak    77 spectrum    1 weight  0.10000E+01 volume  0.13127E-02 ppm1      0.710 ppm2      1.080 CV     1
 OR {   77}
   (  segid "T22D" and resid 37   and name HD1%)
   (  segid "T22D" and resid 107  and name HG1%)
 ASSI {   80}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 83   and name HB2 ))
      4.500     2.500     1.500 peak    80 spectrum    1 weight  0.10000E+01 volume  0.74929E-03 ppm1      0.705 ppm2      1.988 CV     1
 OR {   80}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 92   and name HA  ))
 ASSI {   81}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 35   and name HA  ))
      4.200     2.200     1.800 peak    81 spectrum    1 weight  0.10000E+01 volume  0.89558E-03 ppm1      0.718 ppm2      4.402 CV     1
 OR {   81}
   (  segid "T22D" and resid 37   and name HD1%)
   (( segid "T22D" and resid 39   and name HA  ))
 ASSI {  135}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 85   and name HB2 ))
      3.900     1.900     1.900 peak   135 spectrum    1 weight  0.10000E+01 volume  0.10572E-02 ppm1      1.923 ppm2      2.775 CV     1
 OR {  135}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 93   and name HB2 ))
 OR {  135}
   (  segid "T22D" and resid 83   and name HE% )
   (( segid "T22D" and resid 34   and name HB1 ))
 ASSI {  195}
   (  segid "T22D" and resid 37   and name HG2%)
   (  segid "T22D" and resid 92   and name HB% )
      3.200     1.300     1.300 peak   195 spectrum    1 weight  0.10000E+01 volume  0.21870E-02 ppm1      0.698 ppm2      1.420 CV     1
 OR {  195}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 39   and name HB  ))
 ASSI {  207}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 83   and name HG1 ))
      2.700     0.900     0.900 peak   207 spectrum    1 weight  0.10000E+01 volume  0.38508E-02 ppm1      1.597 ppm2      2.248 CV     1
 OR {  207}
   (  segid "T22D" and resid 89   and name HB% )
   (( segid "T22D" and resid 90   and name HB2 ))
 ASSI {  218}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 56   and name HB2 ))
      4.300     2.300     1.700 peak   218 spectrum    1 weight  0.10000E+01 volume  0.98023E-03 ppm1      0.604 ppm2      2.102 CV     1
 OR {  218}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 63   and name HB2 ))
 OR {  218}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 56   and name HB1 ))
 OR {  218}
   (  segid "T22D" and resid 61   and name HG2%)
   (( segid "T22D" and resid 62   and name HG2 ))
 ASSI {  224}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 93   and name HB2 ))
      3.800     1.800     1.800 peak   224 spectrum    1 weight  0.10000E+01 volume  0.14146E-02 ppm1      0.680 ppm2      2.795 CV     1
 OR {  224}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 38   and name HB2 ))
 OR {  224}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 108  and name HB2 ))
 OR {  224}
   (  segid "T22D" and resid 37   and name HG2%)
   (( segid "T22D" and resid 80   and name HB2 ))
 ASSI {  236}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "T22D" and resid 33   and name HA  ))
      2.500     2.500     3.500 peak   236 spectrum    1 weight  0.10000E+01 volume  0.16512E-02 ppm1      1.333 ppm2      3.749 CV     1
 OR {  236}
   (  segid "T22D" and resid 26   and name HB% )
   (( segid "T22D" and resid 33   and name HA  ))
 ASSI {  243}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "T22D" and resid 115  and name HB1 ))
      3.300     3.300     2.700 peak   243 spectrum    1 weight  0.10000E+01 volume  0.28708E-02 ppm1      1.279 ppm2      1.840 CV     1
 OR {  243}
   (  segid "T22D" and resid 114  and name HB% )
   (( segid "T22D" and resid 116  and name HB2 ))
 ASSI {  249}
   (  segid "T22D" and resid 92   and name HB% )
   (( segid "T22D" and resid 83   and name HG1 ))
      3.800     1.800     1.800 peak   249 spectrum    1 weight  0.10000E+01 volume  0.73770E-03 ppm1      1.434 ppm2      2.253 CV     1
 OR {  249}
   (  segid "T22D" and resid 92   and name HB% )
   (( segid "T22D" and resid 90   and name HB2 ))
 ASSI {  251}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 67   and name HA  ))
      3.600     1.600     1.600 peak   251 spectrum    1 weight  0.10000E+01 volume  0.14879E-02 ppm1      0.926 ppm2      4.099 CV     1
 OR {  251}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "T22D" and resid 48   and name HA  ))
 ASSI {  276}
   (  segid "T22D" and resid 65   and name HG2%)
   (( segid "3T5T" and resid 6    and name H1' ))
      3.400     1.400     1.400 peak   276 spectrum    1 weight  0.10000E+01 volume  0.13687E-02 ppm1      0.942 ppm2      6.369 CV     1
 OR {  276}
   (  segid "T22D" and resid 65   and name HG2%)
   (  segid "T22D" and resid 78   and name HD% )
 ASSI {  304}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 104  and name HA  ))
      3.500     1.500     1.500 peak   304 spectrum    1 weight  0.10000E+01 volume  0.20526E-02 ppm1      1.324 ppm2      4.142 CV     1
 OR {  304}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 51   and name HA  ))
 OR {  304}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 61   and name HA  ))
 ASSI {  305}
   (  segid "T22D" and resid 105  and name HB% )
   (( segid "T22D" and resid 41   and name HA1 ))
      3.700     1.700     1.700 peak   305 spectrum    1 weight  0.10000E+01 volume  0.86042E-03 ppm1      1.330 ppm2      4.056 CV     1
 OR {  305}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 48   and name HA  ))
 ASSI {  308}
   (  segid "T22D" and resid 82   and name HG2%)
   (( segid "T22D" and resid 32   and name HA  ))
      2.800     0.900     0.900 peak   308 spectrum    1 weight  0.10000E+01 volume  0.36419E-02 ppm1      1.159 ppm2      4.641 CV     1
 OR {  308}
   (  segid "T22D" and resid 72   and name HG2%)
   (( segid "T22D" and resid 69   and name HA  ))
 ASSI {  315}
   (  segid "T22D" and resid 32   and name HG2%)
   (( segid "T22D" and resid 31   and name HB2 ))
      3.600     1.700     1.700 peak   315 spectrum    1 weight  0.10000E+01 volume  0.78390E-03 ppm1      1.089 ppm2      2.816 CV     1
 OR {  315}
   (  segid "T22D" and resid 32   and name HG2%)
   (( segid "T22D" and resid 36   and name HE1 ))
 ASSI {  317}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 48   and name HB2 ))
      4.100     2.100     1.900 peak   317 spectrum    1 weight  0.10000E+01 volume  0.64441E-03 ppm1      1.327 ppm2      2.744 CV     1
 OR {  317}
   (  segid "T22D" and resid 64   and name HB% )
   (( segid "T22D" and resid 80   and name HB2 ))
 ASSI {  318}
   (  segid "T22D" and resid 81   and name HG2%)
   (  segid "T22D" and resid 39   and name HG1%)
      2.800     1.000     1.000 peak   318 spectrum    1 weight  0.10000E+01 volume  0.36916E-02 ppm1      0.270 ppm2      0.684 CV     1
 OR {  318}
   (  segid "T22D" and resid 81   and name HG2%)
   (  segid "T22D" and resid 37   and name HD1%)
 ASSI {  331}
   (  segid "T22D" and resid 81   and name HG2%)
   (( segid "T22D" and resid 39   and name HB  ))
      2.500     2.500     3.500 peak   331 spectrum    1 weight  0.10000E+01 volume  0.38789E-02 ppm1      0.273 ppm2      1.463 CV     1
 OR {  331}
   (  segid "T22D" and resid 81   and name HG2%)
   (( segid "T22D" and resid 51   and name HG  ))
 OR {  331}
   (  segid "T22D" and resid 81   and name HG2%)
   (  segid "T22D" and resid 92   and name HB% )
 ASSI {  340}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 73   and name HB2 ))
      3.100     1.200     1.200 peak   340 spectrum    1 weight  0.10000E+01 volume  0.32252E-02 ppm1      0.928 ppm2      2.338 CV     1
 OR {  340}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 73   and name HB1 ))
 OR {  340}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 73   and name HG2 ))
 OR {  340}
   (  segid "T22D" and resid 120  and name HG1%)
   (( segid "T22D" and resid 121  and name HG1 ))
 OR {  340}
   (  segid "T22D" and resid 120  and name HG1%)
   (( segid "T22D" and resid 121  and name HG2 ))
 OR {  340}
   (  segid "T22D" and resid 68   and name HG2%)
   (( segid "T22D" and resid 76   and name HB2 ))
 ASSI {  344}
   (  segid "T22D" and resid 120  and name HG1%)
   (( segid "3T5T" and resid 6    and name H2' ))
      2.800     2.800     3.200 peak   344 spectrum    1 weight  0.10000E+01 volume  0.85946E-03 ppm1      0.922 ppm2      2.603 CV     1
 OR {  344}
   (  segid "T22D" and resid 120  and name HG1%)
   (( segid "T22D" and resid 27   and name HG1 ))
 ASSI {  362}
   (  segid "T22D" and resid 72   and name HG2%)
   (( segid "T22D" and resid 73   and name HG1 ))
      3.700     1.700     1.700 peak   362 spectrum    1 weight  0.10000E+01 volume  0.10819E-02 ppm1      1.189 ppm2      2.304 CV     1
 OR {  362}
   (  segid "T22D" and resid 118  and name HG2%)
   (( segid "T22D" and resid 116  and name HB1 ))
 OR {  362}
   (  segid "T22D" and resid 72   and name HG2%)
   (( segid "T22D" and resid 73   and name HG2 ))
 ASSI {  387}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HD1 ))
      3.900     1.900     1.900 peak   387 spectrum    1 weight  0.10000E+01 volume  0.96230E-03 ppm1      0.799 ppm2      3.010 CV     1
 OR {  387}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 85   and name HB1 ))
 OR {  387}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HD2 ))
 ASSI {  396}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 86   and name HD1 ))
      4.100     2.100     1.900 peak   396 spectrum    1 weight  0.10000E+01 volume  0.72414E-03 ppm1      0.797 ppm2      2.954 CV     1
 OR {  396}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 85   and name HB1 ))
 OR {  396}
   (  segid "T22D" and resid 35   and name HG2%)
   (( segid "T22D" and resid 111  and name HB1 ))
 ASSI {  402}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 43   and name HG2 ))
      3.300     1.400     1.400 peak   402 spectrum    1 weight  0.10000E+01 volume  0.19369E-02 ppm1      1.260 ppm2      1.811 CV     1
 OR {  402}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 49   and name HB1 ))
 ASSI {  403}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 103  and name HB2 ))
      2.900     2.900     3.100 peak   403 spectrum    1 weight  0.10000E+01 volume  0.50721E-02 ppm1      1.274 ppm2      1.551 CV     1
 OR {  403}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 98   and name HB2 ))
 OR {  403}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 57   and name HB2 ))
 OR {  403}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 57   and name HB1 ))
 ASSI {  405}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 43   and name HA  ))
      3.800     1.800     1.800 peak   405 spectrum    1 weight  0.10000E+01 volume  0.12879E-02 ppm1      0.635 ppm2      4.606 CV     1
 OR {  405}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 103  and name HA  ))
 OR {  405}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 38   and name HA  ))
 OR {  405}
   (  segid "T22D" and resid 66   and name HG2%)
   (( segid "T22D" and resid 76   and name HA  ))
 OR {  405}
   (  segid "T22D" and resid 66   and name HG2%)
   (( segid "T22D" and resid 38   and name HA  ))
 OR {  405}
   (  segid "T22D" and resid 66   and name HG2%)
   (( segid "3T5T" and resid 6    and name H4' ))
 ASSI {  408}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 53   and name HB1 ))
      3.500     3.500     2.500 peak   408 spectrum    1 weight  0.10000E+01 volume  0.20263E-02 ppm1      1.276 ppm2      2.122 CV     1
 OR {  408}
   (  segid "T22D" and resid 50   and name HG2%)
   (( segid "T22D" and resid 98   and name HB1 ))
 ASSI {  424}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 51   and name HA  ))
      3.800     1.800     1.800 peak   424 spectrum    1 weight  0.10000E+01 volume  0.17540E-02 ppm1      1.141 ppm2      4.136 CV     1
 OR {  424}
   (  segid "T22D" and resid 46   and name HG2%)
   (( segid "T22D" and resid 50   and name HA  ))
 ASSI {  432}
   (  segid "T22D" and resid 46   and name HG2%)
   (  segid "T22D" and resid 66   and name HG2%)
      2.500     0.800     0.800 peak   432 spectrum    1 weight  0.10000E+01 volume  0.73986E-02 ppm1      1.138 ppm2      0.594 CV     1
 OR {  432}
   (  segid "T22D" and resid 46   and name HG2%)
   (  segid "T22D" and resid 51   and name HD1%)
 ASSI {  436}
   (  segid "T22D" and resid 46   and name HG2%)
   (  segid "T22D" and resid 100  and name HG2%)
      2.400     0.700     0.700 peak   436 spectrum    1 weight  0.10000E+01 volume  0.78582E-02 ppm1      1.140 ppm2      0.446 CV     1
 OR {  436}
   (  segid "T22D" and resid 46   and name HG2%)
   (  segid "T22D" and resid 42   and name HD1%)
 ASSI {  439}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 42   and name HG  ))
      2.300     0.600     0.600 peak   439 spectrum    1 weight  0.10000E+01 volume  0.70258E-02 ppm1      0.662 ppm2      1.308 CV     1
 OR {  439}
   (  segid "T22D" and resid 42   and name HD2%)
   (  segid "T22D" and resid 105  and name HB% )
 OR {  439}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 100  and name HB  ))
 OR {  439}
   (  segid "T22D" and resid 112  and name HD2%)
   (  segid "T22D" and resid 109  and name HD1%)
 ASSI {  443}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 43   and name HG1 ))
      4.300     2.300     1.700 peak   443 spectrum    1 weight  0.10000E+01 volume  0.96438E-03 ppm1      0.658 ppm2      2.226 CV     1
 OR {  443}
   (  segid "T22D" and resid 42   and name HD2%)
   (( segid "T22D" and resid 101  and name HB1 ))
 ASSI {  457}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 90   and name HG1 ))
      2.900     2.900     3.100 peak   457 spectrum    1 weight  0.10000E+01 volume  0.82110E-03 ppm1      0.883 ppm2      2.274 CV     1
 OR {  457}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 83   and name HG1 ))
 OR {  457}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 36   and name HE2 ))
 ASSI {  458}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 90   and name HG2 ))
      2.700     2.700     3.300 peak   458 spectrum    1 weight  0.10000E+01 volume  0.94970E-03 ppm1      0.880 ppm2      2.556 CV     1
 OR {  458}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 83   and name HG2 ))
 ASSI {  460}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 93   and name HB2 ))
      3.500     1.600     1.600 peak   460 spectrum    1 weight  0.10000E+01 volume  0.81793E-03 ppm1      0.885 ppm2      2.784 CV     1
 OR {  460}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 34   and name HB1 ))
 OR {  460}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 108  and name HB2 ))
 ASSI {  471}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 93   and name HB1 ))
      4.100     2.100     1.900 peak   471 spectrum    1 weight  0.10000E+01 volume  0.69533E-03 ppm1      0.901 ppm2      3.049 CV     1
 OR {  471}
   (  segid "T22D" and resid 109  and name HD2%)
   (( segid "T22D" and resid 108  and name HB1 ))
 ASSI {  498}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 46   and name HB  ))
      3.700     1.800     1.800 peak   498 spectrum    1 weight  0.10000E+01 volume  0.13361E-02 ppm1      0.932 ppm2      3.755 CV     1
 OR {  498}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 66   and name HA  ))
 OR {  498}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 79   and name HA1 ))
 OR {  498}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 52   and name HA  ))
 OR {  498}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 43   and name HD1 ))
 ASSI {  500}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 54   and name HB2 ))
      4.200     2.200     1.800 peak   500 spectrum    1 weight  0.10000E+01 volume  0.63490E-03 ppm1      0.927 ppm2      3.230 CV     1
 OR {  500}
   (  segid "T22D" and resid 51   and name HD2%)
   (( segid "T22D" and resid 55   and name HB2 ))
 ASSI {  506}
   (( segid "T22D" and resid 74   and name HG1 ))
   (( segid "T22D" and resid 72   and name HB  ))
      2.200     0.600     0.600 peak   506 spectrum    1 weight  0.10000E+01 volume  0.93140E-02 ppm1      1.382 ppm2      4.363 CV     1
 OR {  506}
   (( segid "T22D" and resid 74   and name HG2 ))
   (( segid "T22D" and resid 72   and name HB  ))
 OR {  506}
   (( segid "T22D" and resid 74   and name HG1 ))
   (( segid "T22D" and resid 74   and name HA  ))
 OR {  506}
   (( segid "T22D" and resid 74   and name HG2 ))
   (( segid "T22D" and resid 74   and name HA  ))
 OR {  506}
   (( segid "T22D" and resid 74   and name HG2 ))
   (( segid "T22D" and resid 72   and name HA  ))
 ASSI {  521}
   (( segid "T22D" and resid 36   and name HG1 ))
   (( segid "T22D" and resid 36   and name HD2 ))
      2.800     1.000     1.000 peak   521 spectrum    1 weight  0.10000E+01 volume  0.22288E-02 ppm1      0.970 ppm2      1.644 CV     1
 OR {  521}
   (( segid "T22D" and resid 36   and name HG1 ))
   (  segid "T22D" and resid 110  and name HB% )
 ASSI {  534}
   (( segid "T22D" and resid 84   and name HG1 ))
   (( segid "T22D" and resid 62   and name HA  ))
      3.400     1.400     1.400 peak   534 spectrum    1 weight  0.10000E+01 volume  0.22986E-02 ppm1      1.368 ppm2      4.388 CV     1
 OR {  534}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 62   and name HA  ))
 OR {  534}
   (( segid "T22D" and resid 36   and name HG2 ))
   (( segid "T22D" and resid 35   and name HA  ))
 ASSI {  547}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 42   and name HG  ))
      2.800     1.000     1.000 peak   547 spectrum    1 weight  0.10000E+01 volume  0.15308E-02 ppm1      0.447 ppm2      1.313 CV     1
 OR {  547}
   (  segid "T22D" and resid 42   and name HD1%)
   (  segid "T22D" and resid 105  and name HB% )
 OR {  547}
   (  segid "T22D" and resid 42   and name HD1%)
   (( segid "T22D" and resid 51   and name HB2 ))
 ASSI {  548}
   (  segid "T22D" and resid 42   and name HD1%)
   (  segid "T22D" and resid 51   and name HD1%)
      2.400     0.700     0.700 peak   548 spectrum    1 weight  0.10000E+01 volume  0.58899E-02 ppm1      0.442 ppm2      0.591 CV     1
 OR {  548}
   (  segid "T22D" and resid 42   and name HD1%)
   (  segid "T22D" and resid 39   and name HG2%)
 ASSI {  592}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 34   and name HB1 ))
      3.600     1.600     1.600 peak   592 spectrum    1 weight  0.10000E+01 volume  0.95946E-03 ppm1      1.342 ppm2      2.793 CV     1
 OR {  592}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 93   and name HB2 ))
 OR {  592}
   (( segid "T22D" and resid 84   and name HG2 ))
   (( segid "T22D" and resid 85   and name HB2 ))
 OR {  592}
   (  segid "T22D" and resid 109  and name HD1%)
   (( segid "T22D" and resid 108  and name HB2 ))
 ASSI {  606}
   (( segid "T22D" and resid 98   and name HG2 ))
   (  segid "T22D" and resid 105  and name HB% )
      3.300     1.400     1.400 peak   606 spectrum    1 weight  0.10000E+01 volume  0.86847E-03 ppm1      1.975 ppm2      1.314 CV     1
 OR {  606}
   (( segid "T22D" and resid 98   and name HG1 ))
   (  segid "T22D" and resid 105  and name HB% )
 OR {  606}
   (( segid "T22D" and resid 98   and name HG2 ))
   (( segid "T22D" and resid 100  and name HB  ))
 ASSI {  612}
   (( segid "T22D" and resid 86   and name HG2 ))
   (( segid "T22D" and resid 90   and name HG2 ))
      4.200     2.200     1.800 peak   612 spectrum    1 weight  0.10000E+01 volume  0.73223E-03 ppm1      1.812 ppm2      2.552 CV     1
 OR {  612}
   (( segid "T22D" and resid 86   and name HG2 ))
   (( segid "T22D" and resid 83   and name HB1 ))
 OR {  612}
   (( segid "T22D" and resid 86   and name HG2 ))
   (( segid "T22D" and resid 83   and name HG2 ))
 ASSI {  613}
   (( segid "T22D" and resid 86   and name HG1 ))
   (( segid "T22D" and resid 90   and name HG2 ))
      4.300     2.300     1.700 peak   613 spectrum    1 weight  0.10000E+01 volume  0.68186E-03 ppm1      1.649 ppm2      2.559 CV     1
 OR {  613}
   (( segid "T22D" and resid 86   and name HG1 ))
   (( segid "T22D" and resid 83   and name HB1 ))
 OR {  613}
   (( segid "T22D" and resid 86   and name HG1 ))
   (( segid "T22D" and resid 83   and name HG2 ))
 ASSI {  649}
   (( segid "T22D" and resid 109  and name HG  ))
   (( segid "T22D" and resid 109  and name HB1 ))
      3.100     1.200     1.200 peak   649 spectrum    1 weight  0.10000E+01 volume  0.18246E-02 ppm1      2.075 ppm2      1.800 CV     1
 OR {  649}
   (( segid "T22D" and resid 116  and name HG2 ))
   (( segid "T22D" and resid 115  and name HB1 ))
 ASSI {  660}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 104  and name HB2 ))
      4.100     2.100     1.900 peak   660 spectrum    1 weight  0.10000E+01 volume  0.83382E-03 ppm1      1.149 ppm2      1.600 CV     1
 OR {  660}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 98   and name HB2 ))
 OR {  660}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 104  and name HD2 ))
 OR {  660}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 104  and name HD1 ))
 ASSI {  661}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 104  and name HG2 ))
      3.700     1.700     1.700 peak   661 spectrum    1 weight  0.10000E+01 volume  0.13045E-02 ppm1      1.150 ppm2      1.332 CV     1
 OR {  661}
   (( segid "T22D" and resid 67   and name HG12))
   (( segid "T22D" and resid 76   and name HB1 ))
 OR {  661}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 104  and name HG1 ))
 OR {  661}
   (( segid "T22D" and resid 99   and name HG12))
   (  segid "T22D" and resid 105  and name HB% )
 OR {  661}
   (( segid "T22D" and resid 99   and name HG12))
   (( segid "T22D" and resid 100  and name HB  ))
 ASSI {  742}
   (( segid "T22D" and resid 37   and name HG11))
   (( segid "T22D" and resid 89   and name HA  ))
      3.300     1.400     1.400 peak   742 spectrum    1 weight  0.10000E+01 volume  0.35326E-02 ppm1      1.710 ppm2      4.095 CV     1
 OR {  742}
   (( segid "T22D" and resid 84   and name HD2 ))
   (( segid "T22D" and resid 84   and name HA  ))
 OR {  742}
   (( segid "T22D" and resid 84   and name HD1 ))
   (( segid "T22D" and resid 84   and name HA  ))
 OR {  742}
   (( segid "T22D" and resid 37   and name HG11))
   (( segid "T22D" and resid 90   and name HA  ))
 ASSI {  745}
   (( segid "T22D" and resid 84   and name HD2 ))
   (  segid "T22D" and resid 61   and name HG2%)
      2.700     2.700     3.300 peak   745 spectrum    1 weight  0.10000E+01 volume  0.11955E-02 ppm1      1.713 ppm2      0.588 CV     1
 OR {  745}
   (( segid "T22D" and resid 84   and name HD1 ))
   (  segid "T22D" and resid 61   and name HG2%)
 OR {  745}
   (( segid "T22D" and resid 49   and name HD2 ))
   (  segid "T22D" and resid 66   and name HG2%)
 OR {  745}
   (( segid "T22D" and resid 49   and name HD2 ))
   (  segid "T22D" and resid 51   and name HD1%)
 OR {  745}
   (( segid "T22D" and resid 49   and name HD2 ))
   (  segid "T22D" and resid 61   and name HG2%)
 OR {  745}
   (( segid "T22D" and resid 91   and name HG1 ))
   (  segid "T22D" and resid 39   and name HG2%)
 OR {  745}
   (( segid "T22D" and resid 94   and name HD1 ))
   (  segid "T22D" and resid 39   and name HG2%)
 ASSI {  790}
   (( segid "T22D" and resid 86   and name HB2 ))
   (( segid "T22D" and resid 86   and name HG1 ))
      1.800     0.400     0.400 peak   790 spectrum    1 weight  0.10000E+01 volume  0.32412E-01 ppm1      1.853 ppm2      1.695 CV     1
 OR {  790}
   (( segid "T22D" and resid 70   and name HB2 ))
   (( segid "T22D" and resid 70   and name HG1 ))
 OR {  790}
   (( segid "T22D" and resid 70   and name HB1 ))
   (( segid "T22D" and resid 70   and name HG2 ))
 OR {  790}
   (( segid "T22D" and resid 70   and name HB1 ))
   (( segid "T22D" and resid 70   and name HG1 ))
 OR {  790}
   (( segid "T22D" and resid 70   and name HB2 ))
   (( segid "T22D" and resid 70   and name HG2 ))
 OR {  790}
   (( segid "T22D" and resid 86   and name HB1 ))
   (( segid "T22D" and resid 86   and name HG1 ))
 ASSI {  813}
   (( segid "T22D" and resid 62   and name HB2 ))
   (( segid "T22D" and resid 83   and name HB1 ))
      4.000     2.000     2.000 peak   813 spectrum    1 weight  0.10000E+01 volume  0.73027E-03 ppm1      1.830 ppm2      2.565 CV     1
 OR {  813}
   (( segid "T22D" and resid 62   and name HB2 ))
   (( segid "T22D" and resid 60   and name HB1 ))
 OR {  813}
   (( segid "T22D" and resid 62   and name HB2 ))
   (( segid "T22D" and resid 60   and name HB2 ))
 OR {  813}
   (( segid "T22D" and resid 62   and name HB2 ))
   (( segid "T22D" and resid 83   and name HG2 ))
 ASSI {  814}
   (( segid "T22D" and resid 62   and name HB2 ))
   (  segid "T22D" and resid 81   and name HG1%)
      4.600     2.700     1.400 peak   814 spectrum    1 weight  0.10000E+01 volume  0.40921E-03 ppm1      1.823 ppm2      0.511 CV     1
 OR {  814}
   (( segid "T22D" and resid 62   and name HB2 ))
   (( segid "T22D" and resid 37   and name HG12))
 ASSI {  818}
   (( segid "T22D" and resid 62   and name HB1 ))
   (( segid "T22D" and resid 84   and name HA  ))
      4.100     2.100     1.900 peak   818 spectrum    1 weight  0.10000E+01 volume  0.16634E-02 ppm1      1.703 ppm2      4.097 CV     1
 OR {  818}
   (( segid "T22D" and resid 62   and name HB1 ))
   (( segid "T22D" and resid 61   and name HA  ))
 ASSI {  890}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 83   and name HB2 ))
      2.500     0.800     0.800 peak   890 spectrum    1 weight  0.10000E+01 volume  0.24579E-02 ppm1      2.563 ppm2      2.056 CV     1
 OR {  890}
   (( segid "T22D" and resid 27   and name HG1 ))
   (( segid "T22D" and resid 27   and name HB2 ))
 OR {  890}
   (( segid "T22D" and resid 27   and name HG2 ))
   (( segid "T22D" and resid 27   and name HB2 ))
 OR {  890}
   (( segid "T22D" and resid 27   and name HG2 ))
   (  segid "T22D" and resid 27   and name HE% )
 OR {  890}
   (( segid "T22D" and resid 27   and name HG1 ))
   (  segid "T22D" and resid 27   and name HE% )
 ASSI {  902}
   (( segid "T22D" and resid 39   and name HB  ))
   (( segid "T22D" and resid 39   and name HA  ))
      3.400     1.400     1.400 peak   902 spectrum    1 weight  0.10000E+01 volume  0.79658E-03 ppm1      1.446 ppm2      4.369 CV     1
 OR {  902}
   (( segid "T22D" and resid 39   and name HB  ))
   (( segid "T22D" and resid 42   and name HA  ))
 ASSI {  907}
   (( segid "T22D" and resid 83   and name HG2 ))
   (  segid "T22D" and resid 81   and name HG1%)
      3.400     1.500     1.500 peak   907 spectrum    1 weight  0.10000E+01 volume  0.72856E-03 ppm1      2.567 ppm2      0.528 CV     1
 OR {  907}
   (( segid "T22D" and resid 83   and name HG2 ))
   (( segid "T22D" and resid 37   and name HG12))
 OR {  907}
   (( segid "T22D" and resid 83   and name HB1 ))
   (  segid "T22D" and resid 81   and name HG1%)
 ASSI {  910}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 88   and name HB2 ))
      3.000     1.200     1.200 peak   910 spectrum    1 weight  0.10000E+01 volume  0.20149E-02 ppm1      2.557 ppm2      4.106 CV     1
 OR {  910}
   (( segid "T22D" and resid 83   and name HG2 ))
   (( segid "T22D" and resid 89   and name HA  ))
 OR {  910}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 61   and name HA  ))
 OR {  910}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 89   and name HA  ))
 OR {  910}
   (( segid "T22D" and resid 83   and name HG2 ))
   (( segid "T22D" and resid 88   and name HB2 ))
 ASSI {  929}
   (( segid "T22D" and resid 83   and name HG1 ))
   (( segid "T22D" and resid 89   and name HA  ))
      2.400     0.700     0.700 peak   929 spectrum    1 weight  0.10000E+01 volume  0.14253E-02 ppm1      2.251 ppm2      4.105 CV     1
 OR {  929}
   (( segid "T22D" and resid 83   and name HG1 ))
   (( segid "T22D" and resid 88   and name HB2 ))
 ASSI {  933}
   (( segid "T22D" and resid 49   and name HB1 ))
   (( segid "T22D" and resid 49   and name HE2 ))
      3.100     1.200     1.200 peak   933 spectrum    1 weight  0.10000E+01 volume  0.25050E-02 ppm1      1.813 ppm2      2.998 CV     1
 OR {  933}
   (( segid "T22D" and resid 49   and name HB1 ))
   (( segid "T22D" and resid 49   and name HE1 ))
 OR {  933}
   (( segid "T22D" and resid 115  and name HB1 ))
   (( segid "T22D" and resid 115  and name HE2 ))
 OR {  933}
   (( segid "T22D" and resid 115  and name HB1 ))
   (( segid "T22D" and resid 115  and name HE1 ))
 OR {  933}
   (( segid "T22D" and resid 94   and name HB1 ))
   (( segid "T22D" and resid 94   and name HE2 ))
 OR {  933}
   (( segid "T22D" and resid 94   and name HB1 ))
   (( segid "T22D" and resid 94   and name HE1 ))
 ASSI {  941}
   (( segid "T22D" and resid 83   and name HG2 ))
   (( segid "T22D" and resid 89   and name HA  ))
      3.700     1.700     1.700 peak   941 spectrum    1 weight  0.10000E+01 volume  0.12688E-02 ppm1      2.520 ppm2      4.112 CV     1
 OR {  941}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 61   and name HA  ))
 OR {  941}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 89   and name HA  ))
 OR {  941}
   (( segid "T22D" and resid 83   and name HG2 ))
   (( segid "T22D" and resid 61   and name HA  ))
 ASSI {  942}
   (( segid "T22D" and resid 83   and name HG2 ))
   (  segid "T22D" and resid 92   and name HB% )
      4.100     2.100     1.900 peak   942 spectrum    1 weight  0.10000E+01 volume  0.59612E-03 ppm1      2.568 ppm2      1.415 CV     1
 OR {  942}
   (( segid "T22D" and resid 27   and name HG1 ))
   (  segid "T22D" and resid 26   and name HB% )
 OR {  942}
   (( segid "T22D" and resid 83   and name HB1 ))
   (  segid "T22D" and resid 92   and name HB% )
 OR {  942}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 84   and name HG2 ))
 OR {  942}
   (( segid "T22D" and resid 83   and name HB1 ))
   (( segid "T22D" and resid 84   and name HG1 ))
 ASSI {  943}
   (( segid "T22D" and resid 83   and name HG1 ))
   (  segid "T22D" and resid 92   and name HB% )
      4.000     2.000     2.000 peak   943 spectrum    1 weight  0.10000E+01 volume  0.55675E-03 ppm1      2.261 ppm2      1.423 CV     1
 OR {  943}
   (( segid "T22D" and resid 116  and name HB1 ))
   (( segid "T22D" and resid 115  and name HG1 ))
 ASSI {  945}
   (( segid "T22D" and resid 116  and name HB1 ))
   (( segid "T22D" and resid 116  and name HG1 ))
      2.400     0.800     0.800 peak   945 spectrum    1 weight  0.10000E+01 volume  0.46685E-02 ppm1      2.278 ppm2      2.000 CV     1
 OR {  945}
   (( segid "T22D" and resid 83   and name HG1 ))
   (( segid "T22D" and resid 83   and name HB2 ))
 OR {  945}
   (( segid "T22D" and resid 116  and name HB1 ))
   (( segid "T22D" and resid 116  and name HG2 ))
 ASSI {  959}
   (( segid "T22D" and resid 120  and name HB  ))
   (( segid "T22D" and resid 120  and name HA  ))
      3.000     1.100     1.100 peak   959 spectrum    1 weight  0.10000E+01 volume  0.28792E-02 ppm1      2.104 ppm2      4.120 CV     1
 OR {  959}
   (( segid "T22D" and resid 120  and name HB  ))
   (( segid "T22D" and resid 121  and name HA  ))
 ASSI {  966}
   (( segid "T22D" and resid 84   and name HB2 ))
   (( segid "T22D" and resid 84   and name HA  ))
      2.700     0.900     0.900 peak   966 spectrum    1 weight  0.10000E+01 volume  0.28965E-02 ppm1      1.864 ppm2      4.065 CV     1
 OR {  966}
   (( segid "T22D" and resid 66   and name HB  ))
   (( segid "T22D" and resid 48   and name HA  ))
 OR {  966}
   (( segid "T22D" and resid 66   and name HB  ))
   (( segid "T22D" and resid 67   and name HA  ))
 OR {  966}
   (( segid "T22D" and resid 49   and name HB2 ))
   (( segid "T22D" and resid 48   and name HA  ))
 ASSI {  969}
   (( segid "T22D" and resid 84   and name HB2 ))
   (( segid "T22D" and resid 84   and name HA  ))
      2.300     0.700     0.700 peak   969 spectrum    1 weight  0.10000E+01 volume  0.71714E-02 ppm1      1.902 ppm2      4.094 CV     1
 OR {  969}
   (( segid "T22D" and resid 84   and name HB2 ))
   (( segid "T22D" and resid 61   and name HA  ))
 OR {  969}
   (( segid "T22D" and resid 66   and name HB  ))
   (( segid "T22D" and resid 48   and name HA  ))
 ASSI {  973}
   (( segid "T22D" and resid 84   and name HB1 ))
   (( segid "T22D" and resid 84   and name HA  ))
      2.600     0.800     0.800 peak   973 spectrum    1 weight  0.10000E+01 volume  0.65742E-02 ppm1      1.727 ppm2      4.096 CV     1
 OR {  973}
   (( segid "T22D" and resid 84   and name HB1 ))
   (( segid "T22D" and resid 61   and name HA  ))
 ASSI {  979}
   (( segid "T22D" and resid 84   and name HB1 ))
   (( segid "T22D" and resid 84   and name HG2 ))
      2.200     0.600     0.600 peak   979 spectrum    1 weight  0.10000E+01 volume  0.69937E-02 ppm1      1.770 ppm2      1.378 CV     1
 OR {  979}
   (( segid "T22D" and resid 74   and name HB2 ))
   (( segid "T22D" and resid 74   and name HG2 ))
 OR {  979}
   (( segid "T22D" and resid 74   and name HB2 ))
   (( segid "T22D" and resid 74   and name HG1 ))
 OR {  979}
   (( segid "T22D" and resid 84   and name HB1 ))
   (( segid "T22D" and resid 84   and name HG1 ))
 ASSI { 1015}
   (( segid "T22D" and resid 73   and name HG1 ))
   (( segid "T22D" and resid 72   and name HA  ))
      2.800     1.000     1.000 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.20861E-02 ppm1      2.290 ppm2      4.399 CV     1
 OR { 1015}
   (( segid "T22D" and resid 73   and name HG1 ))
   (( segid "T22D" and resid 74   and name HA  ))
 ASSI { 1030}
   (( segid "T22D" and resid 103  and name HB2 ))
   (( segid "T22D" and resid 43   and name HG1 ))
      3.500     1.600     1.600 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.53619E-03 ppm1      1.514 ppm2      2.234 CV     1
 OR { 1030}
   (( segid "T22D" and resid 103  and name HB2 ))
   (( segid "T22D" and resid 101  and name HB1 ))
 ASSI { 1042}
   (( segid "T22D" and resid 81   and name HB  ))
   (( segid "T22D" and resid 82   and name HA  ))
      4.100     2.100     1.900 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.71593E-03 ppm1      1.093 ppm2      5.252 CV     1
 OR { 1042}
   (( segid "T22D" and resid 81   and name HB  ))
   (( segid "T22D" and resid 64   and name HA  ))
 ASSI { 1092}
   (( segid "T22D" and resid 44   and name HB1 ))
   (( segid "T22D" and resid 75   and name HB1 ))
      4.100     2.100     1.900 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.43866E-03 ppm1      3.261 ppm2      4.009 CV     1
 OR { 1092}
   (( segid "T22D" and resid 111  and name HB2 ))
   (( segid "T22D" and resid 114  and name HA  ))
 ASSI { 1258}
   (( segid "T22D" and resid 61   and name HB  ))
   (( segid "T22D" and resid 56   and name HA  ))
      4.200     2.200     1.800 peak  1258 spectrum    1 weight  0.10000E+01 volume  0.51764E-03 ppm1      1.484 ppm2      4.402 CV     1
 OR { 1258}
   (( segid "T22D" and resid 61   and name HB  ))
   (( segid "T22D" and resid 62   and name HA  ))
 ASSI { 1345}
   (( segid "T22D" and resid 109  and name HB2 ))
   (  segid "T22D" and resid 112  and name HD1%)
      2.700     0.900     0.900 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.31837E-02 ppm1      1.916 ppm2      0.941 CV     1
 OR { 1345}
   (( segid "T22D" and resid 109  and name HB2 ))
   (  segid "T22D" and resid 109  and name HD2%)
 ASSI { 1351}
   (( segid "T22D" and resid 94   and name HE1 ))
   (( segid "T22D" and resid 90   and name HG1 ))
      3.000     3.000     3.000 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.15949E-02 ppm1      3.020 ppm2      2.245 CV     1
 OR { 1351}
   (( segid "T22D" and resid 94   and name HE2 ))
   (( segid "T22D" and resid 90   and name HG1 ))
 OR { 1351}
   (( segid "T22D" and resid 49   and name HE2 ))
   (( segid "T22D" and resid 53   and name HB2 ))
 OR { 1351}
   (( segid "T22D" and resid 49   and name HE1 ))
   (( segid "T22D" and resid 53   and name HB2 ))
 OR { 1351}
   (( segid "T22D" and resid 115  and name HE2 ))
   (( segid "3T5T" and resid 4    and name H2''))
 OR { 1351}
   (( segid "T22D" and resid 115  and name HE1 ))
   (( segid "3T5T" and resid 4    and name H2''))
 OR { 1351}
   (( segid "T22D" and resid 108  and name HB1 ))
   (( segid "T22D" and resid 90   and name HG1 ))
 OR { 1351}
   (( segid "T22D" and resid 108  and name HB1 ))
   (( segid "3T5T" and resid 4    and name H2''))
 OR { 1351}
   (( segid "T22D" and resid 108  and name HB1 ))
   (( segid "T22D" and resid 90   and name HB2 ))
 OR { 1351}
   (( segid "T22D" and resid 115  and name HE2 ))
   (( segid "T22D" and resid 36   and name HE2 ))
 OR { 1351}
   (( segid "T22D" and resid 115  and name HE1 ))
   (( segid "T22D" and resid 36   and name HE2 ))
 ASSI { 1358}
   (( segid "T22D" and resid 51   and name HB2 ))
   (  segid "T22D" and resid 42   and name HD1%)
      4.400     2.500     1.600 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.10591E-02 ppm1      1.299 ppm2      0.447 CV     1
 OR { 1358}
   (( segid "T22D" and resid 51   and name HB2 ))
   (  segid "T22D" and resid 100  and name HG2%)
 ASSI { 1359}
   (( segid "T22D" and resid 94   and name HE1 ))
   (( segid "T22D" and resid 94   and name HD1 ))
      2.600     0.900     0.900 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.43961E-02 ppm1      3.009 ppm2      1.781 CV     1
 OR { 1359}
   (( segid "T22D" and resid 94   and name HE2 ))
   (( segid "T22D" and resid 94   and name HD2 ))
 OR { 1359}
   (( segid "T22D" and resid 94   and name HE2 ))
   (( segid "T22D" and resid 94   and name HD1 ))
 OR { 1359}
   (( segid "T22D" and resid 94   and name HE1 ))
   (( segid "T22D" and resid 94   and name HD2 ))
 OR { 1359}
   (( segid "T22D" and resid 49   and name HE2 ))
   (( segid "T22D" and resid 49   and name HB1 ))
 OR { 1359}
   (( segid "T22D" and resid 49   and name HE1 ))
   (( segid "T22D" and resid 49   and name HB1 ))
 OR { 1359}
   (( segid "T22D" and resid 115  and name HE1 ))
   (( segid "T22D" and resid 115  and name HB1 ))
 ASSI { 1364}
   (( segid "T22D" and resid 51   and name HB2 ))
   (  segid "T22D" and resid 46   and name HG2%)
      4.100     2.100     1.900 peak  1364 spectrum    1 weight  0.10000E+01 volume  0.11830E-02 ppm1      1.308 ppm2      1.136 CV     1
 OR { 1364}
   (( segid "T22D" and resid 51   and name HB2 ))
   (( segid "T22D" and resid 81   and name HB  ))
 ASSI { 1369}
   (( segid "T22D" and resid 51   and name HB1 ))
   (  segid "T22D" and resid 46   and name HG2%)
      4.500     2.500     1.500 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.71434E-03 ppm1      1.933 ppm2      1.135 CV     1
 OR { 1369}
   (( segid "T22D" and resid 51   and name HB1 ))
   (( segid "T22D" and resid 81   and name HB  ))
 ASSI { 1371}
   (( segid "T22D" and resid 51   and name HB1 ))
   (  segid "T22D" and resid 42   and name HD1%)
      4.700     2.700     1.300 peak  1371 spectrum    1 weight  0.10000E+01 volume  0.51580E-03 ppm1      1.925 ppm2      0.441 CV     1
 OR { 1371}
   (( segid "T22D" and resid 51   and name HB1 ))
   (  segid "T22D" and resid 100  and name HG2%)
 ASSI { 1398}
   (( segid "T22D" and resid 117  and name HD1 ))
   (( segid "T22D" and resid 27   and name HB2 ))
      2.800     2.800     3.200 peak  1398 spectrum    1 weight  0.10000E+01 volume  0.20039E-02 ppm1      3.195 ppm2      2.093 CV     1
 OR { 1398}
   (( segid "T22D" and resid 117  and name HD1 ))
   (  segid "T22D" and resid 27   and name HE% )
 OR { 1398}
   (( segid "T22D" and resid 117  and name HD2 ))
   (( segid "T22D" and resid 120  and name HB  ))
 OR { 1398}
   (( segid "T22D" and resid 117  and name HD2 ))
   (( segid "T22D" and resid 27   and name HB2 ))
 OR { 1398}
   (( segid "T22D" and resid 117  and name HD2 ))
   (  segid "T22D" and resid 27   and name HE% )
 OR { 1398}
   (( segid "T22D" and resid 117  and name HD1 ))
   (( segid "T22D" and resid 120  and name HB  ))
 OR { 1398}
   (( segid "T22D" and resid 30   and name HD2 ))
   (( segid "T22D" and resid 36   and name HB2 ))
 OR { 1398}
   (( segid "T22D" and resid 30   and name HD1 ))
   (( segid "T22D" and resid 36   and name HB2 ))
 OR { 1398}
   (( segid "T22D" and resid 30   and name HD2 ))
   (( segid "T22D" and resid 27   and name HB2 ))
 OR { 1398}
   (( segid "T22D" and resid 30   and name HD2 ))
   (  segid "T22D" and resid 27   and name HE% )
 OR { 1398}
   (( segid "T22D" and resid 30   and name HD1 ))
   (( segid "T22D" and resid 27   and name HB2 ))
 OR { 1398}
   (( segid "T22D" and resid 30   and name HD1 ))
   (  segid "T22D" and resid 27   and name HE% )
 ASSI { 1407}
   (( segid "T22D" and resid 70   and name HD2 ))
   (( segid "T22D" and resid 73   and name HG2 ))
      2.500     2.500     3.500 peak  1407 spectrum    1 weight  0.10000E+01 volume  0.17243E-02 ppm1      3.195 ppm2      2.342 CV     1
 OR { 1407}
   (( segid "T22D" and resid 70   and name HD1 ))
   (( segid "T22D" and resid 73   and name HG2 ))
 OR { 1407}
   (( segid "T22D" and resid 70   and name HD2 ))
   (( segid "T22D" and resid 73   and name HG1 ))
 OR { 1407}
   (( segid "T22D" and resid 70   and name HD1 ))
   (( segid "T22D" and resid 73   and name HG1 ))
 OR { 1407}
   (( segid "T22D" and resid 117  and name HD1 ))
   (( segid "T22D" and resid 116  and name HB1 ))
 OR { 1407}
   (( segid "T22D" and resid 117  and name HD2 ))
   (( segid "T22D" and resid 116  and name HB1 ))
 OR { 1407}
   (( segid "T22D" and resid 70   and name HD1 ))
   (( segid "3T5T" and resid 7    and name H2' ))
 OR { 1407}
   (( segid "T22D" and resid 70   and name HD2 ))
   (( segid "T22D" and resid 73   and name HB1 ))
 OR { 1407}
   (( segid "T22D" and resid 70   and name HD1 ))
   (( segid "T22D" and resid 73   and name HB1 ))
 ASSI { 1439}
   (( segid "T22D" and resid 85   and name HB1 ))
   (( segid "T22D" and resid 84   and name HG2 ))
      3.700     1.700     1.700 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.80325E-03 ppm1      2.967 ppm2      1.370 CV     1
 OR { 1439}
   (( segid "T22D" and resid 86   and name HD1 ))
   (  segid "T22D" and resid 109  and name HD1%)
 ASSI { 1440}
   (( segid "T22D" and resid 85   and name HB1 ))
   (( segid "T22D" and resid 84   and name HB1 ))
      3.000     1.100     1.100 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.18665E-02 ppm1      2.976 ppm2      1.717 CV     1
 OR { 1440}
   (( segid "T22D" and resid 85   and name HB1 ))
   (( segid "T22D" and resid 91   and name HG1 ))
 ASSI { 1441}
   (( segid "T22D" and resid 86   and name HD1 ))
   (  segid "T22D" and resid 35   and name HG2%)
      3.700     1.700     1.700 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.83127E-03 ppm1      2.998 ppm2      0.797 CV     1
 OR { 1441}
   (( segid "T22D" and resid 85   and name HB1 ))
   (  segid "T22D" and resid 35   and name HG2%)
 ASSI { 1461}
   (( segid "T22D" and resid 80   and name HB2 ))
   (( segid "T22D" and resid 36   and name HE2 ))
      4.100     2.100     1.900 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.10306E-02 ppm1      2.772 ppm2      2.241 CV     1
 OR { 1461}
   (( segid "T22D" and resid 85   and name HB2 ))
   (( segid "T22D" and resid 83   and name HG1 ))
 ASSI { 1471}
   (( segid "T22D" and resid 113  and name HA1 ))
   (( segid "3T5T" and resid 4    and name H2' ))
      3.600     3.600     2.400 peak  1471 spectrum    1 weight  0.10000E+01 volume  0.10389E-02 ppm1      4.152 ppm2      2.038 CV     1
 OR { 1471}
   (( segid "T22D" and resid 113  and name HA1 ))
   (( segid "T22D" and resid 116  and name HG1 ))
 ASSI { 1480}
   (( segid "T22D" and resid 79   and name HA1 ))
   (( segid "T22D" and resid 67   and name HB  ))
      4.200     2.200     1.800 peak  1480 spectrum    1 weight  0.10000E+01 volume  0.79199E-03 ppm1      3.819 ppm2      0.938 CV     1
 OR { 1480}
   (( segid "T22D" and resid 79   and name HA1 ))
   (  segid "T22D" and resid 65   and name HG2%)
 OR { 1480}
   (( segid "T22D" and resid 79   and name HA1 ))
   (  segid "T22D" and resid 51   and name HD2%)
 ASSI { 1486}
   (( segid "T22D" and resid 28   and name HA2 ))
   (( segid "T22D" and resid 30   and name HG2 ))
      4.000     2.000     2.000 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.53603E-03 ppm1      3.961 ppm2      1.696 CV     1
 OR { 1486}
   (( segid "T22D" and resid 28   and name HA1 ))
   (( segid "T22D" and resid 30   and name HG2 ))
 OR { 1486}
   (( segid "T22D" and resid 79   and name HA2 ))
   (( segid "T22D" and resid 76   and name HG1 ))
 OR { 1486}
   (( segid "T22D" and resid 79   and name HA2 ))
   (  segid "T22D" and resid 110  and name HB% )
 ASSI { 1583}
   (( segid "T22D" and resid 105  and name HA  ))
   (  segid "T22D" and resid 42   and name HD2%)
      4.200     2.200     1.800 peak  1583 spectrum    1 weight  0.10000E+01 volume  0.50563E-03 ppm1      4.747 ppm2      0.671 CV     1
 OR { 1583}
   (( segid "T22D" and resid 105  and name HA  ))
   (  segid "T22D" and resid 39   and name HG1%)
 ASSI { 1597}
   (( segid "T22D" and resid 64   and name HA  ))
   (( segid "T22D" and resid 51   and name HB1 ))
      4.100     2.100     1.900 peak  1597 spectrum    1 weight  0.10000E+01 volume  0.73640E-03 ppm1      5.257 ppm2      1.929 CV     1
 OR { 1597}
   (( segid "T22D" and resid 64   and name HA  ))
   (( segid "T22D" and resid 65   and name HB  ))
 OR { 1597}
   (( segid "T22D" and resid 64   and name HA  ))
   (( segid "T22D" and resid 37   and name HB  ))
 ASSI { 1621}
   (( segid "T22D" and resid 42   and name HA  ))
   (( segid "T22D" and resid 77   and name HA1 ))
      4.000     2.000     2.000 peak  1621 spectrum    1 weight  0.10000E+01 volume  0.73795E-03 ppm1      4.321 ppm2      3.214 CV     1
 OR { 1621}
   (( segid "T22D" and resid 42   and name HA  ))
   (( segid "T22D" and resid 98   and name HD2 ))
 OR { 1621}
   (( segid "T22D" and resid 26   and name HA  ))
   (( segid "T22D" and resid 117  and name HD1 ))
 OR { 1621}
   (( segid "T22D" and resid 26   and name HA  ))
   (( segid "T22D" and resid 117  and name HD2 ))
 OR { 1621}
   (( segid "T22D" and resid 42   and name HA  ))
   (( segid "T22D" and resid 44   and name HB1 ))
 ASSI { 1673}
   (( segid "T22D" and resid 69   and name HA  ))
   (  segid "T22D" and resid 68   and name HG2%)
      4.500     2.500     1.500 peak  1673 spectrum    1 weight  0.10000E+01 volume  0.47831E-03 ppm1      4.607 ppm2      0.970 CV     1
 OR { 1673}
   (( segid "T22D" and resid 69   and name HA  ))
   (( segid "T22D" and resid 67   and name HB  ))
 ASSI { 1694}
   (( segid "T22D" and resid 78   and name HA  ))
   (  segid "T22D" and resid 51   and name HD1%)
      5.000     3.100     1.000 peak  1694 spectrum    1 weight  0.10000E+01 volume  0.49896E-03 ppm1      4.999 ppm2      0.595 CV     1
 OR { 1694}
   (( segid "T22D" and resid 78   and name HA  ))
   (  segid "T22D" and resid 39   and name HG2%)
 ASSI { 1704}
   (( segid "T22D" and resid 87   and name HA  ))
   (  segid "T22D" and resid 109  and name HD1%)
      4.000     2.000     2.000 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.68311E-03 ppm1      4.231 ppm2      1.381 CV     1
 OR { 1704}
   (( segid "T22D" and resid 87   and name HA  ))
   (  segid "T22D" and resid 92   and name HB% )
 ASSI { 1723}
   (( segid "T22D" and resid 110  and name HA  ))
   (  segid "T22D" and resid 80   and name HE% )
      4.300     2.300     1.700 peak  1723 spectrum    1 weight  0.10000E+01 volume  0.56359E-03 ppm1      4.120 ppm2      7.121 CV     1
 OR { 1723}
   (( segid "T22D" and resid 110  and name HA  ))
   (  segid "T22D" and resid 111  and name HD% )
 ASSI { 1746}
   (( segid "T22D" and resid 63   and name HA  ))
   (  segid "T22D" and resid 65   and name HG2%)
      4.400     2.400     1.600 peak  1746 spectrum    1 weight  0.10000E+01 volume  0.66659E-03 ppm1      4.538 ppm2      0.933 CV     1
 OR { 1746}
   (( segid "T22D" and resid 63   and name HA  ))
   (( segid "T22D" and resid 61   and name HG12))
 ASSI { 1784}
   (( segid "T22D" and resid 36   and name HA  ))
   (( segid "T22D" and resid 36   and name HE1 ))
      4.500     2.500     1.500 peak  1784 spectrum    1 weight  0.10000E+01 volume  0.67464E-03 ppm1      4.960 ppm2      2.784 CV     1
 OR { 1784}
   (( segid "T22D" and resid 36   and name HA  ))
   (( segid "T22D" and resid 80   and name HB2 ))
 OR { 1784}
   (( segid "T22D" and resid 36   and name HA  ))
   (( segid "T22D" and resid 38   and name HB2 ))
 ASSI { 1807}
   (( segid "T22D" and resid 109  and name HA  ))
   (( segid "T22D" and resid 108  and name HB2 ))
      4.400     2.400     1.600 peak  1807 spectrum    1 weight  0.10000E+01 volume  0.48190E-03 ppm1      4.476 ppm2      2.784 CV     1
 OR { 1807}
   (( segid "T22D" and resid 109  and name HA  ))
   (( segid "T22D" and resid 93   and name HB2 ))
 OR { 1807}
   (( segid "T22D" and resid 109  and name HA  ))
   (( segid "T22D" and resid 38   and name HB2 ))
 OR { 1807}
   (( segid "T22D" and resid 109  and name HA  ))
   (( segid "T22D" and resid 34   and name HB1 ))
 ASSI { 1824}
   (( segid "T22D" and resid 38   and name HA  ))
   (  segid "T22D" and resid 38   and name HD% )
      3.200     1.300     1.300 peak  1824 spectrum    1 weight  0.10000E+01 volume  0.85075E-03 ppm1      4.588 ppm2      6.638 CV     1
 OR { 1824}
   (( segid "T22D" and resid 38   and name HA  ))
   (  segid "T22D" and resid 80   and name HD% )
 ASSI { 1837}
   (( segid "T22D" and resid 34   and name HA  ))
   (( segid "T22D" and resid 111  and name HB1 ))
      4.200     2.200     1.800 peak  1837 spectrum    1 weight  0.10000E+01 volume  0.45479E-03 ppm1      4.962 ppm2      2.954 CV     1
 OR { 1837}
   (( segid "T22D" and resid 34   and name HA  ))
   (( segid "T22D" and resid 86   and name HD1 ))
 ASSI { 1844}
   (( segid "T22D" and resid 38   and name HA  ))
   (  segid "T22D" and resid 37   and name HG2%)
      4.000     2.000     2.000 peak  1844 spectrum    1 weight  0.10000E+01 volume  0.64833E-03 ppm1      4.586 ppm2      0.684 CV     1
 OR { 1844}
   (( segid "T22D" and resid 38   and name HA  ))
   (  segid "T22D" and resid 39   and name HG1%)
 OR { 1844}
   (( segid "T22D" and resid 38   and name HA  ))
   (  segid "T22D" and resid 37   and name HD1%)
 ASSI { 1888}
   (( segid "T22D" and resid 51   and name HA  ))
   (  segid "T22D" and resid 46   and name HG2%)
      3.600     1.600     1.600 peak  1888 spectrum    1 weight  0.10000E+01 volume  0.15185E-02 ppm1      4.104 ppm2      1.156 CV     1
 OR { 1888}
   (( segid "T22D" and resid 51   and name HA  ))
   (( segid "T22D" and resid 42   and name HB1 ))
 ASSI { 1892}
   (( segid "T22D" and resid 65   and name HA  ))
   (( segid "T22D" and resid 48   and name HA  ))
      3.000     1.100     1.100 peak  1892 spectrum    1 weight  0.10000E+01 volume  0.17681E-02 ppm1      4.754 ppm2      4.054 CV     1
 OR { 1892}
   (( segid "T22D" and resid 58   and name HA  ))
   (( segid "T22D" and resid 57   and name HA  ))
 ASSI { 1896}
   (( segid "T22D" and resid 67   and name HA  ))
   (  segid "T22D" and resid 67   and name HD1%)
      2.000     0.500     0.500 peak  1896 spectrum    1 weight  0.10000E+01 volume  0.10739E-01 ppm1      4.098 ppm2      0.767 CV     1
 OR { 1896}
   (( segid "T22D" and resid 86   and name HA  ))
   (  segid "T22D" and resid 35   and name HG2%)
 ASSI { 1897}
   (( segid "T22D" and resid 65   and name HA  ))
   (  segid "T22D" and resid 66   and name HG2%)
      3.500     1.500     1.500 peak  1897 spectrum    1 weight  0.10000E+01 volume  0.14798E-02 ppm1      4.751 ppm2      0.593 CV     1
 OR { 1897}
   (( segid "T22D" and resid 65   and name HA  ))
   (  segid "T22D" and resid 51   and name HD1%)
 ASSI { 1898}
   (( segid "T22D" and resid 70   and name HA  ))
   (( segid "T22D" and resid 69   and name HA  ))
      4.100     2.100     1.900 peak  1898 spectrum    1 weight  0.10000E+01 volume  0.73469E-03 ppm1      4.080 ppm2      4.573 CV     1
 OR { 1898}
   (( segid "T22D" and resid 67   and name HA  ))
   (( segid "3T5T" and resid 6    and name H4' ))
 OR { 1898}
   (( segid "T22D" and resid 86   and name HA  ))
   (( segid "T22D" and resid 35   and name HB  ))
 OR { 1898}
   (( segid "T22D" and resid 84   and name HA  ))
   (( segid "T22D" and resid 35   and name HB  ))
 ASSI { 1899}
   (( segid "T22D" and resid 84   and name HA  ))
   (( segid "T22D" and resid 84   and name HG1 ))
      2.500     0.800     0.800 peak  1899 spectrum    1 weight  0.10000E+01 volume  0.47277E-02 ppm1      4.110 ppm2      1.341 CV     1
 OR { 1899}
   (( segid "T22D" and resid 51   and name HA  ))
   (( segid "T22D" and resid 51   and name HB2 ))
 OR { 1899}
   (( segid "T22D" and resid 84   and name HA  ))
   (( segid "T22D" and resid 84   and name HG2 ))
 ASSI { 1900}
   (( segid "T22D" and resid 53   and name HA  ))
   (( segid "T22D" and resid 53   and name HB1 ))
      2.500     0.800     0.800 peak  1900 spectrum    1 weight  0.10000E+01 volume  0.54333E-02 ppm1      4.061 ppm2      2.069 CV     1
 OR { 1900}
   (( segid "T22D" and resid 84   and name HA  ))
   (( segid "T22D" and resid 62   and name HG2 ))
 OR { 1900}
   (( segid "T22D" and resid 84   and name HA  ))
   (( segid "T22D" and resid 62   and name HG1 ))
 OR { 1900}
   (( segid "T22D" and resid 53   and name HA  ))
   (( segid "T22D" and resid 56   and name HB1 ))
 ASSI { 1902}
   (( segid "T22D" and resid 68   and name HA  ))
   (  segid "T22D" and resid 68   and name HG2%)
      2.400     0.700     0.700 peak  1902 spectrum    1 weight  0.10000E+01 volume  0.88357E-02 ppm1      4.774 ppm2      0.952 CV     1
 OR { 1902}
   (( segid "T22D" and resid 65   and name HA  ))
   (  segid "T22D" and resid 65   and name HG2%)
 ASSI { 1920}
   (( segid "T22D" and resid 86   and name HA  ))
   (( segid "T22D" and resid 86   and name HG1 ))
      2.900     1.000     1.000 peak  1920 spectrum    1 weight  0.10000E+01 volume  0.18713E-02 ppm1      4.091 ppm2      1.637 CV     1
 OR { 1920}
   (( segid "T22D" and resid 86   and name HA  ))
   (  segid "T22D" and resid 89   and name HB% )
 ASSI { 1931}
   (( segid "T22D" and resid 49   and name HA  ))
   (( segid "T22D" and resid 52   and name HD2 ))
      4.600     2.600     1.400 peak  1931 spectrum    1 weight  0.10000E+01 volume  0.47627E-03 ppm1      4.153 ppm2      7.318 CV     1
 OR { 1931}
   (( segid "T22D" and resid 67   and name HA  ))
   (( segid "T22D" and resid 80   and name HZ  ))
 ASSI { 1933}
   (( segid "T22D" and resid 94   and name HA  ))
   (( segid "T22D" and resid 93   and name HB2 ))
      4.100     2.100     1.900 peak  1933 spectrum    1 weight  0.10000E+01 volume  0.46597E-03 ppm1      3.890 ppm2      2.808 CV     1
 OR { 1933}
   (( segid "T22D" and resid 94   and name HA  ))
   (( segid "T22D" and resid 95   and name HB2 ))
 ASSI { 1934}
   (( segid "T22D" and resid 67   and name HA  ))
   (( segid "T22D" and resid 79   and name HA1 ))
      3.600     1.600     1.600 peak  1934 spectrum    1 weight  0.10000E+01 volume  0.17252E-02 ppm1      4.141 ppm2      3.753 CV     1
 OR { 1934}
   (( segid "T22D" and resid 67   and name HA  ))
   (( segid "T22D" and resid 66   and name HA  ))
 OR { 1934}
   (( segid "T22D" and resid 99   and name HA  ))
   (( segid "T22D" and resid 100  and name HA  ))
 OR { 1934}
   (( segid "T22D" and resid 49   and name HA  ))
   (( segid "T22D" and resid 52   and name HA  ))
 ASSI { 1969}
   (( segid "T22D" and resid 111  and name HA  ))
   (( segid "T22D" and resid 112  and name HB2 ))
      4.100     2.100     1.900 peak  1969 spectrum    1 weight  0.10000E+01 volume  0.64378E-03 ppm1      4.433 ppm2      1.340 CV     1
 OR { 1969}
   (( segid "T22D" and resid 111  and name HA  ))
   (( segid "T22D" and resid 33   and name HB1 ))
 OR { 1969}
   (( segid "T22D" and resid 111  and name HA  ))
   (  segid "T22D" and resid 109  and name HD1%)
 ASSI { 1972}
   (( segid "T22D" and resid 39   and name HA  ))
   (( segid "T22D" and resid 42   and name HB1 ))
      3.600     3.600     2.400 peak  1972 spectrum    1 weight  0.10000E+01 volume  0.35384E-02 ppm1      4.358 ppm2      1.175 CV     1
 OR { 1972}
   (( segid "T22D" and resid 39   and name HA  ))
   (( segid "T22D" and resid 67   and name HG12))
 OR { 1972}
   (( segid "T22D" and resid 39   and name HA  ))
   (  segid "T22D" and resid 46   and name HG2%)
 OR { 1972}
   (( segid "T22D" and resid 39   and name HA  ))
   (( segid "3T5T" and resid 5    and name H72 ))
 ASSI { 1978}
   (( segid "T22D" and resid 33   and name HA  ))
   (( segid "T22D" and resid 33   and name HG1 ))
      3.000     1.100     1.100 peak  1978 spectrum    1 weight  0.10000E+01 volume  0.21901E-02 ppm1      3.739 ppm2      0.905 CV     1
 OR { 1978}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 61   and name HG12))
 ASSI { 1987}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 61   and name HB  ))
      3.900     1.900     1.900 peak  1987 spectrum    1 weight  0.10000E+01 volume  0.11213E-02 ppm1      3.747 ppm2      1.477 CV     1
 OR { 1987}
   (( segid "T22D" and resid 33   and name HA  ))
   (  segid "T22D" and resid 33   and name HE% )
 OR { 1987}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 51   and name HG  ))
 ASSI { 1989}
   (( segid "T22D" and resid 81   and name HA  ))
   (( segid "T22D" and resid 61   and name HG12))
      3.700     1.700     1.700 peak  1989 spectrum    1 weight  0.10000E+01 volume  0.11040E-02 ppm1      4.794 ppm2      0.937 CV     1
 OR { 1989}
   (( segid "T22D" and resid 81   and name HA  ))
   (  segid "T22D" and resid 65   and name HG2%)
 OR { 1989}
   (( segid "T22D" and resid 81   and name HA  ))
   (  segid "T22D" and resid 51   and name HD2%)
 ASSI { 1992}
   (( segid "T22D" and resid 81   and name HA  ))
   (( segid "T22D" and resid 37   and name HB  ))
      4.300     2.300     1.700 peak  1992 spectrum    1 weight  0.10000E+01 volume  0.45025E-03 ppm1      4.810 ppm2      1.897 CV     1
 OR { 1992}
   (( segid "T22D" and resid 81   and name HA  ))
   (( segid "T22D" and resid 51   and name HB1 ))
 OR { 1992}
   (( segid "T22D" and resid 81   and name HA  ))
   (  segid "T22D" and resid 83   and name HE% )
 ASSI { 2013}
   (( segid "T22D" and resid 100  and name HA  ))
   (( segid "T22D" and resid 99   and name HA  ))
      3.700     1.700     1.700 peak  2013 spectrum    1 weight  0.10000E+01 volume  0.13335E-02 ppm1      3.755 ppm2      4.151 CV     1
 OR { 2013}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 51   and name HA  ))
 OR { 2013}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 49   and name HA  ))
 OR { 2013}
   (( segid "T22D" and resid 100  and name HA  ))
   (( segid "T22D" and resid 102  and name HA2 ))
 OR { 2013}
   (( segid "T22D" and resid 100  and name HA  ))
   (( segid "T22D" and resid 104  and name HA  ))
 OR { 2013}
   (( segid "T22D" and resid 52   and name HA  ))
   (( segid "T22D" and resid 61   and name HA  ))
 ASSI { 2040}
   (( segid "T22D" and resid 61   and name HA  ))
   (  segid "T22D" and resid 64   and name HB% )
      4.800     2.900     1.200 peak  2040 spectrum    1 weight  0.10000E+01 volume  0.63098E-03 ppm1      4.115 ppm2      1.370 CV     1
 OR { 2040}
   (( segid "T22D" and resid 61   and name HA  ))
   (( segid "T22D" and resid 84   and name HG1 ))
 OR { 2040}
   (( segid "T22D" and resid 61   and name HA  ))
   (( segid "T22D" and resid 84   and name HG2 ))
 ASSI { 2076}
   (( segid "T22D" and resid 88   and name HA  ))
   (  segid "T22D" and resid 83   and name HE% )
      3.500     1.500     1.500 peak  2076 spectrum    1 weight  0.10000E+01 volume  0.15311E-02 ppm1      4.321 ppm2      1.923 CV     1
 OR { 2076}
   (( segid "T22D" and resid 55   and name HA  ))
   (  segid "T22D" and resid 83   and name HE% )
 OR { 2076}
   (( segid "T22D" and resid 55   and name HA  ))
   (( segid "T22D" and resid 92   and name HA  ))
 OR { 2076}
   (( segid "T22D" and resid 88   and name HA  ))
   (( segid "T22D" and resid 92   and name HA  ))
 OR { 2076}
   (( segid "T22D" and resid 55   and name HA  ))
   (( segid "T22D" and resid 51   and name HB1 ))
 ASSI { 2082}
   (( segid "T22D" and resid 72   and name HA  ))
   (( segid "T22D" and resid 73   and name HB1 ))
      4.000     2.000     2.000 peak  2082 spectrum    1 weight  0.10000E+01 volume  0.94382E-03 ppm1      4.324 ppm2      2.366 CV     1
 OR { 2082}
   (( segid "T22D" and resid 88   and name HA  ))
   (( segid "T22D" and resid 91   and name HB1 ))
 OR { 2082}
   (( segid "T22D" and resid 72   and name HA  ))
   (( segid "T22D" and resid 73   and name HB2 ))
 ASSI { 2083}
   (( segid "T22D" and resid 88   and name HA  ))
   (( segid "T22D" and resid 91   and name HB2 ))
      3.200     1.300     1.300 peak  2083 spectrum    1 weight  0.10000E+01 volume  0.12488E-02 ppm1      4.337 ppm2      2.072 CV     1
 OR { 2083}
   (( segid "T22D" and resid 88   and name HA  ))
   (( segid "T22D" and resid 91   and name HG2 ))
 OR { 2083}
   (( segid "T22D" and resid 55   and name HA  ))
   (( segid "T22D" and resid 56   and name HB1 ))
 ASSI { 2105}
   (( segid "T22D" and resid 43   and name HA  ))
   (( segid "T22D" and resid 42   and name HA  ))
      3.100     1.200     1.200 peak  2105 spectrum    1 weight  0.10000E+01 volume  0.17461E-02 ppm1      4.610 ppm2      4.294 CV     1
 OR { 2105}
   (( segid "T22D" and resid 43   and name HA  ))
   (( segid "T22D" and resid 77   and name HA2 ))
 ASSI { 2113}
   (( segid "T22D" and resid 66   and name HA  ))
   (( segid "T22D" and resid 51   and name HB2 ))
      4.000     2.000     2.000 peak  2113 spectrum    1 weight  0.10000E+01 volume  0.74641E-03 ppm1      3.742 ppm2      1.332 CV     1
 OR { 2113}
   (( segid "T22D" and resid 66   and name HA  ))
   (  segid "T22D" and resid 64   and name HB% )
 ASSI { 2127}
   (( segid "T22D" and resid 98   and name HA  ))
   (( segid "T22D" and resid 97   and name HB2 ))
      3.800     1.800     1.800 peak  2127 spectrum    1 weight  0.10000E+01 volume  0.49966E-03 ppm1      4.452 ppm2      2.814 CV     1
 OR { 2127}
   (( segid "T22D" and resid 98   and name HA  ))
   (( segid "T22D" and resid 106  and name HB1 ))
 OR { 2127}
   (( segid "T22D" and resid 98   and name HA  ))
   (( segid "T22D" and resid 106  and name HB2 ))
 ASSI { 2175}
   (( segid "T22D" and resid 46   and name HA  ))
   (  segid "T22D" and resid 100  and name HG2%)
      4.200     2.200     1.800 peak  2175 spectrum    1 weight  0.10000E+01 volume  0.63957E-03 ppm1      4.029 ppm2      0.459 CV     1
 OR { 2175}
   (( segid "T22D" and resid 46   and name HA  ))
   (  segid "T22D" and resid 42   and name HD1%)
 ASSI { 2177}
   (( segid "T22D" and resid 50   and name HB  ))
   (( segid "T22D" and resid 53   and name HB2 ))
      4.200     2.200     1.800 peak  2177 spectrum    1 weight  0.10000E+01 volume  0.66167E-03 ppm1      4.483 ppm2      2.258 CV     1
 OR { 2177}
   (( segid "T22D" and resid 50   and name HB  ))
   (( segid "T22D" and resid 101  and name HB1 ))
 OR { 2177}
   (( segid "T22D" and resid 50   and name HB  ))
   (( segid "T22D" and resid 43   and name HG1 ))
 ASSI { 2215}
   (( segid "T22D" and resid 35   and name HB  ))
   (( segid "T22D" and resid 86   and name HB2 ))
      4.800     2.800     1.200 peak  2215 spectrum    1 weight  0.10000E+01 volume  0.40446E-03 ppm1      4.580 ppm2      1.892 CV     1
 OR { 2215}
   (( segid "T22D" and resid 35   and name HB  ))
   (( segid "T22D" and resid 84   and name HB2 ))
 OR { 2215}
   (( segid "T22D" and resid 35   and name HB  ))
   (  segid "T22D" and resid 83   and name HE% )
 OR { 2215}
   (( segid "T22D" and resid 35   and name HB  ))
   (( segid "T22D" and resid 86   and name HB1 ))
 OR { 2215}
   (( segid "T22D" and resid 35   and name HB  ))
   (( segid "T22D" and resid 37   and name HB  ))
 ASSI { 2254}
   (  segid "T22D" and resid 54   and name HE% )
   (  segid "T22D" and resid 39   and name HG1%)
      4.800     2.900     1.200 peak  2254 spectrum    1 weight  0.10000E+01 volume  0.30069E-03 ppm1      6.450 ppm2      0.677 CV     1
 OR { 2254}
   (  segid "T22D" and resid 54   and name HE% )
   (  segid "T22D" and resid 99   and name HD1%)
 OR { 2254}
   (  segid "T22D" and resid 54   and name HE% )
   (  segid "T22D" and resid 42   and name HD2%)
 OR { 2254}
   (  segid "T22D" and resid 54   and name HE% )
   (  segid "T22D" and resid 37   and name HG2%)
 ASSI { 2329}
   (( segid "T22D" and resid 58   and name HZ  ))
   (  segid "T22D" and resid 37   and name HD1%)
      4.200     2.200     1.800 peak  2329 spectrum    1 weight  0.10000E+01 volume  0.60542E-03 ppm1      7.302 ppm2      0.687 CV     1
 OR { 2329}
   (( segid "T22D" and resid 58   and name HZ  ))
   (  segid "T22D" and resid 39   and name HG1%)
 OR { 2329}
   (( segid "T22D" and resid 58   and name HZ  ))
   (  segid "T22D" and resid 37   and name HG2%)
 OR { 2329}
   (( segid "T22D" and resid 58   and name HZ  ))
   (  segid "T22D" and resid 42   and name HD2%)
 OR { 2329}
   (( segid "T22D" and resid 58   and name HZ  ))
   (  segid "T22D" and resid 99   and name HD1%)
 ASSI { 2335}
   (  segid "T22D" and resid 80   and name HE% )
   (  segid "T22D" and resid 32   and name HG2%)
      2.900     2.900     3.100 peak  2335 spectrum    1 weight  0.10000E+01 volume  0.70183E-03 ppm1      7.166 ppm2      1.043 CV     1
 OR { 2335}
   (  segid "T22D" and resid 80   and name HE% )
   (  segid "T22D" and resid 107  and name HG1%)
 OR { 2335}
   (  segid "T22D" and resid 80   and name HE% )
   (  segid "T22D" and resid 107  and name HG2%)
 ASSI { 2336}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "T22D" and resid 36   and name HG1 ))
      4.400     2.400     1.600 peak  2336 spectrum    1 weight  0.10000E+01 volume  0.56455E-03 ppm1      7.166 ppm2      1.005 CV     1
 OR { 2336}
   (  segid "T22D" and resid 80   and name HE% )
   (( segid "T22D" and resid 67   and name HB  ))
 ASSI { 2337}
   (  segid "T22D" and resid 80   and name HE% )
   (  segid "T22D" and resid 67   and name HG2%)
      4.400     2.400     1.600 peak  2337 spectrum    1 weight  0.10000E+01 volume  0.43382E-03 ppm1      7.145 ppm2      0.884 CV     1
 OR { 2337}
   (  segid "T22D" and resid 80   and name HE% )
   (  segid "T22D" and resid 65   and name HG2%)
 ASSI { 2385}
   (  segid "T22D" and resid 55   and name HE% )
   (  segid "T22D" and resid 81   and name HG1%)
      4.200     2.200     1.800 peak  2385 spectrum    1 weight  0.10000E+01 volume  0.71689E-03 ppm1      7.312 ppm2      0.531 CV     1
 OR { 2385}
   (  segid "T22D" and resid 55   and name HE% )
   (  segid "T22D" and resid 51   and name HD1%)
 OR { 2385}
   (  segid "T22D" and resid 58   and name HD% )
   (  segid "T22D" and resid 81   and name HG1%)
 OR { 2385}
   (  segid "T22D" and resid 55   and name HE% )
   (( segid "T22D" and resid 37   and name HG12))
 ASSI { 2386}
   (  segid "T22D" and resid 55   and name HE% )
   (  segid "T22D" and resid 39   and name HG1%)
      3.000     1.100     1.100 peak  2386 spectrum    1 weight  0.10000E+01 volume  0.24232E-02 ppm1      7.305 ppm2      0.683 CV     1
 OR { 2386}
   (  segid "T22D" and resid 55   and name HE% )
   (  segid "T22D" and resid 37   and name HG2%)
 OR { 2386}
   (  segid "T22D" and resid 55   and name HE% )
   (  segid "T22D" and resid 42   and name HD2%)
 OR { 2386}
   (  segid "T22D" and resid 55   and name HE% )
   (  segid "T22D" and resid 37   and name HD1%)
 ASSI { 2421}
   (  segid "T22D" and resid 55   and name HD% )
   (  segid "T22D" and resid 92   and name HB% )
      3.700     1.700     1.700 peak  2421 spectrum    1 weight  0.10000E+01 volume  0.42936E-03 ppm1      7.776 ppm2      1.472 CV     1
 OR { 2421}
   (  segid "T22D" and resid 55   and name HD% )
   (( segid "T22D" and resid 51   and name HG  ))
!
!Hydrogen bond restraints
!
!!beta-1
assign ( residue  81 and name O ) ( residue  37 and name N ) 2.74 0.0 0.5
assign ( residue  81 and name O ) ( residue  37 and name HN ) 1.79 0.0 0.5
assign ( residue  108 and name O ) ( residue  38 and name N ) 2.74 0.0 0.5
assign ( residue  108 and name O ) ( residue  38 and name HN ) 1.79 0.0 0.5
assign ( residue  79 and name O ) ( residue  39 and name N ) 2.74 0.0 0.5
assign ( residue  79 and name O ) ( residue  39 and name HN ) 1.79 0.0 0.5
assign ( residue  106 and name O ) ( residue  40 and name N ) 2.74 0.0 0.5
assign ( residue  106 and name O ) ( residue  40 and name HN ) 1.79 0.0 0.5
!!alpha-1
assign ( residue  47 and name O ) ( residue  51 and name N ) 2.74 0.0 0.5
assign ( residue  47 and name O ) ( residue  51 and name HN ) 1.79 0.0 0.5
assign ( residue  48 and name O ) ( residue  52 and name N ) 2.74 0.0 0.5
assign ( residue  48 and name O ) ( residue  52 and name HN ) 1.79 0.0 0.5
assign ( residue  49 and name O ) ( residue  53 and name N ) 2.74 0.0 0.5
assign ( residue  49 and name O ) ( residue  53 and name HN ) 1.79 0.0 0.5
assign ( residue  50 and name O ) ( residue  54 and name N ) 2.74 0.0 0.5
assign ( residue  50 and name O ) ( residue  54 and name HN ) 1.79 0.0 0.5
assign ( residue  51 and name O ) ( residue  55 and name N ) 2.74 0.0 0.5
assign ( residue  51 and name O ) ( residue  55 and name HN ) 1.79 0.0 0.5
assign ( residue  52 and name O ) ( residue  56 and name N ) 2.74 0.0 0.5
assign ( residue  52 and name O ) ( residue  56 and name HN ) 1.79 0.0 0.5
!assign ( residue  53 and name O ) ( residue  57 and name N ) 2.74 0.0 0.5
!assign ( residue  53 and name O ) ( residue  57 and name HN ) 1.79 0.0 0.5
!assign ( residue  54 and name O ) ( residue  58 and name N ) 2.74 0.0 0.5
!assign ( residue  54 and name O ) ( residue  58 and name HN ) 1.79 0.0 0.5
!!beta-2
assign ( residue  82 and name O ) ( residue  63 and name N ) 2.74 0.0 0.5
assign ( residue  82 and name O ) ( residue  63 and name HN ) 1.79 0.0 0.5
assign ( residue  80 and name O ) ( residue  65 and name N ) 2.74 0.0 0.5
assign ( residue  80 and name O ) ( residue  65 and name HN ) 1.79 0.0 0.5
!!beta-3
assign ( residue  39 and name O ) ( residue  79 and name N ) 2.74 0.0 0.5
assign ( residue  39 and name O ) ( residue  79 and name HN ) 1.79 0.0 0.5
assign ( residue  65 and name O ) ( residue  80 and name N ) 2.74 0.0 0.5
assign ( residue  65 and name O ) ( residue  80 and name HN ) 1.79 0.0 0.5
assign ( residue  37 and name O ) ( residue  81 and name N ) 2.74 0.0 0.5
assign ( residue  37 and name O ) ( residue  81 and name HN ) 1.79 0.0 0.5
assign ( residue  63 and name O ) ( residue  82 and name N ) 2.74 0.0 0.5
assign ( residue  63 and name O ) ( residue  82 and name HN ) 1.79 0.0 0.5
!!alpha-2
assign ( residue  85 and name O ) ( residue  89 and name N ) 2.74 0.0 0.5
assign ( residue  85 and name O ) ( residue  89 and name HN ) 1.79 0.0 0.5
assign ( residue  86 and name O ) ( residue  90 and name N ) 2.74 0.0 0.5
assign ( residue  86 and name O ) ( residue  90 and name HN ) 1.79 0.0 0.5
assign ( residue  87 and name O ) ( residue  91 and name N ) 2.74 0.0 0.5
assign ( residue  87 and name O ) ( residue  91 and name HN ) 1.79 0.0 0.5
assign ( residue  88 and name O ) ( residue  92 and name N ) 2.74 0.0 0.5
assign ( residue  88 and name O ) ( residue  92 and name HN ) 1.79 0.0 0.5
assign ( residue  89 and name O ) ( residue  93 and name N ) 2.74 0.0 0.5
assign ( residue  89 and name O ) ( residue  93 and name HN ) 1.79 0.0 0.5
assign ( residue  90 and name O ) ( residue  94 and name N ) 2.74 0.0 0.5
assign ( residue  90 and name O ) ( residue  94 and name HN ) 1.79 0.0 0.5
!!beta-4
assign ( residue  103 and name O ) ( residue  100 and name N ) 2.74 0.0 0.5
assign ( residue  103 and name O ) ( residue  100 and name HN ) 1.79 0.0 0.5
assign ( residue  100 and name O ) ( residue  103 and name N ) 2.74 0.0 0.5
assign ( residue  100 and name O ) ( residue  103 and name HN ) 1.79 0.0 0.5
assign ( residue  98 and name O ) ( residue  105 and name N ) 2.74 0.0 0.5
assign ( residue  98 and name O ) ( residue  105 and name HN ) 1.79 0.0 0.5
!
!Dihedral restraints
!
!!TALOS-N phi/psi
assign (resid   30 and name C    ) (resid   31 and name N    )
       (resid   31 and name CA   ) (resid   31 and name C    )    1.0  -73.044   12.769 2
assign (resid   31 and name N    ) (resid   31 and name CA   )
       (resid   31 and name C    ) (resid   32 and name N    )    1.0  -18.265   7.946 2
assign (resid   31 and name C    ) (resid   32 and name N    )
       (resid   32 and name CA   ) (resid   32 and name C    )    1.0  -111.665   12.606 2
assign (resid   32 and name N    ) (resid   32 and name CA   )
       (resid   32 and name C    ) (resid   33 and name N    )    1.0  12.526   13.631 2
assign (resid   32 and name C    ) (resid   33 and name N    )
       (resid   33 and name CA   ) (resid   33 and name C    )    1.0  -60.367   6.167 2
assign (resid   33 and name N    ) (resid   33 and name CA   )
       (resid   33 and name C    ) (resid   34 and name N    )    1.0  -37.359   13.090 2
assign (resid   33 and name C    ) (resid   34 and name N    )
       (resid   34 and name CA   ) (resid   34 and name C    )    1.0  -89.419   15.008 2
assign (resid   34 and name N    ) (resid   34 and name CA   )
       (resid   34 and name C    ) (resid   35 and name N    )    1.0  -4.283   11.544 2
assign (resid   34 and name C    ) (resid   35 and name N    )
       (resid   35 and name CA   ) (resid   35 and name C    )    1.0 -115.057   32.089 2
!!assign (resid   35 and name N    ) (resid   35 and name CA   )
!!       (resid   35 and name C    ) (resid   36 and name N    )    1.0   155.662   10.930 2
assign (resid   35 and name C    ) (resid   36 and name N    )
       (resid   36 and name CA   ) (resid   36 and name C    )    1.0 -90.819   17.302 2
assign (resid   36 and name N    ) (resid   36 and name CA   )
       (resid   36 and name C    ) (resid   37 and name N    )    1.0  123.749   9.672 2
assign (resid   36 and name C    ) (resid   37 and name N    )
       (resid   37 and name CA   ) (resid   37 and name C    )    1.0 -101.226   10.885 2
assign (resid   37 and name N    ) (resid   37 and name CA   )
       (resid   37 and name C    ) (resid   38 and name N    )    1.0  127.410   6.603 2
assign (resid   37 and name C    ) (resid   38 and name N    )
       (resid   38 and name CA   ) (resid   38 and name C    )    1.0 -104.161   12.252 2
assign (resid   38 and name N    ) (resid   38 and name CA   )
       (resid   38 and name C    ) (resid   39 and name N    )    1.0  125.754   6.985 2
assign (resid   38 and name C    ) (resid   39 and name N    )
       (resid   39 and name CA   ) (resid   39 and name C    )    1.0 -111.187   7.784 2
assign (resid   39 and name N    ) (resid   39 and name CA   )
       (resid   39 and name C    ) (resid   40 and name N    )    1.0  119.576   10.659 2
assign (resid   39 and name C    ) (resid   40 and name N    )
       (resid   40 and name CA   ) (resid   40 and name C    )    1.0 -101.122   25.034 2
assign (resid   40 and name N    ) (resid   40 and name CA   )
       (resid   40 and name C    ) (resid   41 and name N    )    1.0  163.654   15.720 2
assign (resid   40 and name C    ) (resid   41 and name N    )
       (resid   41 and name CA   ) (resid   41 and name C    )    1.0 85.052   13.687 2
assign (resid   41 and name N    ) (resid   41 and name CA   )
       (resid   41 and name C    ) (resid   42 and name N    )    1.0  16.607   14.102 2
assign (resid   41 and name C    ) (resid   42 and name N    )
       (resid   42 and name CA   ) (resid   42 and name C    )    1.0  -79.192   12.566 2
assign (resid   42 and name N    ) (resid   42 and name CA   )
       (resid   42 and name C    ) (resid   43 and name N    )    1.0  137.146   11.521 2
assign (resid   42 and name C    ) (resid   43 and name N    )
       (resid   43 and name CA   ) (resid   43 and name C    )    1.0  -63.954   7.421 2
assign (resid   43 and name N    ) (resid   43 and name CA   )
       (resid   43 and name C    ) (resid   44 and name N    )    1.0  139.841   17.349 2
assign (resid   43 and name C    ) (resid   44 and name N    )
       (resid   44 and name CA   ) (resid   44 and name C    )    1.0  -67.230   7.827 2
assign (resid   44 and name N    ) (resid   44 and name CA   )
       (resid   44 and name C    ) (resid   45 and name N    )    1.0  -17.504   12.475 2
assign (resid   44 and name C    ) (resid   45 and name N    )
       (resid   45 and name CA   ) (resid   45 and name C    )    1.0  -92.810   14.516 2
assign (resid   45 and name N    ) (resid   45 and name CA   )
       (resid   45 and name C    ) (resid   46 and name N    )    1.0    2.363   21.998 2
assign (resid   45 and name C    ) (resid   46 and name N    )
       (resid   46 and name CA   ) (resid   46 and name C    )    1.0  -63.529   7.163 2
assign (resid   46 and name N    ) (resid   46 and name CA   )
       (resid   46 and name C    ) (resid   47 and name N    )    1.0  134.628   7.178 2
assign (resid   46 and name C    ) (resid   47 and name N    )
       (resid   47 and name CA   ) (resid   47 and name C    )    1.0 -128.236   16.397 2
assign (resid   47 and name N    ) (resid   47 and name CA   )
       (resid   47 and name C    ) (resid   48 and name N    )    1.0  165.963   6.011 2
assign (resid   47 and name C    ) (resid   48 and name N    )
       (resid   48 and name CA   ) (resid   48 and name C    )    1.0  -61.216   5.303 2
assign (resid   48 and name N    ) (resid   48 and name CA   )
       (resid   48 and name C    ) (resid   49 and name N    )    1.0  -36.304   5.322 2
assign (resid   48 and name C    ) (resid   49 and name N    )
       (resid   49 and name CA   ) (resid   49 and name C    )    1.0  -64.955   4.494 2
assign (resid   49 and name N    ) (resid   49 and name CA   )
       (resid   49 and name C    ) (resid   50 and name N    )    1.0  -41.580   5.612 2
assign (resid   49 and name C    ) (resid   50 and name N    )
       (resid   50 and name CA   ) (resid   50 and name C    )    1.0  -67.520   4.158 2
assign (resid   50 and name N    ) (resid   50 and name CA   )
       (resid   50 and name C    ) (resid   51 and name N    )    1.0  -38.012   3.574 2
assign (resid   50 and name C    ) (resid   51 and name N    )
       (resid   51 and name CA   ) (resid   51 and name C    )    1.0  -66.060   3.836 2
assign (resid   51 and name N    ) (resid   51 and name CA   )
       (resid   51 and name C    ) (resid   52 and name N    )    1.0  -43.732   3.425 2
assign (resid   51 and name C    ) (resid   52 and name N    )
       (resid   52 and name CA   ) (resid   52 and name C    )    1.0  -61.537   3.790 2
assign (resid   52 and name N    ) (resid   52 and name CA   )
       (resid   52 and name C    ) (resid   53 and name N    )    1.0  -42.955   10.516 2
assign (resid   52 and name C    ) (resid   53 and name N    )
       (resid   53 and name CA   ) (resid   53 and name C    )    1.0  -65.192   3.432 2
assign (resid   53 and name N    ) (resid   53 and name CA   )
       (resid   53 and name C    ) (resid   54 and name N    )    1.0  -39.085   4.733 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )    1.0  -63.216   5.798 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )    1.0  -44.744   4.909 2
assign (resid   54 and name C    ) (resid   55 and name N    )
       (resid   55 and name CA   ) (resid   55 and name C    )    1.0  -67.181   3.992 2
assign (resid   55 and name N    ) (resid   55 and name CA   )
       (resid   55 and name C    ) (resid   56 and name N    )    1.0  -35.777   6.857 2
assign (resid   55 and name C    ) (resid   56 and name N    )
       (resid   56 and name CA   ) (resid   56 and name C    )    1.0  -68.771   4.497 2
assign (resid   56 and name N    ) (resid   56 and name CA   )
       (resid   56 and name C    ) (resid   57 and name N    )    1.0  -23.039   10.167 2
assign (resid   56 and name C    ) (resid   57 and name N    )
       (resid   57 and name CA   ) (resid   57 and name C    )    1.0  -78.519   10.018 2
assign (resid   57 and name N    ) (resid   57 and name CA   )
       (resid   57 and name C    ) (resid   58 and name N    )    1.0  -17.845   9.907 2
assign (resid   57 and name C    ) (resid   58 and name N    )
       (resid   58 and name CA   ) (resid   58 and name C    )    1.0  -107.705   15.405 2
assign (resid   58 and name N    ) (resid   58 and name CA   )
       (resid   58 and name C    ) (resid   59 and name N    )    1.0  -14.770   15.838 2
!!assign (resid   58 and name C    ) (resid   59 and name N    )
!!       (resid   59 and name CA   ) (resid   59 and name C    )    1.0  79.403   6.686 2
!!assign (resid   59 and name N    ) (resid   59 and name CA   )
!!       (resid   59 and name C    ) (resid   60 and name N    )    1.0  -163.046   12.301 2
!!assign (resid   59 and name C    ) (resid   60 and name N    )
!!       (resid   60 and name CA   ) (resid   60 and name C    )    1.0  -79.060   35.574 2
assign (resid   60 and name N    ) (resid   60 and name CA   )
       (resid   60 and name C    ) (resid   61 and name N    )    1.0  134.522   16.604 2
assign (resid   60 and name C    ) (resid   61 and name N    )
       (resid   61 and name CA   ) (resid   61 and name C    )    1.0  -104.910   19.019 2
assign (resid   61 and name N    ) (resid   61 and name CA   )
       (resid   61 and name C    ) (resid   62 and name N    )    1.0  132.077   9.179 2
!!assign (resid   61 and name C    ) (resid   62 and name N    )
!!       (resid   62 and name CA   ) (resid   62 and name C    )    1.0  -92.861   13.715 2
!!assign (resid   62 and name N    ) (resid   62 and name CA   )
!!       (resid   62 and name C    ) (resid   63 and name N    )    1.0  -36.319   14.490 2
assign (resid   62 and name C    ) (resid   63 and name N    )
       (resid   63 and name CA   ) (resid   63 and name C    )    1.0 -152.936  6.178 2
assign (resid   63 and name N    ) (resid   63 and name CA   )
       (resid   63 and name C    ) (resid   64 and name N    )    1.0  143.913   7.675 2
assign (resid   63 and name C    ) (resid   64 and name N    )
       (resid   64 and name CA   ) (resid   64 and name C    )    1.0 -123.865   11.025 2
assign (resid   64 and name N    ) (resid   64 and name CA   )
       (resid   64 and name C    ) (resid   65 and name N    )    1.0  130.659   13.608 2
assign (resid   64 and name C    ) (resid   65 and name N    )
       (resid   65 and name CA   ) (resid   65 and name C    )    1.0 -127.973   8.297  2
assign (resid   65 and name N    ) (resid   65 and name CA   )
       (resid   65 and name C    ) (resid   66 and name N    )    1.0  138.790   12.184 2
assign (resid   65 and name C    ) (resid   66 and name N    )
       (resid   66 and name CA   ) (resid   66 and name C    )    1.0  -96.168   14.774 2
assign (resid   66 and name N    ) (resid   66 and name CA   )
       (resid   66 and name C    ) (resid   67 and name N    )    1.0  125.380   7.992 2
assign (resid   66 and name C    ) (resid   67 and name N    )
       (resid   67 and name CA   ) (resid   67 and name C    )    1.0  -86.442   9.623 2
assign (resid   67 and name N    ) (resid   67 and name CA   )
       (resid   67 and name C    ) (resid   68 and name N    )    1.0  104.345   23.512 2
assign (resid   67 and name C    ) (resid   68 and name N    )
       (resid   68 and name CA   ) (resid   68 and name C    )    1.0 -129.826   13.435 2
assign (resid   68 and name N    ) (resid   68 and name CA   )
       (resid   68 and name C    ) (resid   69 and name N    )    1.0  157.297   10.497 2
assign (resid   68 and name C    ) (resid   69 and name N    )
       (resid   69 and name CA   ) (resid   69 and name C    )    1.0  -71.160   13.095 2
assign (resid   69 and name N    ) (resid   69 and name CA   )
       (resid   69 and name C    ) (resid   70 and name N    )    1.0  132.808   11.710 2
assign (resid   69 and name C    ) (resid   70 and name N    )
       (resid   70 and name CA   ) (resid   70 and name C    )    1.0  -66.835   6.930 2
assign (resid   70 and name N    ) (resid   70 and name CA   )
       (resid   70 and name C    ) (resid   71 and name N    )    1.0  -29.193   12.400 2
assign (resid   70 and name C    ) (resid   71 and name N    )
       (resid   71 and name CA   ) (resid   71 and name C    )    1.0  -84.689   11.743 2
assign (resid   71 and name N    ) (resid   71 and name CA   )
       (resid   71 and name C    ) (resid   72 and name N    )    1.0  -38.028   19.582 2
assign (resid   71 and name C    ) (resid   72 and name N    )
       (resid   72 and name CA   ) (resid   72 and name C    )    1.0  -107.116   13.271 2
assign (resid   72 and name N    ) (resid   72 and name CA   )
       (resid   72 and name C    ) (resid   73 and name N    )    1.0   -17.323   5.594 2
assign (resid   72 and name C    ) (resid   73 and name N    )
       (resid   73 and name CA   ) (resid   73 and name C    )    1.0   63.744   4.357 2
assign (resid   73 and name N    ) (resid   73 and name CA   )
       (resid   73 and name C    ) (resid   74 and name N    )    1.0   21.264   9.056 2
assign (resid   73 and name C    ) (resid   74 and name N    )
       (resid   74 and name CA   ) (resid   74 and name C    )    1.0   -89.838   14.317 2
assign (resid   74 and name N    ) (resid   74 and name CA   )
       (resid   74 and name C    ) (resid   75 and name N    )    1.0   139.733   9.329 2
assign (resid   74 and name C    ) (resid   75 and name N    )
       (resid   75 and name CA   ) (resid   75 and name C    )    1.0 -75.484   14.871 2
assign (resid   75 and name N    ) (resid   75 and name CA   )
       (resid   75 and name C    ) (resid   76 and name N    )    1.0  135.458   12.733 2
!!assign (resid   75 and name C    ) (resid   76 and name N    )
!!       (resid   76 and name CA   ) (resid   76 and name C    )    1.0  -90.925   42.649 2
!!assign (resid   76 and name N    ) (resid   76 and name CA   )
!!       (resid   76 and name C    ) (resid   77 and name N    )    1.0  135.876   15.073 2
assign (resid   76 and name C    ) (resid   77 and name N    )
       (resid   77 and name CA   ) (resid   77 and name C    )    1.0   86.216   9.139 2
assign (resid   77 and name N    ) (resid   77 and name CA   )
       (resid   77 and name C    ) (resid   78 and name N    )    1.0   12.251   11.548 2
assign (resid   77 and name C    ) (resid   78 and name N    )
       (resid   78 and name CA   ) (resid   78 and name C    )    1.0 -147.206   12.666  2
assign (resid   78 and name N    ) (resid   78 and name CA   )
       (resid   78 and name C    ) (resid   79 and name N    )    1.0  159.898   8.020 2
assign (resid   78 and name C    ) (resid   79 and name N    )
       (resid   79 and name CA   ) (resid   79 and name C    )    1.0 -158.327   21.428 2
assign (resid   79 and name N    ) (resid   79 and name CA   )
       (resid   79 and name C    ) (resid   80 and name N    )    1.0  175.921   12.306 2
assign (resid   79 and name C    ) (resid   80 and name N    )
       (resid   80 and name CA   ) (resid   80 and name C    )    1.0 -134.654   11.356 2
assign (resid   80 and name N    ) (resid   80 and name CA   )
       (resid   80 and name C    ) (resid   81 and name N    )    1.0  147.127   7.591 2
assign (resid   80 and name C    ) (resid   81 and name N    )
       (resid   81 and name CA   ) (resid   81 and name C    )    1.0 -123.334   10.186 2
assign (resid   81 and name N    ) (resid   81 and name CA   )
       (resid   81 and name C    ) (resid   82 and name N    )    1.0  126.286   8.281 2
assign (resid   81 and name C    ) (resid   82 and name N    )
       (resid   82 and name CA   ) (resid   82 and name C    )    1.0 -105.071   14.540 2
assign (resid   82 and name N    ) (resid   82 and name CA   )
       (resid   82 and name C    ) (resid   83 and name N    )    1.0  123.125   12.426 2
assign (resid   82 and name C    ) (resid   83 and name N    )
       (resid   83 and name CA   ) (resid   83 and name C    )    1.0  -114.500   28.582 2
assign (resid   83 and name N    ) (resid   83 and name CA   )
       (resid   83 and name C    ) (resid   84 and name N    )    1.0 152.555   16.488 2
assign (resid   83 and name C    ) (resid   84 and name N    )
       (resid   84 and name CA   ) (resid   84 and name C    )    1.0  -68.727   7.498 2
assign (resid   84 and name N    ) (resid   84 and name CA   )
       (resid   84 and name C    ) (resid   85 and name N    )    1.0  -28.344   7.599 2
assign (resid   84 and name C    ) (resid   85 and name N    )
       (resid   85 and name CA   ) (resid   85 and name C    )    1.0 -150.537   8.908 2
assign (resid   85 and name N    ) (resid   85 and name CA   )
       (resid   85 and name C    ) (resid   86 and name N    )    1.0  164.301  13.342 2
assign (resid   85 and name C    ) (resid   86 and name N    )
       (resid   86 and name CA   ) (resid   86 and name C    )    1.0  -64.872   4.461 2
assign (resid   86 and name N    ) (resid   86 and name CA   )
       (resid   86 and name C    ) (resid   87 and name N    )    1.0  -36.244   5.998 2
assign (resid   86 and name C    ) (resid   87 and name N    )
       (resid   87 and name CA   ) (resid   87 and name C    )    1.0  -60.024   5.896 2
assign (resid   87 and name N    ) (resid   87 and name CA   )
       (resid   87 and name C    ) (resid   88 and name N    )    1.0  -42.203   5.059 2
assign (resid   87 and name C    ) (resid   88 and name N    )
       (resid   88 and name CA   ) (resid   88 and name C    )    1.0  -66.261  3.252 2
assign (resid   88 and name N    ) (resid   88 and name CA   )
       (resid   88 and name C    ) (resid   89 and name N    )    1.0  -38.726   4.824 2
assign (resid   88 and name C    ) (resid   89 and name N    )
       (resid   89 and name CA   ) (resid   89 and name C    )    1.0  -65.905   2.801 2
assign (resid   89 and name N    ) (resid   89 and name CA   )
       (resid   89 and name C    ) (resid   90 and name N    )    1.0  -40.861   3.865 2
assign (resid   89 and name C    ) (resid   90 and name N    )
       (resid   90 and name CA   ) (resid   90 and name C    )    1.0  -64.527   4.091 2
assign (resid   90 and name N    ) (resid   90 and name CA   )
       (resid   90 and name C    ) (resid   91 and name N    )    1.0  -40.507   4.691 2
assign (resid   90 and name C    ) (resid   91 and name N    )
       (resid   91 and name CA   ) (resid   91 and name C    )    1.0  -65.781   4.138 2
assign (resid   91 and name N    ) (resid   91 and name CA   )
       (resid   91 and name C    ) (resid   92 and name N    )    1.0  -41.727   4.379 2
assign (resid   91 and name C    ) (resid   92 and name N    )
       (resid   92 and name CA   ) (resid   92 and name C    )    1.0  -65.104   4.581 2
assign (resid   92 and name N    ) (resid   92 and name CA   )
       (resid   92 and name C    ) (resid   93 and name N    )    1.0  -35.270   5.927 2
assign (resid   92 and name C    ) (resid   93 and name N    )
       (resid   93 and name CA   ) (resid   93 and name C    )    1.0  -71.163   8.749 2
assign (resid   93 and name N    ) (resid   93 and name CA   )
       (resid   93 and name C    ) (resid   94 and name N    )    1.0  -22.537   11.806 2
assign (resid   93 and name C    ) (resid   94 and name N    )
       (resid   94 and name CA   ) (resid   94 and name C    )    1.0  -73.736   8.081 2
assign (resid   94 and name N    ) (resid   94 and name CA   )
       (resid   94 and name C    ) (resid   95 and name N    )    1.0  -26.985   11.739 2
assign (resid   94 and name C    ) (resid   95 and name N    )
       (resid   95 and name CA   ) (resid   95 and name C    )    1.0 -121.372   20.443 2
assign (resid   95 and name N    ) (resid   95 and name CA   )
       (resid   95 and name C    ) (resid   96 and name N    )    1.0  105.559   31.014 2
assign (resid   95 and name C    ) (resid   96 and name N    )
       (resid   96 and name CA   ) (resid   96 and name C    )    1.0  -61.220   6.569 2
assign (resid   96 and name N    ) (resid   96 and name CA   )
       (resid   96 and name C    ) (resid   97 and name N    )    1.0  0   30 2
assign (resid   96 and name C    ) (resid   97 and name N    )
       (resid   97 and name CA   ) (resid   97 and name C    )    1.0  -127.106   20.190 2
!!!assign (resid   97 and name N    ) (resid   97 and name CA   )
!!!       (resid   97 and name C    ) (resid   98 and name N    )    1.0  141.340   20.891 2
assign (resid   97 and name C    ) (resid   98 and name N    )
       (resid   98 and name CA   ) (resid   98 and name C    )    1.0  -66.485   6.208 2
assign (resid   98 and name N    ) (resid   98 and name CA   )
       (resid   98 and name C    ) (resid   99 and name N    )    1.0  148.770   9.921 2
assign (resid   98 and name C    ) (resid   99 and name N    )
       (resid   99 and name CA   ) (resid   99 and name C    )    1.0   -96.876   17.210 2
assign (resid   99 and name N    ) (resid   99 and name CA   )
       (resid   99 and name C    ) (resid  100 and name N    )    1.0   121.773   9.864 2
assign (resid   99 and name C    ) (resid  100 and name N    )
       (resid  100 and name CA   ) (resid  100 and name C    )    1.0  -128.740   13.623 2
assign (resid  100 and name N    ) (resid  100 and name CA   )
       (resid  100 and name C    ) (resid  101 and name N    )    1.0  124.098   8.494 2
assign (resid  100 and name C    ) (resid  101 and name N    )
       (resid  101 and name CA   ) (resid  101 and name C    )    1.0   54.363   4.058 2
assign (resid  101 and name N    ) (resid  101 and name CA   )
       (resid  101 and name C    ) (resid  102 and name N    )    1.0   38.603   5.499 2
assign (resid  101 and name C    ) (resid  102 and name N    )
       (resid  102 and name CA   ) (resid  102 and name C    )    1.0   78.339   4.560 2
assign (resid  102 and name N    ) (resid  102 and name CA   )
       (resid  102 and name C    ) (resid  103 and name N    )    1.0   7.950   7.210 2
assign (resid  102 and name C    ) (resid  103 and name N    )
       (resid  103 and name CA   ) (resid  103 and name C    )    1.0  -124.521   8.483 2
assign (resid  103 and name N    ) (resid  103 and name CA   )
       (resid  103 and name C    ) (resid  104 and name N    )    1.0  141.904   8.840 2
assign (resid  103 and name C    ) (resid  104 and name N    )
       (resid  104 and name CA   ) (resid  104 and name C    )    1.0  -77.209   10.009 2
assign (resid  104 and name N    ) (resid  104 and name CA   )
       (resid  104 and name C    ) (resid  105 and name N    )    1.0  129.684   9.435 2
assign (resid  104 and name C    ) (resid  105 and name N    )
       (resid  105 and name CA   ) (resid  105 and name C    )    1.0 -118.871   10.704 2
assign (resid  105 and name N    ) (resid  105 and name CA   )
       (resid  105 and name C    ) (resid  106 and name N    )    1.0  137.439  19.846 2
assign (resid  105 and name C    ) (resid  106 and name N    )
       (resid  106 and name CA   ) (resid  106 and name C    )    1.0 -115.932   14.289 2
assign (resid  106 and name N    ) (resid  106 and name CA   )
       (resid  106 and name C    ) (resid  107 and name N    )    1.0  128.831   10.954 2
assign (resid  106 and name C    ) (resid  107 and name N    )
       (resid  107 and name CA   ) (resid  107 and name C    )    1.0 -121.552   8.901 2
assign (resid  107 and name N    ) (resid  107 and name CA   )
       (resid  107 and name C    ) (resid  108 and name N    )    1.0  135.010   8.557 2
assign (resid  107 and name C    ) (resid  108 and name N    )
       (resid  108 and name CA   ) (resid  108 and name C    )    1.0 -143.852   14.576 2
assign (resid  108 and name N    ) (resid  108 and name CA   )
       (resid  108 and name C    ) (resid  109 and name N    )    1.0  154.469   17.679 2
assign (resid  108 and name C    ) (resid  109 and name N    )
       (resid  109 and name CA   ) (resid  109 and name C    )    1.0  -64.300   7.095 2
assign (resid  109 and name N    ) (resid  109 and name CA   )
       (resid  109 and name C    ) (resid  110 and name N    )    1.0  134.069   6.424 2
assign (resid  109 and name C    ) (resid  110 and name N    )
       (resid  110 and name CA   ) (resid  110 and name C    )    1.0  -60.163   7.200 2
assign (resid  110 and name N    ) (resid  110 and name CA   )
       (resid  110 and name C    ) (resid  111 and name N    )    1.0  -35.479   6.342 2
assign (resid  110 and name C    ) (resid  111 and name N    )
       (resid  111 and name CA   ) (resid  111 and name C    )    1.0  -69.432   9.973 2
assign (resid  111 and name N    ) (resid  111 and name CA   )
       (resid  111 and name C    ) (resid  112 and name N    )    1.0  -23.015   12.091 2
assign (resid  111 and name C    ) (resid  112 and name N    )
       (resid  112 and name CA   ) (resid  112 and name C    )    1.0  -74.105   6.666 2
assign (resid  112 and name N    ) (resid  112 and name CA   )
      (resid  112 and name C    ) (resid  113 and name N    )    1.0  -19.448   10.493 2
!!!assign (resid  112 and name C    ) (resid  113 and name N    )
!!!       (resid  113 and name CA   ) (resid  113 and name C    )    1.0  99.975   12.525 2
assign (resid  113 and name N    ) (resid  113 and name CA   )
       (resid  113 and name C    ) (resid  114 and name N    )    1.0  5.813   7.251 2
assign (resid  113 and name C    ) (resid  114 and name N    )
       (resid  114 and name CA   ) (resid  114 and name C    )    1.0  -69.942   8.960 2
assign (resid  114 and name N    ) (resid  114 and name CA   )
       (resid  114 and name C    ) (resid  115 and name N    )    1.0  136.287   9.030 2
assign (resid  114 and name C    ) (resid  115 and name N    )
       (resid  115 and name CA   ) (resid  115 and name C    )    1.0  -72.420   8.986 2
assign (resid  115 and name N    ) (resid  115 and name CA   )
       (resid  115 and name C    ) (resid  116 and name N    )    1.0  136.338   11.701 2

!!TALOS-N chi1
!!F34 g-
assign (resid   34 and name N   ) (resid   34 and name CA   )
       (resid   34 and name CB   ) (resid   34 and name CG  )    1.0  -60.0   15.0 2
!!T35 g+
assign (resid   35 and name N   ) (resid   35 and name CA   )
       (resid   35 and name CB   ) (resid   35 and name OG1  )    1.0  60.0   15.0 2
!!K36 t
assign (resid   36 and name N   ) (resid   36 and name CA   )
       (resid   36 and name CB   ) (resid   36 and name CG  )    1.0  180.0   15.0 2
!!I37 g-
assign (resid   37 and name N   ) (resid   37 and name CA   )
       (resid   37 and name CB   ) (resid   37 and name CG1  )    1.0  -60.0   15.0 2
!!F38 t
assign (resid   38 and name N   ) (resid   38 and name CA   )
       (resid   38 and name CB   ) (resid   38 and name CG  )    1.0  180.0   15.0 2
!!V39 t
assign (resid   39 and name N   ) (resid   39 and name CA   )
       (resid   39 and name CB   ) (resid   39 and name CG1  )    1.0  180.0   15.0 2
!!L42 g-
assign (resid   42 and name N   ) (resid   42 and name CA   )
       (resid   42 and name CB   ) (resid   42 and name CG  )    1.0  -60.0   15.0 2
!!Y44 g-
assign (resid   44 and name N   ) (resid   44 and name CA   )
       (resid   44 and name CB   ) (resid   44 and name CG  )    1.0  -60.0   15.0 2
!!T46 g-
assign (resid   46 and name N   ) (resid   46 and name CA   )
       (resid   46 and name CB   ) (resid   46 and name OG1  )    1.0  -60.0   15.0 2
!!S47 g+
assign (resid   47 and name N   ) (resid   47 and name CA   )
       (resid   47 and name CB   ) (resid   47 and name OG  )    1.0  60.0   15.0 2
!!D48 g-
assign (resid   48 and name N   ) (resid   48 and name CA   )
       (resid   48 and name CB   ) (resid   48 and name CG  )    1.0  -60.0   15.0 2
!!T50 g-
assign (resid   50 and name N   ) (resid   50 and name CA   )
       (resid   50 and name CB   ) (resid   50 and name OG1  )    1.0  -60.0   15.0 2
!!H52 t
assign (resid   52 and name N   ) (resid   52 and name CA   )
       (resid   52 and name CB   ) (resid   52 and name CG  )    1.0  180.0   15.0 2
!!F55 g-
assign (resid   55 and name N   ) (resid   55 and name CA   )
       (resid   55 and name CB   ) (resid   55 and name CG  )    1.0  -60.0   15.0 2
!!Q57 g-
assign (resid   57 and name N   ) (resid   57 and name CA   )
       (resid   57 and name CB   ) (resid   57 and name CG  )    1.0  -60.0   15.0 2
!!F58 g-
assign (resid   58 and name N   ) (resid   58 and name CA   )
       (resid   58 and name CB   ) (resid   58 and name CG  )    1.0  -60.0   15.0 2
!!D60 g-
assign (resid   60 and name N   ) (resid   60 and name CA   )
       (resid   60 and name CB   ) (resid   60 and name CG  )    1.0  -60.0   15.0 2
!!I61 g-
assign (resid   61 and name N   ) (resid   61 and name CA   )
       (resid   61 and name CB   ) (resid   61 and name CG1  )    1.0  -60.0   15.0 2
!!V66 t
assign (resid   66 and name N   ) (resid   66 and name CA   )
       (resid   66 and name CB   ) (resid   66 and name CG1  )    1.0  180.0   15.0 2
!!I67 g-
assign (resid   67 and name N   ) (resid   67 and name CA   )
       (resid   67 and name CB   ) (resid   67 and name CG1  )    1.0  -60.0   15.0 2
!!T68 g+
assign (resid   68 and name N   ) (resid   68 and name CA   )
       (resid   68 and name CB   ) (resid   68 and name OG1  )    1.0  60.0   15.0 2
!!D69 t
assign (resid   69 and name N   ) (resid   69 and name CA   )
       (resid   69 and name CB   ) (resid   69 and name CG  )    1.0  180.0   15.0 2
!!N71 g-
assign (resid   71 and name N   ) (resid   71 and name CA   )
       (resid   71 and name CB   ) (resid   71 and name CG  )    1.0  -60.0   15.0 2
!!T72 g+
assign (resid   72 and name N   ) (resid   72 and name CA   )
       (resid   72 and name CB   ) (resid   72 and name OG1  )    1.0  60.0   15.0 2
!!Q73 g-
assign (resid   73 and name N   ) (resid   73 and name CA   )
       (resid   73 and name CB   ) (resid   73 and name CG  )    1.0  -60.0   15.0 2
!!K74 g-
assign (resid   74 and name N   ) (resid   74 and name CA   )
       (resid   74 and name CB   ) (resid   74 and name CG  )    1.0  -60.0   15.0 2
!!R76 g-
assign (resid   76 and name N   ) (resid   76 and name CA   )
       (resid   76 and name CB   ) (resid   76 and name CG  )    1.0  -60.0   15.0 2
!!Y78 g+
assign (resid   78 and name N   ) (resid   78 and name CA   )
       (resid   78 and name CB   ) (resid   78 and name CG  )    1.0  60.0   15.0 2
!!F80 g-
assign (resid   80 and name N   ) (resid   80 and name CA   )
       (resid   80 and name CB   ) (resid   80 and name CG  )    1.0  -60.0   15.0 2
!!V81 t
assign (resid   81 and name N   ) (resid   81 and name CA   )
       (resid   81 and name CB   ) (resid   81 and name CG1  )    1.0  180.0   15.0 2
!!T82 g-
assign (resid   82 and name N   ) (resid   82 and name CA   )
       (resid   82 and name CB   ) (resid   82 and name OG1  )    1.0  -60.0   15.0 2
!!M83 g-
assign (resid   83 and name N   ) (resid   83 and name CA   )
       (resid   83 and name CB   ) (resid   83 and name CG  )    1.0  -60.0   15.0 2
!!C93 g-
assign (resid   93 and name N   ) (resid   93 and name CA   )
       (resid   93 and name CB   ) (resid   93 and name SG  )    1.0  -60.0   15.0 2
!!D95 t
assign (resid   95 and name N   ) (resid   95 and name CA   )
       (resid   95 and name CB   ) (resid   95 and name CG  )    1.0  180.0   15.0 2
!!N97 g-
assign (resid   97 and name N   ) (resid   97 and name CA   )
       (resid   97 and name CB   ) (resid   97 and name CG  )    1.0  -60.0   15.0 2
!!I99 g-
assign (resid   99 and name N   ) (resid   99 and name CA   )
       (resid   99 and name CB   ) (resid   99 and name CG1  )    1.0  -60.0   15.0 2
!!I100 g-
assign (resid  100 and name N   ) (resid  100 and name CA   )
       (resid  100 and name CB   ) (resid  100 and name CG1  )    1.0  -60.0   15.0 2
!!K104 t
assign (resid  104 and name N   ) (resid  104 and name CA   )
       (resid  104 and name CB   ) (resid  104 and name CG  )    1.0  180.0   15.0 2
!!V107 t
assign (resid  107 and name N   ) (resid  107 and name CA   )
       (resid  107 and name CB   ) (resid  107 and name CG1  )    1.0  180.0   15.0 2
!!Y111 g- not included
!!assign (resid  111 and name N   ) (resid  111 and name CA   )
!!       (resid  111 and name CB   ) (resid  111 and name CG  )    1.0  -60.0   15.0 2
!!L112 g-
assign (resid  112 and name N   ) (resid  112 and name CA   )
       (resid  112 and name CB   ) (resid  112 and name SG  )    1.0  -60.0   15.0 2
!!K115 g-
assign (resid  115 and name N   ) (resid  115 and name CA   )
       (resid  115 and name CB   ) (resid  115 and name CG  )    1.0  -60.0   15.0 2
!!R117 g-
assign (resid  117 and name N   ) (resid  117 and name CA   )
       (resid  117 and name CB   ) (resid  117 and name SG  )    1.0  -60.0   15.0 2
!!V120 t
assign (resid  120 and name N   ) (resid  120 and name CA   )
       (resid  120 and name CB   ) (resid  120 and name CG1  )    1.0  180.0   15.0 2

!13C D1-D2 = 2.6 = trans
assign (resid   42 and name CA   ) (resid   42 and name CB   )
       (resid   42 and name CG   ) (resid   42 and name CD1  )    1.0  180.0   10.0 2
assign (resid   42 and name  N   ) (resid   42 and name CA   )
       (resid   42 and name CB   ) (resid   42 and name CG   )    1.0  -60.0   10.0 2
!13C D1-D2 = 1.3 => Leu51 is mostly trans
assign (resid   51 and name CA   ) (resid   51 and name CB   )
       (resid   51 and name CG   ) (resid   51 and name CD1  )    1.0  180.0   10.0 2
assign (resid   51 and name  N   ) (resid   51 and name CA   )
       (resid   51 and name CB   ) (resid   51 and name CG   )    1.0  -60.0   10.0 2
!13C D1-D2 = 3.3 = trans
assign (resid  109 and name CA   ) (resid  109 and name CB   )
       (resid  109 and name CG   ) (resid  109 and name CD1  )    1.0  180.0   10.0 2
assign (resid  109 and name  N   ) (resid  109 and name CA   )
       (resid  109 and name CB   ) (resid  109 and name CG   )    1.0  -60.0   10.0 2
!13C D1-D2 = 3.2 = trans
assign (resid  112 and name CA   ) (resid  112 and name CB   )
       (resid  112 and name CG   ) (resid  112 and name CD1  )    1.0  180.0   10.0 2
assign (resid  112 and name  N   ) (resid  112 and name CA   )
       (resid  112 and name CB   ) (resid  112 and name CG   )    1.0  -60.0   10.0 2

!!DNA dihedrals
! Alpha (O3' - P - O5' - C5') 180 +/- 135
assign (resid 1 and name O3') (resid 2 and name P) (resid 2 and name O5') (resid 2 and name C5') 1 180 135 2
assign (resid 2 and name O3') (resid 3 and name P) (resid 3 and name O5') (resid 3 and name C5') 1 180 135 2
assign (resid 3 and name O3') (resid 4 and name P) (resid 4 and name O5') (resid 4 and name C5') 1 180 135 2
assign (resid 4 and name O3') (resid 5 and name P) (resid 5 and name O5') (resid 5 and name C5') 1 180 135 2
assign (resid 5 and name O3') (resid 6 and name P) (resid 6 and name O5') (resid 6 and name C5') 1 180 135 2
assign (resid 6 and name O3') (resid 7 and name P) (resid 7 and name O5') (resid 7 and name C5') 1 180 135 2

! Beta (P - O5' - C5' - C4') 165 +/- 90
assign (resid 2 and name P) (resid 2 and name O5') (resid 2 and name C5') (resid 2 and name C4') 1 165 90 2
assign (resid 3 and name P) (resid 3 and name O5') (resid 3 and name C5') (resid 3 and name C4') 1 165 90 2
assign (resid 4 and name P) (resid 4 and name O5') (resid 4 and name C5') (resid 4 and name C4') 1 165 90 2
assign (resid 5 and name P) (resid 5 and name O5') (resid 5 and name C5') (resid 5 and name C4') 1 165 90 2
assign (resid 6 and name P) (resid 6 and name O5') (resid 6 and name C5') (resid 6 and name C4') 1 165 90 2
assign (resid 7 and name P) (resid 7 and name O5') (resid 7 and name C5') (resid 7 and name C4') 1 165 90 2

! Gamma ( O5' - C5' - C4' - C3') 125 +/- 85
assign (resid 1 and name O5') (resid 1 and name C5') (resid 1 and name C4') (resid 1 and name C3') 1 125 85 2
assign (resid 2 and name O5') (resid 2 and name C5') (resid 2 and name C4') (resid 2 and name C3') 1 125 85 2
assign (resid 3 and name O5') (resid 3 and name C5') (resid 3 and name C4') (resid 3 and name C3') 1 125 85 2
assign (resid 4 and name O5') (resid 4 and name C5') (resid 4 and name C4') (resid 4 and name C3') 1 125 85 2
assign (resid 5 and name O5') (resid 5 and name C5') (resid 5 and name C4') (resid 5 and name C3') 1 125 85 2
assign (resid 6 and name O5') (resid 6 and name C5') (resid 6 and name C4') (resid 6 and name C3') 1 125 85 2
assign (resid 7 and name O5') (resid 7 and name C5') (resid 7 and name C4') (resid 7 and name C3') 1 125 85 2

! Delta (C5' - C4' - C3' - O3') 115 +/- 50
assign (resid 1 and name C5') (resid 1 and name C4') (resid 1 and name C3') (resid 1 and name O3') 1 115 50 2
assign (resid 2 and name C5') (resid 2 and name C4') (resid 2 and name C3') (resid 2 and name O3') 1 115 50 2
assign (resid 3 and name C5') (resid 3 and name C4') (resid 3 and name C3') (resid 3 and name O3') 1 115 50 2
assign (resid 4 and name C5') (resid 4 and name C4') (resid 4 and name C3') (resid 4 and name O3') 1 115 50 2
assign (resid 5 and name C5') (resid 5 and name C4') (resid 5 and name C3') (resid 5 and name O3') 1 115 50 2
assign (resid 6 and name C5') (resid 6 and name C4') (resid 6 and name C3') (resid 6 and name O3') 1 115 50 2
assign (resid 7 and name C5') (resid 7 and name C4') (resid 7 and name C3') (resid 7 and name O3') 1 115 50 2

! Epsilon (C4' - C3' - O3' - P) -127 +/- 55
assign (resid 1 and name C4') (resid 1 and name C3') (resid 1 and name O3') (resid 2 and name P)  1 -127 55 2
assign (resid 2 and name C4') (resid 2 and name C3') (resid 2 and name O3') (resid 3 and name P)  1 -127 55 2
assign (resid 3 and name C4') (resid 3 and name C3') (resid 3 and name O3') (resid 4 and name P)  1 -127 55 2
assign (resid 4 and name C4') (resid 4 and name C3') (resid 4 and name O3') (resid 5 and name P)  1 -127 55 2
assign (resid 5 and name C4') (resid 5 and name C3') (resid 5 and name O3') (resid 6 and name P)  1 -127 55 2
assign (resid 6 and name C4') (resid 6 and name C3') (resid 6 and name O3') (resid 7 and name P)  1 -127 55 2

! Zeta (C3' - O3' - P - O5') 175 +/- 130
assign (resid 1 and name C3') (resid 1 and name O3') (resid 2 and name P) (resid 2 and name O5') 1 175 130 2
assign (resid 2 and name C3') (resid 2 and name O3') (resid 3 and name P) (resid 3 and name O5') 1 175 130 2
assign (resid 3 and name C3') (resid 3 and name O3') (resid 4 and name P) (resid 4 and name O5') 1 175 130 2
assign (resid 4 and name C3') (resid 4 and name O3') (resid 5 and name P) (resid 5 and name O5') 1 175 130 2
assign (resid 5 and name C3') (resid 5 and name O3') (resid 6 and name P) (resid 6 and name O5') 1 175 130 2
assign (resid 6 and name C3') (resid 6 and name O3') (resid 7 and name P) (resid 7 and name O5') 1 175 130 2

! Chi A,G (O4' - C1' - N9 -C4) -140 +/- 40 (anti)
assign (resid 1 and name O4') (resid 1 and name C1') (resid 1 and name N9) (resid 1 and name C4) 1 -120 60 2
assign (resid 2 and name O4') (resid 2 and name C1') (resid 2 and name N9) (resid 2 and name C4) 1 -120 60 2
assign (resid 3 and name O4') (resid 3 and name C1') (resid 3 and name N1) (resid 3 and name C2) 1 -145 35 2
assign (resid 4 and name O4') (resid 4 and name C1') (resid 4 and name N9) (resid 4 and name C4) 1 70 10 2
assign (resid 5 and name O4') (resid 5 and name C1') (resid 5 and name N1) (resid 5 and name C2) 1 -120 60 2
assign (resid 6 and name O4') (resid 6 and name C1') (resid 6 and name N9) (resid 6 and name C4) 1 -145 35 2

{ Restrain Specific Nucleotides to 2' endo }
assign (resid 1 and name C4') (resid 1 and name O4')
       (resid 1 and name C1') (resid 1 and name C2') 2 -18 5 2
assign (resid 1 and name O4') (resid 1 and name C1')
       (resid 1 and name C2') (resid 1 and name C3') 2 34 5 2
assign (resid 1 and name C1') (resid 1 and name C2')
       (resid 1 and name C3') (resid 1 and name C4') 2 -37 5 2
assign (resid 1 and name C2') (resid 1 and name C3')
       (resid 1 and name C4') (resid 1 and name O4') 2 26 5 2

assign (resid 2 and name C4') (resid 2 and name O4')
       (resid 2 and name C1') (resid 2 and name C2') 2 -18 5 2
assign (resid 2 and name O4') (resid 2 and name C1')
       (resid 2 and name C2') (resid 2 and name C3') 2 34 5 2
assign (resid 2 and name C1') (resid 2 and name C2')
       (resid 2 and name C3') (resid 2 and name C4') 2 -37 5 2
assign (resid 2 and name C2') (resid 2 and name C3')
       (resid 2 and name C4') (resid 2 and name O4') 2 26 5 2

assign (resid 3 and name C4') (resid 3 and name O4')
       (resid 3 and name C1') (resid 3 and name C2') 2 -18 5 2
assign (resid 3 and name O4') (resid 3 and name C1')
       (resid 3 and name C2') (resid 3 and name C3') 2 34 5 2
assign (resid 3 and name C1') (resid 3 and name C2')
       (resid 3 and name C3') (resid 3 and name C4') 2 -37 5 2
assign (resid 3 and name C2') (resid 3 and name C3')
       (resid 3 and name C4') (resid 3 and name O4') 2 26 5 2

assign (resid 5 and name C4') (resid 5 and name O4')
       (resid 5 and name C1') (resid 5 and name C2') 2 -18 5 2
assign (resid 5 and name O4') (resid 5 and name C1')
       (resid 5 and name C2') (resid 5 and name C3') 2 34 5 2
assign (resid 5 and name C1') (resid 5 and name C2')
       (resid 5 and name C3') (resid 5 and name C4') 2 -37 5 2
assign (resid 5 and name C2') (resid 5 and name C3')
       (resid 5 and name C4') (resid 5 and name O4') 2 26 5 2

assign (resid 6 and name C4') (resid 6 and name O4')
       (resid 6 and name C1') (resid 6 and name C2') 2 -18 5 2
assign (resid 6 and name O4') (resid 6 and name C1')
       (resid 6 and name C2') (resid 6 and name C3') 2 34 5 2
assign (resid 6 and name C1') (resid 6 and name C2')
       (resid 6 and name C3') (resid 6 and name C4') 2 -37 5 2
assign (resid 6 and name C2') (resid 6 and name C3')
       (resid 6 and name C4') (resid 6 and name O4') 2 26 5 2
!
!RDC restraints
!
!!aligned with PEG/hexanol with HDO splitting 35.5 Hz
!!
!!Da=13
!!R=0.25

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  32  and name  HN  )
       ( resid  32  and name  N   )  6.42 0.96

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  33  and name  HN  )
       ( resid  33  and name  N   )  -5.04 0.24

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  34  and name  HN  )
       ( resid  34  and name  N   )  6.78 3.11

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  35  and name  HN  )
       ( resid  35  and name  N   )  -0.63 3.89

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  36  and name  HN  )
       ( resid  36  and name  N   )  -6.96 0.38

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  37  and name  HN  )
       ( resid  37  and name  N   )  1.52 4.74

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  39  and name  HN  )
       ( resid  39  and name  N   )  -15.16 0.13

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  40  and name  HN  )
       ( resid  40  and name  N   )  -3.57 0.31

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  45  and name  HN  )
       ( resid  45  and name  N   )  -5.14 3.84

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  46  and name  HN  )
       ( resid  46  and name  N   )  10.31 0.20

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  47  and name  HN  )
       ( resid  47  and name  N   )  5.02 0.50

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  48  and name  HN  )
       ( resid  48  and name  N   )  -9.12 2.28

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  49  and name  HN  )
       ( resid  49  and name  N   )  -8.79 0.91

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  50  and name  HN  )
       ( resid  50  and name  N   )  3.10 0.13

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  51  and name  HN  )
       ( resid  51  and name  N   )  -10.54 2.05

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  52  and name  HN  )
       ( resid  52  and name  N   )  -8.09 7.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  53  and name  HN  )
       ( resid  53  and name  N   )  -7.30 0.46

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  54  and name  HN  )
       ( resid  54  and name  N   )  4.42 1.68

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  55  and name  HN  )
       ( resid  55  and name  N   )  -3.6 1.23

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  57  and name  HN  )
       ( resid  57  and name  N   )  13.14 0.81

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  58  and name  HN  )
       ( resid  58  and name  N   )  0.09 0.16

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  59  and name  HN  )
       ( resid  59  and name  N   )  -12.27 1.36

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  60  and name  HN  )
       ( resid  60  and name  N   )  -7.74 1.20

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  61  and name  HN  )
       ( resid  61  and name  N   )  0.25 1.33

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  62  and name  HN  )
       ( resid  62  and name  N   )  1.92 1.84

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  63  and name  HN  )
       ( resid  63  and name  N   )  -14 3.58

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  64  and name  HN  )
       ( resid  64  and name  N   )  -9.74 0.33

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  65  and name  HN  )
       ( resid  65  and name  N   )  -11.85 3.90

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  67  and name  HN  )
       ( resid  67  and name  N   )  -11.22 4.37

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  68  and name  HN  )
       ( resid  68  and name  N   )  1.70 1.60

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  69  and name  HN  )
       ( resid  69  and name  N   )  -3.67 2.15

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  70  and name  HN  )
       ( resid  70  and name  N   )  -7.84 1.13

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  71  and name  HN  )
       ( resid  71  and name  N   )  -4.74 0.81

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  72  and name  HN  )
       ( resid  72  and name  N   )  -11.05 0.20

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  73  and name  HN  )
       ( resid  73  and name  N   )  -2.12 2.02

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  74  and name  HN  )
       ( resid  74  and name  N   )  11.28 1.00

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  75  and name  HN  )
       ( resid  75  and name  N   )  -8.33 1.03

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  76  and name  HN  )
       ( resid  76  and name  N   )  13.22 0.80

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  77  and name  HN  )
       ( resid  77  and name  N   )  -9.43 3.46

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  78  and name  HN  )
       ( resid  78  and name  N   )  -14.68 2.93

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  79  and name  HN  )
       ( resid  79  and name  N   )  -16.94 2.32

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  80  and name  HN  )
       ( resid  80  and name  N   )  -11.94 9.16

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  81  and name  HN  )
       ( resid  81  and name  N   )  -1.82 5.15

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  82  and name  HN  )
       ( resid  82  and name  N   )  -11.34 0.49

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  84  and name  HN  )
       ( resid  84  and name  N   )  -4.88 0.14

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  85  and name  HN  )
       ( resid  85  and name  N   )  -2.99 3.93

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  86  and name  HN  )
       ( resid  86  and name  N   )  -0.92 1.41

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  87  and name  HN  )
       ( resid  87  and name  N   )  10.13 0.06

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  88  and name  HN  )
       ( resid  88  and name  N   )  -2.04 2.35

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  89  and name  HN  )
       ( resid  89  and name  N   )  -2.42 1.48

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  90  and name  HN  )
       ( resid  90  and name  N   )  10.14 1.09

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  91  and name  HN  )
       ( resid  91  and name  N   )  8.04 0.7

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  92  and name  HN  )
       ( resid  92  and name  N   )  -0.72 0.12

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  93  and name  HN  )
       ( resid  93  and name  N   )  4.34 1.61

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  94  and name  HN  )
       ( resid  94  and name  N   )  17.38 1.08

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  95  and name  HN  )
       ( resid  95  and name  N   )  1.88 0.80

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  97  and name  HN  )
       ( resid  97  and name  N   )  5.12 0.62

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  99  and name  HN  )
       ( resid  99  and name  N   )  7.18 0.58

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 100   and name  HN  )
       ( resid 100   and name  N   )  24.61 2.21

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 101   and name  HN  )
       ( resid 101   and name  N   )  23.51 3.10

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 102   and name  HN  )
       ( resid 102   and name  N   )  11.54 0.62

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 103   and name  HN  )
       ( resid 103   and name  N   )  8.27 3.25

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 105   and name  HN  )
       ( resid 105   and name  N   )  20.41 0.45

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 106  and name  HN  )
       ( resid 106  and name  N   )  -10.87 2.52

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 107   and name  HN  )
       ( resid 107   and name  N   )  -9.94 6.48

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 108   and name  HN  )
       ( resid 108   and name  N   )  -15.30 1.05

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 109   and name  HN  )
       ( resid 109   and name  N   )  -13.48 1.81

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 110   and name  HN  )
       ( resid 110   and name  N   )  18.41 2.12

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 111   and name  HN  )
       ( resid 111   and name  N   )  25.115 4.12

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 112   and name  HN  )
       ( resid 112   and name  N   )  10.86 1.37

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 113   and name  HN  )
       ( resid 113   and name  N   )  5.66 2.81

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 114   and name  HN  )
       ( resid 114   and name  N   )  2.85 0.28

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 117   and name  HN  )
       ( resid 117   and name  N   )  -1.35 0.18

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY  25           HT1      GLY  25  -7.724 -11.592  -1.304
  Start of MODEL    1
    2    H2   GLY  25           HT2      GLY  25  -7.833 -13.264  -1.071
  Start of MODEL    1
    3    H3   GLY  25           HT3      GLY  25  -7.898 -12.217   0.255
  Start of MODEL    1
    4    HA3  GLY  25           HA2      GLY  25  -9.988 -11.315  -0.467
  Start of MODEL    1
    5    HA2  GLY  25           HA3      GLY  25 -10.102 -13.061  -0.305
  Start of MODEL    1
    6    H    ALA  26           H        ALA  26 -10.792 -10.484  -2.227
  Start of MODEL    1
    7    HA   ALA  26           HA       ALA  26 -11.351 -10.113  -4.393
  Start of MODEL    1
    8    HB2  ALA  26           HB1      ALA  26  -9.872 -12.636  -5.085
  Start of MODEL    1
    9    HB1  ALA  26           HB2      ALA  26  -9.138 -11.036  -4.972
  Start of MODEL    1
   10    HB3  ALA  26           HB3      ALA  26 -10.369 -11.358  -6.196
  Start of MODEL    1
   11    H    MET  27           H        MET  27 -12.655 -12.191  -2.479
  Start of MODEL    1
   12    HA   MET  27           HA       MET  27 -14.589 -13.165  -4.474
  Start of MODEL    1
   13    HB2  MET  27           HB2      MET  27 -13.845 -14.504  -1.860
  Start of MODEL    1
   14    HB3  MET  27           HB3      MET  27 -15.054 -15.079  -2.999
  Start of MODEL    1
   15    HG2  MET  27           HG2      MET  27 -12.098 -14.851  -3.523
  Start of MODEL    1
   16    HG3  MET  27           HG3      MET  27 -12.983 -16.337  -3.180
  Start of MODEL    1
   17    HE2  MET  27           HE1      MET  27 -12.025 -16.688  -6.964
  Start of MODEL    1
   18    HE1  MET  27           HE2      MET  27 -11.920 -17.415  -5.363
  Start of MODEL    1
   19    HE3  MET  27           HE3      MET  27 -11.068 -15.913  -5.703
  Start of MODEL    1
   20    H    GLY  28           H        GLY  28 -14.709 -13.191  -0.936
  Start of MODEL    1
   21    HA2  GLY  28           HA2      GLY  28 -17.107 -11.486  -1.107
  Start of MODEL    1
   22    HA3  GLY  28           HA3      GLY  28 -16.786 -12.643   0.178
  Start of MODEL    1
   23    H    SER  29           H        SER  29 -14.177 -10.701  -0.933
  Start of MODEL    1
   24    HA   SER  29           HA       SER  29 -13.998  -9.486   1.685
  Start of MODEL    1
   25    HB2  SER  29           HB2      SER  29 -11.797  -8.609   0.737
  Start of MODEL    1
   26    HB3  SER  29           HB3      SER  29 -11.949 -10.364   0.847
  Start of MODEL    1
   27    HG   SER  29           HG       SER  29 -12.379  -8.777  -1.473
  Start of MODEL    1
   28    H    ARG  30           H        ARG  30 -15.881  -8.129   1.471
  Start of MODEL    1
   29    HA   ARG  30           HA       ARG  30 -15.461  -5.770  -0.224
  Start of MODEL    1
   30    HB2  ARG  30           HB2      ARG  30 -17.773  -5.212   0.144
  Start of MODEL    1
   31    HB3  ARG  30           HB3      ARG  30 -17.682  -6.909  -0.300
  Start of MODEL    1
   32    HG2  ARG  30           HG2      ARG  30 -19.180  -6.999   1.410
  Start of MODEL    1
   33    HG3  ARG  30           HG3      ARG  30 -17.679  -7.269   2.297
  Start of MODEL    1
   34    HD2  ARG  30           HD2      ARG  30 -17.600  -4.820   2.751
  Start of MODEL    1
   35    HD3  ARG  30           HD3      ARG  30 -19.196  -4.682   2.022
  Start of MODEL    1
   36    HE   ARG  30           HE       ARG  30 -19.288  -6.619   4.061
  Start of MODEL    1
   37   HH11  ARG  30          HH11      ARG  30 -18.943  -3.151   3.637
  Start of MODEL    1
   38   HH12  ARG  30          HH12      ARG  30 -19.625  -2.774   5.196
  Start of MODEL    1
   39   HH21  ARG  30          HH21      ARG  30 -20.166  -6.104   6.128
  Start of MODEL    1
   40   HH22  ARG  30          HH22      ARG  30 -20.289  -4.436   6.604
  Start of MODEL    1
   41    H    ASP  31           H        ASP  31 -14.836  -6.913   2.759
  Start of MODEL    1
   42    HA   ASP  31           HA       ASP  31 -15.221  -4.704   4.475
  Start of MODEL    1
   43    HB2  ASP  31           HB2      ASP  31 -13.326  -5.891   5.770
  Start of MODEL    1
   44    HB3  ASP  31           HB3      ASP  31 -14.802  -6.814   5.484
  Start of MODEL    1
   45    H    THR  32           H        THR  32 -12.860  -5.476   2.074
  Start of MODEL    1
   46    HA   THR  32           HA       THR  32 -11.273  -3.113   2.819
  Start of MODEL    1
   47    HB   THR  32           HB       THR  32  -9.358  -4.490   1.699
  Start of MODEL    1
   48    HG1  THR  32           HG1      THR  32 -10.895  -6.660   2.732
  Start of MODEL    1
   49   HG22  THR  32          HG21      THR  32  -8.744  -5.429   3.866
  Start of MODEL    1
   50   HG21  THR  32          HG22      THR  32 -10.401  -5.210   4.437
  Start of MODEL    1
   51   HG23  THR  32          HG23      THR  32  -9.406  -3.806   4.049
  Start of MODEL    1
   52    H    MET  33           H        MET  33 -13.308  -4.306   0.574
  Start of MODEL    1
   53    HA   MET  33           HA       MET  33 -12.117  -4.299  -1.861
  Start of MODEL    1
   54    HB2  MET  33           HB2      MET  33 -14.515  -4.820  -1.261
  Start of MODEL    1
   55    HB3  MET  33           HB3      MET  33 -14.836  -3.102  -1.391
  Start of MODEL    1
   56    HG2  MET  33           HG2      MET  33 -14.159  -3.114  -3.711
  Start of MODEL    1
   57    HG3  MET  33           HG3      MET  33 -13.754  -4.827  -3.604
  Start of MODEL    1
   58    HE2  MET  33           HE1      MET  33 -16.944  -4.871  -5.853
  Start of MODEL    1
   59    HE1  MET  33           HE2      MET  33 -15.266  -5.391  -5.694
  Start of MODEL    1
   60    HE3  MET  33           HE3      MET  33 -15.648  -3.676  -5.853
  Start of MODEL    1
   61    H    PHE  34           H        PHE  34 -13.686  -1.368  -0.454
  Start of MODEL    1
   62    HA   PHE  34           HA       PHE  34 -12.175   0.168  -2.451
  Start of MODEL    1
   63    HB2  PHE  34           HB2      PHE  34 -14.736   0.724  -0.982
  Start of MODEL    1
   64    HB3  PHE  34           HB3      PHE  34 -13.828   2.023  -1.747
  Start of MODEL    1
   65    HD1  PHE  34           HD1      PHE  34 -15.912  -0.924  -2.293
  Start of MODEL    1
   66    HD2  PHE  34           HD2      PHE  34 -13.635   2.156  -4.143
  Start of MODEL    1
   67    HE1  PHE  34           HE1      PHE  34 -16.990  -1.423  -4.446
  Start of MODEL    1
   68    HE2  PHE  34           HE2      PHE  34 -14.702   1.664  -6.296
  Start of MODEL    1
   69    HZ   PHE  34           HZ       PHE  34 -16.385  -0.130  -6.458
  Start of MODEL    1
   70    H    THR  35           H        THR  35 -11.741  -0.777   0.615
  Start of MODEL    1
   71    HA   THR  35           HA       THR  35 -10.874   1.864   1.563
  Start of MODEL    1
   72    HB   THR  35           HB       THR  35 -10.743   0.660   3.815
  Start of MODEL    1
   73    HG1  THR  35           HG1      THR  35 -12.023  -1.250   3.921
  Start of MODEL    1
   74   HG23  THR  35          HG21      THR  35 -12.517   2.250   3.202
  Start of MODEL    1
   75   HG22  THR  35          HG22      THR  35 -13.136   0.936   4.204
  Start of MODEL    1
   76   HG21  THR  35          HG23      THR  35 -13.433   0.935   2.464
  Start of MODEL    1
   77    H    LYS  36           H        LYS  36  -9.619  -1.251   0.585
  Start of MODEL    1
   78    HA   LYS  36           HA       LYS  36  -7.138  -0.946   2.031
  Start of MODEL    1
   79    HB2  LYS  36           HB2      LYS  36  -8.358  -3.129   1.518
  Start of MODEL    1
   80    HB3  LYS  36           HB3      LYS  36  -7.836  -2.918  -0.144
  Start of MODEL    1
   81    HG2  LYS  36           HG2      LYS  36  -5.481  -2.901   0.688
  Start of MODEL    1
   82    HG3  LYS  36           HG3      LYS  36  -6.115  -3.354   2.274
  Start of MODEL    1
   83    HD2  LYS  36           HD2      LYS  36  -7.230  -5.308   1.172
  Start of MODEL    1
   84    HD3  LYS  36           HD3      LYS  36  -6.360  -4.895  -0.303
  Start of MODEL    1
   85    HE2  LYS  36           HE2      LYS  36  -5.089  -6.581   0.737
  Start of MODEL    1
   86    HE3  LYS  36           HE3      LYS  36  -4.238  -5.072   1.060
  Start of MODEL    1
   87    HZ1  LYS  36           HZ1      LYS  36  -5.338  -5.011   3.248
  Start of MODEL    1
   88    HZ3  LYS  36           HZ2      LYS  36  -4.336  -6.363   3.053
  Start of MODEL    1
   89    HZ2  LYS  36           HZ3      LYS  36  -6.015  -6.530   2.939
  Start of MODEL    1
   90    H    ILE  37           H        ILE  37  -5.702   0.475   1.289
  Start of MODEL    1
   91    HA   ILE  37           HA       ILE  37  -5.441   0.920  -1.599
  Start of MODEL    1
   92    HB   ILE  37           HB       ILE  37  -4.415   2.507   0.762
  Start of MODEL    1
   93   HD12  ILE  37          HD11      ILE  37  -6.962   5.156  -0.072
  Start of MODEL    1
   94   HD11  ILE  37          HD12      ILE  37  -5.292   5.170  -0.640
  Start of MODEL    1
   95   HD13  ILE  37          HD13      ILE  37  -5.649   4.776   1.040
  Start of MODEL    1
   96    H    PHE  38           H        PHE  38  -3.668   0.289  -2.708
  Start of MODEL    1
   97    HA   PHE  38           HA       PHE  38  -1.410  -0.815  -1.197
  Start of MODEL    1
   98    HB2  PHE  38           HB2      PHE  38  -2.230  -2.351  -2.868
  Start of MODEL    1
   99    HB3  PHE  38           HB3      PHE  38  -2.198  -1.101  -4.109
  Start of MODEL    1
  100    HD1  PHE  38           HD1      PHE  38  -0.376  -0.977  -5.523
  Start of MODEL    1
  101    HD2  PHE  38           HD2      PHE  38   0.076  -2.867  -1.738
  Start of MODEL    1
  102    HE1  PHE  38           HE1      PHE  38   1.922  -1.611  -6.118
  Start of MODEL    1
  103    HE2  PHE  38           HE2      PHE  38   2.376  -3.503  -2.327
  Start of MODEL    1
  104    HZ   PHE  38           HZ       PHE  38   3.302  -2.878  -4.520
  Start of MODEL    1
  105    H    VAL  39           H        VAL  39   0.464   0.282  -1.083
  Start of MODEL    1
  106    HA   VAL  39           HA       VAL  39   0.771   2.610  -2.861
  Start of MODEL    1
  107    HB   VAL  39           HB       VAL  39   2.245   2.200  -0.265
  Start of MODEL    1
  108    H    GLY  40           H        GLY  40   2.476   2.709  -4.166
  Start of MODEL    1
  109    HA2  GLY  40           HA2      GLY  40   4.528   0.592  -3.921
  Start of MODEL    1
  110    HA3  GLY  40           HA3      GLY  40   3.764   0.942  -5.465
  Start of MODEL    1
  111    H    GLY  41           H        GLY  41   6.544   1.050  -5.036
  Start of MODEL    1
  112    HA2  GLY  41           HA2      GLY  41   8.238   2.412  -5.813
  Start of MODEL    1
  113    HA3  GLY  41           HA3      GLY  41   7.035   3.657  -6.107
  Start of MODEL    1
  114    H    LEU  42           H        LEU  42   7.436   2.187  -2.985
  Start of MODEL    1
  115    HA   LEU  42           HA       LEU  42   8.010   4.782  -1.837
  Start of MODEL    1
  116    HB2  LEU  42           HB2      LEU  42   7.495   2.069  -0.625
  Start of MODEL    1
  117    HB3  LEU  42           HB3      LEU  42   7.866   3.489   0.330
  Start of MODEL    1
  118    HG   LEU  42           HG       LEU  42   5.459   3.168  -1.466
  Start of MODEL    1
  119   HD13  LEU  42          HD11      LEU  42   5.369   1.770   0.541
  Start of MODEL    1
  120   HD12  LEU  42          HD12      LEU  42   4.196   3.086   0.610
  Start of MODEL    1
  121   HD11  LEU  42          HD13      LEU  42   5.692   3.187   1.539
  Start of MODEL    1
  122   HD23  LEU  42          HD21      LEU  42   6.171   5.383   0.456
  Start of MODEL    1
  123   HD22  LEU  42          HD22      LEU  42   4.711   5.270  -0.529
  Start of MODEL    1
  124   HD21  LEU  42          HD23      LEU  42   6.282   5.491  -1.301
  Start of MODEL    1
  125    HA   PRO  43           HA       PRO  43  12.430   4.024  -1.575
  Start of MODEL    1
  126    HB2  PRO  43           HB2      PRO  43  12.851   5.944   0.374
  Start of MODEL    1
  127    HB3  PRO  43           HB3      PRO  43  12.867   6.248  -1.363
  Start of MODEL    1
  128    HG2  PRO  43           HG2      PRO  43  10.715   6.754   0.629
  Start of MODEL    1
  129    HG3  PRO  43           HG3      PRO  43  11.168   7.692  -0.805
  Start of MODEL    1
  130    HD2  PRO  43           HD2      PRO  43   8.997   6.061  -0.740
  Start of MODEL    1
  131    HD3  PRO  43           HD3      PRO  43   9.933   6.361  -2.219
  Start of MODEL    1
  132    H    TYR  44           H        TYR  44  13.688   2.846  -0.105
  Start of MODEL    1
  133    HA   TYR  44           HA       TYR  44  12.201   1.220   1.638
  Start of MODEL    1
  134    HB2  TYR  44           HB2      TYR  44  15.193   1.549   1.391
  Start of MODEL    1
  135    HB3  TYR  44           HB3      TYR  44  14.402   0.270   2.306
  Start of MODEL    1
  136    HD1  TYR  44           HD1      TYR  44  12.409  -0.875   0.740
  Start of MODEL    1
  137    HD2  TYR  44           HD2      TYR  44  16.060   0.839  -0.617
  Start of MODEL    1
  138    HE1  TYR  44           HE1      TYR  44  12.302  -2.277  -1.279
  Start of MODEL    1
  139    HE2  TYR  44           HE2      TYR  44  15.963  -0.553  -2.642
  Start of MODEL    1
  140    HH   TYR  44           HH       TYR  44  13.193  -2.256  -3.591
  Start of MODEL    1
  141    H    HIS  45           H        HIS  45  13.803   4.220   2.193
  Start of MODEL    1
  142    HA   HIS  45           HA       HIS  45  13.943   3.881   5.037
  Start of MODEL    1
  143    HB2  HIS  45           HB2      HIS  45  14.623   6.220   5.159
  Start of MODEL    1
  144    HB3  HIS  45           HB3      HIS  45  15.567   5.330   3.978
  Start of MODEL    1
  145    HD1  HIS  45           HD1      HIS  45  13.224   8.208   4.310
  Start of MODEL    1
  146    HD2  HIS  45           HD2      HIS  45  15.098   6.063   1.304
  Start of MODEL    1
  147    HE1  HIS  45           HE1      HIS  45  13.135   9.679   2.282
  Start of MODEL    1
  148    HE2  HIS  45           HE2      HIS  45  14.540   8.480   0.569
  Start of MODEL    1
  149    H    THR  46           H        THR  46  11.353   4.835   2.934
  Start of MODEL    1
  150    HA   THR  46           HA       THR  46   9.887   6.474   4.556
  Start of MODEL    1
  151    HB   THR  46           HB       THR  46   8.799   4.182   2.903
  Start of MODEL    1
  152    HG1  THR  46           HG1      THR  46   8.756   6.736   1.864
  Start of MODEL    1
  153   HG22  THR  46          HG21      THR  46   6.775   5.513   2.724
  Start of MODEL    1
  154   HG21  THR  46          HG22      THR  46   7.494   6.788   3.704
  Start of MODEL    1
  155   HG23  THR  46          HG23      THR  46   7.143   5.218   4.424
  Start of MODEL    1
  156    H    SER  47           H        SER  47   8.549   6.204   6.366
  Start of MODEL    1
  157    HA   SER  47           HA       SER  47   8.624   3.540   7.596
  Start of MODEL    1
  158    HB2  SER  47           HB2      SER  47   8.365   4.712   9.754
  Start of MODEL    1
  159    HB3  SER  47           HB3      SER  47   9.788   5.286   8.886
  Start of MODEL    1
  160    HG   SER  47           HG       SER  47   8.940   7.203   8.821
  Start of MODEL    1
  161    H    ASP  48           H        ASP  48   6.749   2.933   8.858
  Start of MODEL    1
  162    HA   ASP  48           HA       ASP  48   4.281   3.097   7.677
  Start of MODEL    1
  163    HB2  ASP  48           HB2      ASP  48   4.634   2.905  10.666
  Start of MODEL    1
  164    HB3  ASP  48           HB3      ASP  48   3.399   2.143   9.669
  Start of MODEL    1
  165    H    LYS  49           H        LYS  49   5.708   5.268  10.058
  Start of MODEL    1
  166    HA   LYS  49           HA       LYS  49   3.324   6.707  10.613
  Start of MODEL    1
  167    HB2  LYS  49           HB2      LYS  49   5.411   6.639  12.058
  Start of MODEL    1
  168    HB3  LYS  49           HB3      LYS  49   6.133   7.758  10.912
  Start of MODEL    1
  169    HG2  LYS  49           HG2      LYS  49   4.473   9.426  11.412
  Start of MODEL    1
  170    HG3  LYS  49           HG3      LYS  49   3.600   8.293  12.444
  Start of MODEL    1
  171    HD2  LYS  49           HD2      LYS  49   4.840   9.696  13.896
  Start of MODEL    1
  172    HD3  LYS  49           HD3      LYS  49   5.691   8.151  13.849
  Start of MODEL    1
  173    HE2  LYS  49           HE2      LYS  49   7.335   9.852  13.697
  Start of MODEL    1
  174    HE3  LYS  49           HE3      LYS  49   7.187   9.139  12.092
  Start of MODEL    1
  175    HZ2  LYS  49           HZ1      LYS  49   6.124  11.748  13.027
  Start of MODEL    1
  176    HZ1  LYS  49           HZ2      LYS  49   5.643  11.032  11.571
  Start of MODEL    1
  177    HZ3  LYS  49           HZ3      LYS  49   7.261  11.467  11.803
  Start of MODEL    1
  178    H    THR  50           H        THR  50   5.920   7.081   8.249
  Start of MODEL    1
  179    HA   THR  50           HA       THR  50   5.194   9.620   7.274
  Start of MODEL    1
  180    HB   THR  50           HB       THR  50   6.479   7.317   5.770
  Start of MODEL    1
  181    HG1  THR  50           HG1      THR  50   8.306   9.049   6.225
  Start of MODEL    1
  182   HG21  THR  50          HG21      THR  50   5.498   9.039   4.283
  Start of MODEL    1
  183   HG23  THR  50          HG22      THR  50   7.258   8.980   4.188
  Start of MODEL    1
  184   HG22  THR  50          HG23      THR  50   6.469  10.264   5.102
  Start of MODEL    1
  185    H    LEU  51           H        LEU  51   4.066   6.371   6.470
  Start of MODEL    1
  186    HA   LEU  51           HA       LEU  51   2.392   7.238   4.300
  Start of MODEL    1
  187    HB2  LEU  51           HB2      LEU  51   2.372   4.699   5.934
  Start of MODEL    1
  188    HB3  LEU  51           HB3      LEU  51   1.287   4.997   4.590
  Start of MODEL    1
  189    HG   LEU  51           HG       LEU  51   4.292   4.733   4.461
  Start of MODEL    1
  190   HD13  LEU  51          HD11      LEU  51   3.055   2.637   4.679
  Start of MODEL    1
  191   HD12  LEU  51          HD12      LEU  51   3.801   2.789   3.088
  Start of MODEL    1
  192   HD11  LEU  51          HD13      LEU  51   2.071   3.073   3.282
  Start of MODEL    1
  193   HD22  LEU  51          HD21      LEU  51   4.063   5.042   2.052
  Start of MODEL    1
  194   HD21  LEU  51          HD22      LEU  51   3.526   6.474   2.924
  Start of MODEL    1
  195   HD23  LEU  51          HD23      LEU  51   2.341   5.362   2.247
  Start of MODEL    1
  196    H    HIS  52           H        HIS  52   1.902   6.458   7.684
  Start of MODEL    1
  197    HA   HIS  52           HA       HIS  52  -0.820   6.878   7.905
  Start of MODEL    1
  198    HB2  HIS  52           HB2      HIS  52   0.499   6.002   9.748
  Start of MODEL    1
  199    HB3  HIS  52           HB3      HIS  52   1.363   7.527   9.901
  Start of MODEL    1
  200    HD1  HIS  52           HD1      HIS  52   0.372   9.237  11.468
  Start of MODEL    1
  201    HD2  HIS  52           HD2      HIS  52  -2.308   6.202  10.485
  Start of MODEL    1
  202    HE1  HIS  52           HE1      HIS  52  -1.618   9.570  12.966
  Start of MODEL    1
  203    HE2  HIS  52           HE2      HIS  52  -3.324   7.920  12.138
  Start of MODEL    1
  204    H    GLU  53           H        GLU  53   1.717   9.346   8.520
  Start of MODEL    1
  205    HA   GLU  53           HA       GLU  53  -0.019  11.452   8.998
  Start of MODEL    1
  206    HB2  GLU  53           HB2      GLU  53   2.706  11.658   7.707
  Start of MODEL    1
  207    HB3  GLU  53           HB3      GLU  53   1.868  12.921   8.584
  Start of MODEL    1
  208    HG2  GLU  53           HG2      GLU  53   2.991  10.375   9.709
  Start of MODEL    1
  209    HG3  GLU  53           HG3      GLU  53   3.593  12.011   9.957
  Start of MODEL    1
  210    H    TYR  54           H        TYR  54   1.397  10.456   5.897
  Start of MODEL    1
  211    HA   TYR  54           HA       TYR  54   0.490  12.772   4.515
  Start of MODEL    1
  212    HB2  TYR  54           HB2      TYR  54   2.415  11.227   3.855
  Start of MODEL    1
  213    HB3  TYR  54           HB3      TYR  54   1.188  10.155   3.192
  Start of MODEL    1
  214    HD1  TYR  54           HD1      TYR  54   0.140  10.633   1.101
  Start of MODEL    1
  215    HD2  TYR  54           HD2      TYR  54   2.731  13.492   2.896
  Start of MODEL    1
  216    HE1  TYR  54           HE1      TYR  54   0.171  11.914  -0.994
  Start of MODEL    1
  217    HE2  TYR  54           HE2      TYR  54   2.767  14.781   0.801
  Start of MODEL    1
  218    HH   TYR  54           HH       TYR  54   0.624  14.076  -1.833
  Start of MODEL    1
  219    H    PHE  55           H        PHE  55  -0.651   9.384   4.445
  Start of MODEL    1
  220    HA   PHE  55           HA       PHE  55  -2.819   9.966   2.751
  Start of MODEL    1
  221    HB2  PHE  55           HB2      PHE  55  -2.136   7.584   4.434
  Start of MODEL    1
  222    HB3  PHE  55           HB3      PHE  55  -3.634   7.661   3.513
  Start of MODEL    1
  223    HD1  PHE  55           HD1      PHE  55  -0.069   7.131   3.375
  Start of MODEL    1
  224    HD2  PHE  55           HD2      PHE  55  -3.544   7.893   1.039
  Start of MODEL    1
  225    HE1  PHE  55           HE1      PHE  55   1.121   6.386   1.357
  Start of MODEL    1
  226    HE2  PHE  55           HE2      PHE  55  -2.357   7.148  -0.978
  Start of MODEL    1
  227    HZ   PHE  55           HZ       PHE  55  -0.022   6.391  -0.819
  Start of MODEL    1
  228    H    GLU  56           H        GLU  56  -2.588  10.127   6.261
  Start of MODEL    1
  229    HA   GLU  56           HA       GLU  56  -5.379   9.820   6.679
  Start of MODEL    1
  230    HB2  GLU  56           HB2      GLU  56  -5.040  10.489   8.934
  Start of MODEL    1
  231    HB3  GLU  56           HB3      GLU  56  -3.637   9.539   8.467
  Start of MODEL    1
  232    HG2  GLU  56           HG2      GLU  56  -2.231  11.373   8.460
  Start of MODEL    1
  233    HG3  GLU  56           HG3      GLU  56  -3.560  12.522   8.285
  Start of MODEL    1
  234    H    GLN  57           H        GLN  57  -3.542  12.353   5.406
  Start of MODEL    1
  235    HA   GLN  57           HA       GLN  57  -5.082  14.577   6.194
  Start of MODEL    1
  236    HB2  GLN  57           HB2      GLN  57  -3.365  14.104   3.762
  Start of MODEL    1
  237    HB3  GLN  57           HB3      GLN  57  -4.119  15.649   4.123
  Start of MODEL    1
  238    HG2  GLN  57           HG2      GLN  57  -2.882  15.738   6.240
  Start of MODEL    1
  239    HG3  GLN  57           HG3      GLN  57  -2.105  14.208   5.833
  Start of MODEL    1
  240   HE21  GLN  57          HE21      GLN  57  -1.850  14.818   3.021
  Start of MODEL    1
  241   HE22  GLN  57          HE22      GLN  57  -0.605  16.013   2.868
  Start of MODEL    1
  242    H    PHE  58           H        PHE  58  -5.904  11.988   4.180
  Start of MODEL    1
  243    HA   PHE  58           HA       PHE  58  -7.795  13.542   2.599
  Start of MODEL    1
  244    HB2  PHE  58           HB2      PHE  58  -7.157  10.586   2.598
  Start of MODEL    1
  245    HB3  PHE  58           HB3      PHE  58  -8.314  11.356   1.522
  Start of MODEL    1
  246    HD1  PHE  58           HD1      PHE  58  -4.739  11.116   2.400
  Start of MODEL    1
  247    HD2  PHE  58           HD2      PHE  58  -7.608  12.541  -0.400
  Start of MODEL    1
  248    HE1  PHE  58           HE1      PHE  58  -2.929  11.614   0.809
  Start of MODEL    1
  249    HE2  PHE  58           HE2      PHE  58  -5.801  13.046  -1.994
  Start of MODEL    1
  250    HZ   PHE  58           HZ       PHE  58  -3.459  12.578  -1.392
  Start of MODEL    1
  251    H    GLY  59           H        GLY  59  -7.710  11.829   5.539
  Start of MODEL    1
  252    HA2  GLY  59           HA2      GLY  59 -10.233  12.504   6.399
  Start of MODEL    1
  253    HA3  GLY  59           HA3      GLY  59 -10.450  10.976   5.564
  Start of MODEL    1
  254    H    ASP  60           H        ASP  60 -10.216   9.185   6.721
  Start of MODEL    1
  255    HA   ASP  60           HA       ASP  60  -8.547   9.270   9.144
  Start of MODEL    1
  256    HB2  ASP  60           HB2      ASP  60 -11.354   8.220   8.859
  Start of MODEL    1
  257    HB3  ASP  60           HB3      ASP  60 -10.281   7.636  10.124
  Start of MODEL    1
  258    H    ILE  61           H        ILE  61  -7.292   7.495   9.514
  Start of MODEL    1
  259    HA   ILE  61           HA       ILE  61  -7.469   5.314   7.566
  Start of MODEL    1
  260    HB   ILE  61           HB       ILE  61  -5.171   6.561   9.026
  Start of MODEL    1
  261   HD11  ILE  61          HD11      ILE  61  -3.141   6.135   6.877
  Start of MODEL    1
  262   HD13  ILE  61          HD12      ILE  61  -3.630   7.736   7.436
  Start of MODEL    1
  263   HD12  ILE  61          HD13      ILE  61  -3.710   7.339   5.721
  Start of MODEL    1
  264    H    GLU  62           H        GLU  62  -7.617   3.256   8.190
  Start of MODEL    1
  265    HA   GLU  62           HA       GLU  62  -8.210   2.575  10.921
  Start of MODEL    1
  266    HB2  GLU  62           HB2      GLU  62  -7.964   1.061   8.334
  Start of MODEL    1
  267    HB3  GLU  62           HB3      GLU  62  -8.101   0.205   9.851
  Start of MODEL    1
  268    HG2  GLU  62           HG2      GLU  62 -10.109   2.176   8.781
  Start of MODEL    1
  269    HG3  GLU  62           HG3      GLU  62 -10.240   0.424   8.659
  Start of MODEL    1
  270    H    GLU  63           H        GLU  63  -5.705   1.822   8.555
  Start of MODEL    1
  271    HA   GLU  63           HA       GLU  63  -3.651   1.527  10.571
  Start of MODEL    1
  272    HB2  GLU  63           HB2      GLU  63  -4.756  -0.700  10.566
  Start of MODEL    1
  273    HB3  GLU  63           HB3      GLU  63  -4.439  -0.838   8.843
  Start of MODEL    1
  274    HG2  GLU  63           HG2      GLU  63  -2.841  -2.123  10.106
  Start of MODEL    1
  275    HG3  GLU  63           HG3      GLU  63  -2.035  -0.786   9.286
  Start of MODEL    1
  276    H    ALA  64           H        ALA  64  -1.635   1.981   9.711
  Start of MODEL    1
  277    HA   ALA  64           HA       ALA  64  -1.360   2.028   6.791
  Start of MODEL    1
  278    HB2  ALA  64           HB1      ALA  64  -0.309   4.245   6.864
  Start of MODEL    1
  279    HB1  ALA  64           HB2      ALA  64  -0.655   4.354   8.591
  Start of MODEL    1
  280    HB3  ALA  64           HB3      ALA  64  -1.979   4.307   7.427
  Start of MODEL    1
  281    H    VAL  65           H        VAL  65   0.328   0.829   6.346
  Start of MODEL    1
  282    HA   VAL  65           HA       VAL  65   2.680   0.889   8.105
  Start of MODEL    1
  283    HB   VAL  65           HB       VAL  65   2.886  -1.569   8.034
  Start of MODEL    1
  284    H    VAL  66           H        VAL  66   4.628   0.319   7.150
  Start of MODEL    1
  285    HA   VAL  66           HA       VAL  66   4.621   0.085   4.218
  Start of MODEL    1
  286    HB   VAL  66           HB       VAL  66   6.992   0.427   6.083
  Start of MODEL    1
  287    H    ILE  67           H        ILE  67   5.393  -1.812   3.214
  Start of MODEL    1
  288    HA   ILE  67           HA       ILE  67   4.935  -4.080   4.969
  Start of MODEL    1
  289    HB   ILE  67           HB       ILE  67   5.117  -3.946   1.960
  Start of MODEL    1
  290   HD11  ILE  67          HD11      ILE  67   3.036  -3.850   5.044
  Start of MODEL    1
  291   HD13  ILE  67          HD12      ILE  67   2.480  -5.355   4.310
  Start of MODEL    1
  292   HD12  ILE  67          HD13      ILE  67   1.492  -3.897   4.193
  Start of MODEL    1
  293    H    THR  68           H        THR  68   6.386  -5.441   5.610
  Start of MODEL    1
  294    HA   THR  68           HA       THR  68   9.053  -5.371   4.386
  Start of MODEL    1
  295    HB   THR  68           HB       THR  68   9.995  -5.870   6.613
  Start of MODEL    1
  296    HG1  THR  68           HG1      THR  68   7.823  -5.125   8.080
  Start of MODEL    1
  297   HG22  THR  68          HG21      THR  68   9.608  -3.688   7.696
  Start of MODEL    1
  298   HG21  THR  68          HG22      THR  68   8.260  -3.396   6.594
  Start of MODEL    1
  299   HG23  THR  68          HG23      THR  68   9.902  -3.530   5.963
  Start of MODEL    1
  300    H    ASP  69           H        ASP  69  10.063  -7.441   4.143
  Start of MODEL    1
  301    HA   ASP  69           HA       ASP  69   8.469  -9.691   3.891
  Start of MODEL    1
  302    HB2  ASP  69           HB2      ASP  69  10.664  -9.593   2.860
  Start of MODEL    1
  303    HB3  ASP  69           HB3      ASP  69  11.441  -9.487   4.438
  Start of MODEL    1
  304    H    ARG  70           H        ARG  70   7.637 -11.108   5.308
  Start of MODEL    1
  305    HA   ARG  70           HA       ARG  70   7.579 -10.400   8.009
  Start of MODEL    1
  306    HB2  ARG  70           HB2      ARG  70   6.156 -12.280   8.371
  Start of MODEL    1
  307    HB3  ARG  70           HB3      ARG  70   5.719 -11.508   6.855
  Start of MODEL    1
  308    HG2  ARG  70           HG2      ARG  70   5.639 -13.728   6.302
  Start of MODEL    1
  309    HG3  ARG  70           HG3      ARG  70   7.286 -13.304   5.819
  Start of MODEL    1
  310    HD2  ARG  70           HD2      ARG  70   7.376 -15.364   7.042
  Start of MODEL    1
  311    HD3  ARG  70           HD3      ARG  70   8.069 -14.065   8.024
  Start of MODEL    1
  312    HE   ARG  70           HE       ARG  70   5.298 -14.458   8.583
  Start of MODEL    1
  313   HH11  ARG  70          HH11      ARG  70   8.487 -15.757   9.247
  Start of MODEL    1
  314   HH12  ARG  70          HH12      ARG  70   8.034 -16.401  10.789
  Start of MODEL    1
  315   HH21  ARG  70          HH21      ARG  70   4.710 -15.307  10.598
  Start of MODEL    1
  316   HH22  ARG  70          HH22      ARG  70   5.895 -16.141  11.569
  Start of MODEL    1
  317    H    ASN  71           H        ASN  71   9.907 -12.292   6.380
  Start of MODEL    1
  318    HA   ASN  71           HA       ASN  71  10.617 -13.796   8.763
  Start of MODEL    1
  319    HB2  ASN  71           HB2      ASN  71  12.180 -13.618   6.185
  Start of MODEL    1
  320    HB3  ASN  71           HB3      ASN  71  12.271 -14.872   7.417
  Start of MODEL    1
  321   HD21  ASN  71          HD21      ASN  71  10.551 -13.651   4.686
  Start of MODEL    1
  322   HD22  ASN  71          HD22      ASN  71   9.492 -15.014   4.481
  Start of MODEL    1
  323    H    THR  72           H        THR  72  12.204 -11.404   6.641
  Start of MODEL    1
  324    HA   THR  72           HA       THR  72  14.289 -11.011   8.635
  Start of MODEL    1
  325    HB   THR  72           HB       THR  72  15.303  -9.545   6.864
  Start of MODEL    1
  326    HG1  THR  72           HG1      THR  72  13.492 -10.590   4.994
  Start of MODEL    1
  327   HG23  THR  72          HG21      THR  72  15.974 -11.862   7.009
  Start of MODEL    1
  328   HG22  THR  72          HG22      THR  72  15.817 -11.416   5.309
  Start of MODEL    1
  329   HG21  THR  72          HG23      THR  72  14.555 -12.370   6.091
  Start of MODEL    1
  330    H    GLN  73           H        GLN  73  11.411  -9.555   7.700
  Start of MODEL    1
  331    HA   GLN  73           HA       GLN  73  10.249  -7.715   8.412
  Start of MODEL    1
  332    HB2  GLN  73           HB2      GLN  73  12.445  -7.569  10.485
  Start of MODEL    1
  333    HB3  GLN  73           HB3      GLN  73  10.935  -6.665  10.542
  Start of MODEL    1
  334    HG2  GLN  73           HG2      GLN  73   9.683  -8.764  10.656
  Start of MODEL    1
  335    HG3  GLN  73           HG3      GLN  73  11.199  -9.667  10.599
  Start of MODEL    1
  336   HE21  GLN  73          HE21      GLN  73   9.179  -7.557  12.519
  Start of MODEL    1
  337   HE22  GLN  73          HE22      GLN  73   9.932  -7.901  14.038
  Start of MODEL    1
  338    H    LYS  74           H        LYS  74  12.257  -7.510   6.379
  Start of MODEL    1
  339    HA   LYS  74           HA       LYS  74  13.281  -4.780   6.740
  Start of MODEL    1
  340    HB2  LYS  74           HB2      LYS  74  14.072  -6.894   4.717
  Start of MODEL    1
  341    HB3  LYS  74           HB3      LYS  74  14.781  -5.289   4.838
  Start of MODEL    1
  342    HG2  LYS  74           HG2      LYS  74  14.872  -7.352   7.030
  Start of MODEL    1
  343    HG3  LYS  74           HG3      LYS  74  16.156  -7.080   5.850
  Start of MODEL    1
  344    HD2  LYS  74           HD2      LYS  74  16.426  -4.795   6.632
  Start of MODEL    1
  345    HD3  LYS  74           HD3      LYS  74  15.092  -5.004   7.766
  Start of MODEL    1
  346    HE2  LYS  74           HE2      LYS  74  17.586  -6.691   7.821
  Start of MODEL    1
  347    HE3  LYS  74           HE3      LYS  74  17.413  -5.197   8.743
  Start of MODEL    1
  348    HZ3  LYS  74           HZ1      LYS  74  15.711  -6.115  10.040
  Start of MODEL    1
  349    HZ2  LYS  74           HZ2      LYS  74  16.870  -7.345   9.934
  Start of MODEL    1
  350    HZ1  LYS  74           HZ3      LYS  74  15.468  -7.419   8.987
  Start of MODEL    1
  351    H    SER  75           H        SER  75  12.755  -3.170   5.290
  Start of MODEL    1
  352    HA   SER  75           HA       SER  75  10.152  -3.213   4.304
  Start of MODEL    1
  353    HB2  SER  75           HB2      SER  75  12.365  -1.336   3.458
  Start of MODEL    1
  354    HB3  SER  75           HB3      SER  75  10.628  -1.018   3.430
  Start of MODEL    1
  355    HG   SER  75           HG       SER  75  11.515  -0.097   5.276
  Start of MODEL    1
  356    H    ARG  76           H        ARG  76   9.242  -3.758   2.429
  Start of MODEL    1
  357    HA   ARG  76           HA       ARG  76  10.951  -4.821   0.301
  Start of MODEL    1
  358    HB2  ARG  76           HB2      ARG  76   7.985  -5.009   0.812
  Start of MODEL    1
  359    HB3  ARG  76           HB3      ARG  76   8.735  -5.597  -0.663
  Start of MODEL    1
  360    HG2  ARG  76           HG2      ARG  76  10.148  -7.101   0.727
  Start of MODEL    1
  361    HG3  ARG  76           HG3      ARG  76   9.216  -6.589   2.139
  Start of MODEL    1
  362    HD2  ARG  76           HD2      ARG  76   7.184  -7.430   1.161
  Start of MODEL    1
  363    HD3  ARG  76           HD3      ARG  76   8.012  -7.809  -0.345
  Start of MODEL    1
  364    HE   ARG  76           HE       ARG  76   9.254  -9.207   1.755
  Start of MODEL    1
  365   HH11  ARG  76          HH11      ARG  76   6.284  -9.171  -0.080
  Start of MODEL    1
  366   HH12  ARG  76          HH12      ARG  76   5.968 -10.865   0.139
  Start of MODEL    1
  367   HH21  ARG  76          HH21      ARG  76   8.836 -11.449   2.085
  Start of MODEL    1
  368   HH22  ARG  76          HH22      ARG  76   7.396 -12.153   1.406
  Start of MODEL    1
  369    H    GLY  77           H        GLY  77  10.212  -1.923   0.988
  Start of MODEL    1
  370    HA2  GLY  77           HA2      GLY  77  10.097   0.035  -0.217
  Start of MODEL    1
  371    HA3  GLY  77           HA3      GLY  77  10.306  -0.947  -1.651
  Start of MODEL    1
  372    H    TYR  78           H        TYR  78   7.553  -1.755   0.206
  Start of MODEL    1
  373    HA   TYR  78           HA       TYR  78   5.847   0.204  -1.060
  Start of MODEL    1
  374    HB2  TYR  78           HB2      TYR  78   4.315  -1.453  -2.045
  Start of MODEL    1
  375    HB3  TYR  78           HB3      TYR  78   5.903  -1.529  -2.792
  Start of MODEL    1
  376    HD1  TYR  78           HD1      TYR  78   3.524  -3.267  -0.592
  Start of MODEL    1
  377    HD2  TYR  78           HD2      TYR  78   7.266  -3.492  -2.596
  Start of MODEL    1
  378    HE1  TYR  78           HE1      TYR  78   3.575  -5.694  -0.207
  Start of MODEL    1
  379    HE2  TYR  78           HE2      TYR  78   7.339  -5.916  -2.210
  Start of MODEL    1
  380    HH   TYR  78           HH       TYR  78   4.613  -7.685  -1.158
  Start of MODEL    1
  381    H    GLY  79           H        GLY  79   3.503  -0.130  -0.249
  Start of MODEL    1
  382    HA2  GLY  79           HA2      GLY  79   3.463  -1.395   2.372
  Start of MODEL    1
  383    HA3  GLY  79           HA3      GLY  79   3.407   0.359   2.368
  Start of MODEL    1
  384    H    PHE  80           H        PHE  80   1.391  -0.564   3.567
  Start of MODEL    1
  385    HA   PHE  80           HA       PHE  80  -0.814  -0.415   1.648
  Start of MODEL    1
  386    HB2  PHE  80           HB2      PHE  80  -0.449  -2.489   3.791
  Start of MODEL    1
  387    HB3  PHE  80           HB3      PHE  80  -2.056  -2.030   3.246
  Start of MODEL    1
  388    HD1  PHE  80           HD1      PHE  80   1.027  -3.766   2.377
  Start of MODEL    1
  389    HD2  PHE  80           HD2      PHE  80  -2.813  -2.553   1.016
  Start of MODEL    1
  390    HE1  PHE  80           HE1      PHE  80   1.192  -5.355   0.511
  Start of MODEL    1
  391    HE2  PHE  80           HE2      PHE  80  -2.660  -4.139  -0.852
  Start of MODEL    1
  392    HZ   PHE  80           HZ       PHE  80  -0.650  -5.546  -1.106
  Start of MODEL    1
  393    H    VAL  81           H        VAL  81  -2.429   0.763   2.206
  Start of MODEL    1
  394    HA   VAL  81           HA       VAL  81  -2.701   1.616   5.019
  Start of MODEL    1
  395    HB   VAL  81           HB       VAL  81  -3.167   3.382   2.604
  Start of MODEL    1
  396    H    THR  82           H        THR  82  -4.589   1.194   5.887
  Start of MODEL    1
  397    HA   THR  82           HA       THR  82  -6.811   0.476   4.101
  Start of MODEL    1
  398    HB   THR  82           HB       THR  82  -6.536  -0.188   7.041
  Start of MODEL    1
  399    HG1  THR  82           HG1      THR  82  -5.085  -1.162   5.086
  Start of MODEL    1
  400   HG23  THR  82          HG21      THR  82  -8.814  -0.270   6.120
  Start of MODEL    1
  401   HG22  THR  82          HG22      THR  82  -8.232  -1.877   6.559
  Start of MODEL    1
  402   HG21  THR  82          HG23      THR  82  -8.264  -1.381   4.865
  Start of MODEL    1
  403    H    MET  83           H        MET  83  -8.118   2.180   3.850
  Start of MODEL    1
  404    HA   MET  83           HA       MET  83  -8.083   4.332   5.779
  Start of MODEL    1
  405    HB2  MET  83           HB2      MET  83  -9.667   4.058   3.214
  Start of MODEL    1
  406    HB3  MET  83           HB3      MET  83  -9.493   5.523   4.170
  Start of MODEL    1
  407    HG2  MET  83           HG2      MET  83  -7.232   4.077   2.812
  Start of MODEL    1
  408    HG3  MET  83           HG3      MET  83  -8.070   5.489   2.168
  Start of MODEL    1
  409    HE2  MET  83           HE1      MET  83  -7.077   8.275   4.734
  Start of MODEL    1
  410    HE1  MET  83           HE2      MET  83  -8.547   7.304   4.671
  Start of MODEL    1
  411    HE3  MET  83           HE3      MET  83  -7.852   7.948   3.183
  Start of MODEL    1
  412    H    LYS  84           H        LYS  84  -9.865   5.151   6.834
  Start of MODEL    1
  413    HA   LYS  84           HA       LYS  84 -11.651   3.155   7.864
  Start of MODEL    1
  414    HB2  LYS  84           HB2      LYS  84 -10.531   5.027   9.154
  Start of MODEL    1
  415    HB3  LYS  84           HB3      LYS  84 -11.649   6.132   8.366
  Start of MODEL    1
  416    HG2  LYS  84           HG2      LYS  84 -13.528   5.051   9.416
  Start of MODEL    1
  417    HG3  LYS  84           HG3      LYS  84 -12.467   3.821  10.108
  Start of MODEL    1
  418    HD2  LYS  84           HD2      LYS  84 -12.245   6.769  10.687
  Start of MODEL    1
  419    HD3  LYS  84           HD3      LYS  84 -13.116   5.623  11.706
  Start of MODEL    1
  420    HE2  LYS  84           HE2      LYS  84 -10.207   5.291  10.998
  Start of MODEL    1
  421    HE3  LYS  84           HE3      LYS  84 -10.745   6.203  12.409
  Start of MODEL    1
  422    HZ2  LYS  84           HZ1      LYS  84 -10.214   3.964  13.041
  Start of MODEL    1
  423    HZ1  LYS  84           HZ2      LYS  84 -11.249   3.327  11.858
  Start of MODEL    1
  424    HZ3  LYS  84           HZ3      LYS  84 -11.891   4.182  13.175
  Start of MODEL    1
  425    H    ASP  85           H        ASP  85 -11.713   5.441   5.343
  Start of MODEL    1
  426    HA   ASP  85           HA       ASP  85 -14.547   4.928   4.850
  Start of MODEL    1
  427    HB2  ASP  85           HB2      ASP  85 -14.818   7.009   5.860
  Start of MODEL    1
  428    HB3  ASP  85           HB3      ASP  85 -13.256   7.596   5.305
  Start of MODEL    1
  429    H    ARG  86           H        ARG  86 -15.130   4.952   2.643
  Start of MODEL    1
  430    HA   ARG  86           HA       ARG  86 -13.090   4.258   0.851
  Start of MODEL    1
  431    HB2  ARG  86           HB2      ARG  86 -15.221   3.323   0.462
  Start of MODEL    1
  432    HB3  ARG  86           HB3      ARG  86 -16.007   4.895   0.478
  Start of MODEL    1
  433    HG2  ARG  86           HG2      ARG  86 -14.770   5.457  -1.612
  Start of MODEL    1
  434    HG3  ARG  86           HG3      ARG  86 -14.190   3.791  -1.651
  Start of MODEL    1
  435    HD2  ARG  86           HD2      ARG  86 -16.418   2.955  -1.873
  Start of MODEL    1
  436    HD3  ARG  86           HD3      ARG  86 -17.101   4.552  -1.585
  Start of MODEL    1
  437    HE   ARG  86           HE       ARG  86 -15.444   4.771  -3.812
  Start of MODEL    1
  438   HH11  ARG  86          HH11      ARG  86 -18.345   3.045  -2.869
  Start of MODEL    1
  439   HH12  ARG  86          HH12      ARG  86 -19.017   3.018  -4.473
  Start of MODEL    1
  440   HH21  ARG  86          HH21      ARG  86 -16.330   4.793  -5.928
  Start of MODEL    1
  441   HH22  ARG  86          HH22      ARG  86 -17.857   4.022  -6.224
  Start of MODEL    1
  442    H    ALA  87           H        ALA  87 -14.941   7.276   1.190
  Start of MODEL    1
  443    HA   ALA  87           HA       ALA  87 -14.078   8.450  -1.209
  Start of MODEL    1
  444    HB1  ALA  87           HB1      ALA  87 -14.845   9.848   1.348
  Start of MODEL    1
  445    HB3  ALA  87           HB2      ALA  87 -15.966   9.306   0.100
  Start of MODEL    1
  446    HB2  ALA  87           HB3      ALA  87 -14.789  10.570  -0.260
  Start of MODEL    1
  447    H    SER  88           H        SER  88 -12.742   8.458   2.036
  Start of MODEL    1
  448    HA   SER  88           HA       SER  88 -10.648  10.293   1.608
  Start of MODEL    1
  449    HB2  SER  88           HB2      SER  88 -10.642   7.907   3.477
  Start of MODEL    1
  450    HB3  SER  88           HB3      SER  88  -9.684   9.380   3.635
  Start of MODEL    1
  451    HG   SER  88           HG       SER  88 -12.533   9.352   3.650
  Start of MODEL    1
  452    H    ALA  89           H        ALA  89 -10.834   6.764   1.296
  Start of MODEL    1
  453    HA   ALA  89           HA       ALA  89  -8.164   6.316   0.534
  Start of MODEL    1
  454    HB1  ALA  89           HB1      ALA  89 -10.633   4.720  -0.160
  Start of MODEL    1
  455    HB3  ALA  89           HB2      ALA  89  -9.654   4.526   1.293
  Start of MODEL    1
  456    HB2  ALA  89           HB3      ALA  89  -8.967   4.155  -0.287
  Start of MODEL    1
  457    H    GLU  90           H        GLU  90 -11.087   6.932  -1.340
  Start of MODEL    1
  458    HA   GLU  90           HA       GLU  90  -9.887   6.435  -3.849
  Start of MODEL    1
  459    HB2  GLU  90           HB2      GLU  90 -12.360   6.355  -3.204
  Start of MODEL    1
  460    HB3  GLU  90           HB3      GLU  90 -12.353   8.099  -3.437
  Start of MODEL    1
  461    HG2  GLU  90           HG2      GLU  90 -11.755   7.870  -5.722
  Start of MODEL    1
  462    HG3  GLU  90           HG3      GLU  90 -11.457   6.138  -5.531
  Start of MODEL    1
  463    H    ARG  91           H        ARG  91 -10.473   9.434  -2.017
  Start of MODEL    1
  464    HA   ARG  91           HA       ARG  91  -9.594  11.201  -4.020
  Start of MODEL    1
  465    HB2  ARG  91           HB2      ARG  91  -9.253  11.473  -1.022
  Start of MODEL    1
  466    HB3  ARG  91           HB3      ARG  91  -9.073  12.775  -2.188
  Start of MODEL    1
  467    HG2  ARG  91           HG2      ARG  91 -11.588  11.271  -1.520
  Start of MODEL    1
  468    HG3  ARG  91           HG3      ARG  91 -11.211  12.948  -1.131
  Start of MODEL    1
  469    HD2  ARG  91           HD2      ARG  91 -11.355  11.919  -3.954
  Start of MODEL    1
  470    HD3  ARG  91           HD3      ARG  91 -12.749  12.586  -3.107
  Start of MODEL    1
  471    HE   ARG  91           HE       ARG  91 -10.808  14.496  -2.862
  Start of MODEL    1
  472   HH11  ARG  91          HH11      ARG  91 -12.354  12.838  -5.531
  Start of MODEL    1
  473   HH12  ARG  91          HH12      ARG  91 -12.204  14.191  -6.621
  Start of MODEL    1
  474   HH21  ARG  91          HH21      ARG  91 -10.649  16.292  -4.280
  Start of MODEL    1
  475   HH22  ARG  91          HH22      ARG  91 -11.253  16.152  -5.903
  Start of MODEL    1
  476    H    ALA  92           H        ALA  92  -7.840   9.373  -1.562
  Start of MODEL    1
  477    HA   ALA  92           HA       ALA  92  -5.261  10.299  -2.132
  Start of MODEL    1
  478    HB1  ALA  92           HB1      ALA  92  -5.851   8.929  -0.167
  Start of MODEL    1
  479    HB3  ALA  92           HB2      ALA  92  -4.457   8.297  -1.043
  Start of MODEL    1
  480    HB2  ALA  92           HB3      ALA  92  -6.035   7.531  -1.225
  Start of MODEL    1
  481    H    CYS  93           H        CYS  93  -7.253   7.891  -3.766
  Start of MODEL    1
  482    HA   CYS  93           HA       CYS  93  -5.072   6.935  -5.386
  Start of MODEL    1
  483    HB2  CYS  93           HB2      CYS  93  -8.045   6.478  -5.669
  Start of MODEL    1
  484    HB3  CYS  93           HB3      CYS  93  -6.774   5.574  -6.487
  Start of MODEL    1
  485    HG   CYS  93           HG       CYS  93  -7.373   5.594  -3.120
  Start of MODEL    1
  486    H    LYS  94           H        LYS  94  -7.231   9.608  -5.546
  Start of MODEL    1
  487    HA   LYS  94           HA       LYS  94  -7.444   9.810  -8.364
  Start of MODEL    1
  488    HB2  LYS  94           HB2      LYS  94  -8.559  11.073  -6.179
  Start of MODEL    1
  489    HB3  LYS  94           HB3      LYS  94  -7.537  12.324  -6.862
  Start of MODEL    1
  490    HG2  LYS  94           HG2      LYS  94  -9.589  10.786  -8.431
  Start of MODEL    1
  491    HG3  LYS  94           HG3      LYS  94  -9.899  12.336  -7.655
  Start of MODEL    1
  492    HD2  LYS  94           HD2      LYS  94  -7.774  11.867  -9.745
  Start of MODEL    1
  493    HD3  LYS  94           HD3      LYS  94  -9.387  12.496 -10.081
  Start of MODEL    1
  494    HE2  LYS  94           HE2      LYS  94  -8.904  14.345  -8.457
  Start of MODEL    1
  495    HE3  LYS  94           HE3      LYS  94  -7.239  13.765  -8.394
  Start of MODEL    1
  496    HZ1  LYS  94           HZ1      LYS  94  -8.655  14.725 -10.827
  Start of MODEL    1
  497    HZ3  LYS  94           HZ2      LYS  94  -7.062  14.143 -10.789
  Start of MODEL    1
  498    HZ2  LYS  94           HZ3      LYS  94  -7.463  15.571  -9.968
  Start of MODEL    1
  499    H    ASP  95           H        ASP  95  -5.145  10.972  -5.980
  Start of MODEL    1
  500    HA   ASP  95           HA       ASP  95  -3.442  11.995  -8.141
  Start of MODEL    1
  501    HB2  ASP  95           HB2      ASP  95  -3.754  13.437  -6.128
  Start of MODEL    1
  502    HB3  ASP  95           HB3      ASP  95  -3.035  12.169  -5.139
  Start of MODEL    1
  503    HA   PRO  96           HA       PRO  96  -2.160   7.685  -7.587
  Start of MODEL    1
  504    HB2  PRO  96           HB2      PRO  96  -1.057   7.352 -10.037
  Start of MODEL    1
  505    HB3  PRO  96           HB3      PRO  96  -2.798   7.288  -9.743
  Start of MODEL    1
  506    HG2  PRO  96           HG2      PRO  96  -1.139   9.536 -10.808
  Start of MODEL    1
  507    HG3  PRO  96           HG3      PRO  96  -2.729   8.968 -11.347
  Start of MODEL    1
  508    HD2  PRO  96           HD2      PRO  96  -2.397  11.142  -9.757
  Start of MODEL    1
  509    HD3  PRO  96           HD3      PRO  96  -3.838  10.109  -9.692
  Start of MODEL    1
  510    H    ASN  97           H        ASN  97  -0.178  10.450  -8.100
  Start of MODEL    1
  511    HA   ASN  97           HA       ASN  97   2.190   8.819  -7.497
  Start of MODEL    1
  512    HB2  ASN  97           HB2      ASN  97   1.983  10.960  -9.609
  Start of MODEL    1
  513    HB3  ASN  97           HB3      ASN  97   3.513  10.321  -9.022
  Start of MODEL    1
  514   HD21  ASN  97          HD21      ASN  97   2.542   7.603  -8.737
  Start of MODEL    1
  515   HD22  ASN  97          HD22      ASN  97   2.372   6.974 -10.346
  Start of MODEL    1
  516    HA   PRO  98           HA       PRO  98   1.961  12.598  -4.744
  Start of MODEL    1
  517    HB2  PRO  98           HB2      PRO  98   1.765  11.333  -2.374
  Start of MODEL    1
  518    HB3  PRO  98           HB3      PRO  98   0.349  11.718  -3.357
  Start of MODEL    1
  519    HG2  PRO  98           HG2      PRO  98   1.790   9.124  -3.043
  Start of MODEL    1
  520    HG3  PRO  98           HG3      PRO  98   0.050   9.435  -3.153
  Start of MODEL    1
  521    HD2  PRO  98           HD2      PRO  98   1.589   8.558  -5.244
  Start of MODEL    1
  522    HD3  PRO  98           HD3      PRO  98   0.078   9.468  -5.435
  Start of MODEL    1
  523    H    ILE  99           H        ILE  99   3.735  13.432  -3.672
  Start of MODEL    1
  524    HA   ILE  99           HA       ILE  99   6.181  11.912  -3.687
  Start of MODEL    1
  525    HB   ILE  99           HB       ILE  99   5.625  14.676  -2.586
  Start of MODEL    1
  526   HD12  ILE  99          HD11      ILE  99   7.150  14.034  -6.514
  Start of MODEL    1
  527   HD11  ILE  99          HD12      ILE  99   6.770  12.624  -5.527
  Start of MODEL    1
  528   HD13  ILE  99          HD13      ILE  99   8.177  13.615  -5.143
  Start of MODEL    1
  529    H    ILE 100           H        ILE 100   6.574  10.444  -2.167
  Start of MODEL    1
  530    HA   ILE 100           HA       ILE 100   5.795  11.063   0.606
  Start of MODEL    1
  531    HB   ILE 100           HB       ILE 100   5.900   8.347  -0.722
  Start of MODEL    1
  532   HD12  ILE 100          HD11      ILE 100   2.159   8.212  -0.670
  Start of MODEL    1
  533   HD11  ILE 100          HD12      ILE 100   3.141   7.571   0.647
  Start of MODEL    1
  534   HD13  ILE 100          HD13      ILE 100   3.606   7.269  -1.027
  Start of MODEL    1
  535    H    ASP 101           H        ASP 101   7.514  11.484   1.777
  Start of MODEL    1
  536    HA   ASP 101           HA       ASP 101   9.612  11.537   2.612
  Start of MODEL    1
  537    HB2  ASP 101           HB2      ASP 101   8.829   8.835   2.535
  Start of MODEL    1
  538    HB3  ASP 101           HB3      ASP 101  10.505   8.866   1.994
  Start of MODEL    1
  539    H    GLY 102           H        GLY 102   9.453  12.563   0.115
  Start of MODEL    1
  540    HA2  GLY 102           HA2      GLY 102  11.004  13.514  -1.292
  Start of MODEL    1
  541    HA3  GLY 102           HA3      GLY 102  12.217  12.441  -0.621
  Start of MODEL    1
  542    H    ARG 103           H        ARG 103   9.606  10.626  -1.722
  Start of MODEL    1
  543    HA   ARG 103           HA       ARG 103  10.724  10.444  -4.427
  Start of MODEL    1
  544    HB2  ARG 103           HB2      ARG 103  11.801   8.634  -3.243
  Start of MODEL    1
  545    HB3  ARG 103           HB3      ARG 103  10.261   8.086  -2.594
  Start of MODEL    1
  546    HG2  ARG 103           HG2      ARG 103   9.540   7.294  -4.689
  Start of MODEL    1
  547    HG3  ARG 103           HG3      ARG 103  10.817   8.161  -5.542
  Start of MODEL    1
  548    HD2  ARG 103           HD2      ARG 103  12.494   6.701  -4.600
  Start of MODEL    1
  549    HD3  ARG 103           HD3      ARG 103  11.283   5.893  -3.605
  Start of MODEL    1
  550    HE   ARG 103           HE       ARG 103  10.356   5.543  -6.127
  Start of MODEL    1
  551   HH11  ARG 103          HH11      ARG 103  13.454   4.911  -4.605
  Start of MODEL    1
  552   HH12  ARG 103          HH12      ARG 103  13.804   3.537  -5.606
  Start of MODEL    1
  553   HH21  ARG 103          HH21      ARG 103  10.823   3.706  -7.435
  Start of MODEL    1
  554   HH22  ARG 103          HH22      ARG 103  12.303   2.844  -7.190
  Start of MODEL    1
  555    H    LYS 104           H        LYS 104   9.270   9.979  -6.029
  Start of MODEL    1
  556    HA   LYS 104           HA       LYS 104   6.506  10.406  -5.392
  Start of MODEL    1
  557    HB2  LYS 104           HB2      LYS 104   7.487  11.378  -7.409
  Start of MODEL    1
  558    HB3  LYS 104           HB3      LYS 104   7.873   9.774  -8.018
  Start of MODEL    1
  559    HG2  LYS 104           HG2      LYS 104   5.546   9.250  -8.274
  Start of MODEL    1
  560    HG3  LYS 104           HG3      LYS 104   5.077  10.760  -7.493
  Start of MODEL    1
  561    HD2  LYS 104           HD2      LYS 104   6.700  10.650 -10.029
  Start of MODEL    1
  562    HD3  LYS 104           HD3      LYS 104   4.938  10.732 -10.019
  Start of MODEL    1
  563    HE2  LYS 104           HE2      LYS 104   6.722  12.744  -8.654
  Start of MODEL    1
  564    HE3  LYS 104           HE3      LYS 104   6.098  12.939 -10.292
  Start of MODEL    1
  565    HZ2  LYS 104           HZ1      LYS 104   4.822  14.017  -8.376
  Start of MODEL    1
  566    HZ1  LYS 104           HZ2      LYS 104   4.269  12.459  -8.018
  Start of MODEL    1
  567    HZ3  LYS 104           HZ3      LYS 104   3.932  13.157  -9.524
  Start of MODEL    1
  568    H    ALA 105           H        ALA 105   4.983   8.943  -5.100
  Start of MODEL    1
  569    HA   ALA 105           HA       ALA 105   5.698   6.103  -5.387
  Start of MODEL    1
  570    HB3  ALA 105           HB1      ALA 105   4.144   5.665  -3.595
  Start of MODEL    1
  571    HB2  ALA 105           HB2      ALA 105   3.623   7.350  -3.590
  Start of MODEL    1
  572    HB1  ALA 105           HB3      ALA 105   5.263   6.933  -3.094
  Start of MODEL    1
  573    H    ASN 106           H        ASN 106   3.873   4.620  -5.879
  Start of MODEL    1
  574    HA   ASN 106           HA       ASN 106   1.864   5.967  -7.564
  Start of MODEL    1
  575    HB2  ASN 106           HB2      ASN 106   1.902   4.294  -9.206
  Start of MODEL    1
  576    HB3  ASN 106           HB3      ASN 106   3.593   4.590  -8.850
  Start of MODEL    1
  577   HD21  ASN 106          HD21      ASN 106   1.022   2.333  -8.819
  Start of MODEL    1
  578   HD22  ASN 106          HD22      ASN 106   1.949   0.950  -8.366
  Start of MODEL    1
  579    H    VAL 107           H        VAL 107  -0.098   5.804  -6.817
  Start of MODEL    1
  580    HA   VAL 107           HA       VAL 107  -0.675   3.685  -4.846
  Start of MODEL    1
  581    HB   VAL 107           HB       VAL 107  -1.768   6.507  -4.951
  Start of MODEL    1
  582    H    ASN 108           H        ASN 108  -2.465   2.477  -5.080
  Start of MODEL    1
  583    HA   ASN 108           HA       ASN 108  -4.795   3.497  -6.458
  Start of MODEL    1
  584    HB2  ASN 108           HB2      ASN 108  -4.985   1.557  -7.984
  Start of MODEL    1
  585    HB3  ASN 108           HB3      ASN 108  -3.572   2.538  -8.345
  Start of MODEL    1
  586   HD21  ASN 108          HD21      ASN 108  -4.708  -0.511  -7.086
  Start of MODEL    1
  587   HD22  ASN 108          HD22      ASN 108  -3.182  -1.320  -7.137
  Start of MODEL    1
  588    H    LEU 109           H        LEU 109  -6.711   2.276  -5.967
  Start of MODEL    1
  589    HA   LEU 109           HA       LEU 109  -6.859   0.942  -3.547
  Start of MODEL    1
  590    HB2  LEU 109           HB2      LEU 109  -8.608   0.648  -5.990
  Start of MODEL    1
  591    HB3  LEU 109           HB3      LEU 109  -9.003  -0.026  -4.420
  Start of MODEL    1
  592    HG   LEU 109           HG       LEU 109  -8.680   2.916  -5.029
  Start of MODEL    1
  593   HD13  LEU 109          HD11      LEU 109 -10.693   2.029  -6.030
  Start of MODEL    1
  594   HD12  LEU 109          HD12      LEU 109 -11.106   3.012  -4.626
  Start of MODEL    1
  595   HD11  LEU 109          HD13      LEU 109 -11.138   1.253  -4.512
  Start of MODEL    1
  596   HD22  LEU 109          HD21      LEU 109  -9.509   3.263  -2.764
  Start of MODEL    1
  597   HD21  LEU 109          HD22      LEU 109  -8.010   2.334  -2.744
  Start of MODEL    1
  598   HD23  LEU 109          HD23      LEU 109  -9.556   1.520  -2.501
  Start of MODEL    1
  599    H    ALA 110           H        ALA 110  -6.458  -1.070  -2.863
  Start of MODEL    1
  600    HA   ALA 110           HA       ALA 110  -4.540  -2.502  -4.353
  Start of MODEL    1
  601    HB1  ALA 110           HB1      ALA 110  -4.540  -2.305  -1.893
  Start of MODEL    1
  602    HB3  ALA 110           HB2      ALA 110  -4.395  -3.970  -2.454
  Start of MODEL    1
  603    HB2  ALA 110           HB3      ALA 110  -5.935  -3.383  -1.830
  Start of MODEL    1
  604    H    TYR 111           H        TYR 111  -7.994  -3.083  -3.860
  Start of MODEL    1
  605    HA   TYR 111           HA       TYR 111  -7.949  -5.823  -4.514
  Start of MODEL    1
  606    HB2  TYR 111           HB2      TYR 111 -10.285  -5.768  -4.529
  Start of MODEL    1
  607    HB3  TYR 111           HB3      TYR 111  -9.841  -4.490  -3.411
  Start of MODEL    1
  608    HD1  TYR 111           HD1      TYR 111  -9.539  -2.086  -4.743
  Start of MODEL    1
  609    HD2  TYR 111           HD2      TYR 111 -12.042  -5.328  -5.891
  Start of MODEL    1
  610    HE1  TYR 111           HE1      TYR 111 -10.986  -0.526  -5.981
  Start of MODEL    1
  611    HE2  TYR 111           HE2      TYR 111 -13.493  -3.783  -7.135
  Start of MODEL    1
  612    HH   TYR 111           HH       TYR 111 -12.598  -0.591  -7.875
  Start of MODEL    1
  613    H    LEU 112           H        LEU 112  -7.680  -3.042  -6.466
  Start of MODEL    1
  614    HA   LEU 112           HA       LEU 112  -8.638  -4.096  -8.915
  Start of MODEL    1
  615    HB2  LEU 112           HB2      LEU 112  -6.786  -1.805  -8.299
  Start of MODEL    1
  616    HB3  LEU 112           HB3      LEU 112  -7.331  -2.193  -9.921
  Start of MODEL    1
  617    HG   LEU 112           HG       LEU 112  -9.069  -1.358  -7.597
  Start of MODEL    1
  618   HD13  LEU 112          HD11      LEU 112  -7.805   0.467  -8.613
  Start of MODEL    1
  619   HD12  LEU 112          HD12      LEU 112  -9.527   0.601  -8.974
  Start of MODEL    1
  620   HD11  LEU 112          HD13      LEU 112  -8.411   0.005 -10.203
  Start of MODEL    1
  621   HD22  LEU 112          HD21      LEU 112 -10.934  -1.515  -9.099
  Start of MODEL    1
  622   HD21  LEU 112          HD22      LEU 112 -10.109  -3.078  -9.061
  Start of MODEL    1
  623   HD23  LEU 112          HD23      LEU 112  -9.879  -1.988 -10.431
  Start of MODEL    1
  624    H    GLY 113           H        GLY 113  -5.912  -5.012  -7.180
  Start of MODEL    1
  625    HA2  GLY 113           HA2      GLY 113  -4.758  -6.224  -9.558
  Start of MODEL    1
  626    HA3  GLY 113           HA3      GLY 113  -3.716  -5.119  -8.664
  Start of MODEL    1
  627    H    ALA 114           H        ALA 114  -5.980  -6.753  -6.742
  Start of MODEL    1
  628    HA   ALA 114           HA       ALA 114  -3.839  -8.119  -5.365
  Start of MODEL    1
  629    HB3  ALA 114           HB1      ALA 114  -5.558  -6.990  -4.067
  Start of MODEL    1
  630    HB2  ALA 114           HB2      ALA 114  -5.568  -8.719  -3.726
  Start of MODEL    1
  631    HB1  ALA 114           HB3      ALA 114  -6.802  -8.020  -4.773
  Start of MODEL    1
  632    H    LYS 115           H        LYS 115  -3.444 -10.266  -5.353
  Start of MODEL    1
  633    HA   LYS 115           HA       LYS 115  -4.581 -11.878  -7.434
  Start of MODEL    1
  634    HB2  LYS 115           HB2      LYS 115  -2.579 -12.511  -5.255
  Start of MODEL    1
  635    HB3  LYS 115           HB3      LYS 115  -3.035 -13.637  -6.527
  Start of MODEL    1
  636    HG2  LYS 115           HG2      LYS 115  -2.167 -12.099  -8.211
  Start of MODEL    1
  637    HG3  LYS 115           HG3      LYS 115  -1.735 -10.951  -6.942
  Start of MODEL    1
  638    HD2  LYS 115           HD2      LYS 115  -0.165 -12.545  -5.994
  Start of MODEL    1
  639    HD3  LYS 115           HD3      LYS 115  -0.646 -13.757  -7.183
  Start of MODEL    1
  640    HE2  LYS 115           HE2      LYS 115   0.194 -12.338  -8.983
  Start of MODEL    1
  641    HE3  LYS 115           HE3      LYS 115   0.648 -11.104  -7.811
  Start of MODEL    1
  642    HZ1  LYS 115           HZ1      LYS 115   1.756 -13.863  -7.861
  Start of MODEL    1
  643    HZ3  LYS 115           HZ2      LYS 115   2.264 -12.585  -6.866
  Start of MODEL    1
  644    HZ2  LYS 115           HZ3      LYS 115   2.521 -12.508  -8.542
  Start of MODEL    1
  645    HA   PRO 116           HA       PRO 116  -7.852 -13.627  -5.004
  Start of MODEL    1
  646    HB2  PRO 116           HB2      PRO 116  -7.909 -15.839  -6.920
  Start of MODEL    1
  647    HB3  PRO 116           HB3      PRO 116  -9.115 -14.583  -6.627
  Start of MODEL    1
  648    HG2  PRO 116           HG2      PRO 116  -7.640 -14.667  -8.889
  Start of MODEL    1
  649    HG3  PRO 116           HG3      PRO 116  -8.183 -13.143  -8.163
  Start of MODEL    1
  650    HD2  PRO 116           HD2      PRO 116  -5.496 -14.464  -8.007
  Start of MODEL    1
  651    HD3  PRO 116           HD3      PRO 116  -5.895 -12.749  -8.246
  Start of MODEL    1
  652    H    ARG 117           H        ARG 117  -8.511 -15.883  -4.189
  Start of MODEL    1
  653    HA   ARG 117           HA       ARG 117  -8.129 -17.823  -3.078
  Start of MODEL    1
  654    HB2  ARG 117           HB2      ARG 117  -6.819 -18.532  -5.041
  Start of MODEL    1
  655    HB3  ARG 117           HB3      ARG 117  -5.390 -17.779  -4.354
  Start of MODEL    1
  656    HG2  ARG 117           HG2      ARG 117  -5.352 -20.180  -4.021
  Start of MODEL    1
  657    HG3  ARG 117           HG3      ARG 117  -5.465 -19.339  -2.476
  Start of MODEL    1
  658    HD2  ARG 117           HD2      ARG 117  -6.940 -21.307  -2.599
  Start of MODEL    1
  659    HD3  ARG 117           HD3      ARG 117  -7.829 -19.807  -2.352
  Start of MODEL    1
  660    HE   ARG 117           HE       ARG 117  -7.747 -20.269  -5.092
  Start of MODEL    1
  661   HH11  ARG 117          HH11      ARG 117  -8.973 -21.939  -2.261
  Start of MODEL    1
  662   HH12  ARG 117          HH12      ARG 117 -10.397 -22.537  -3.064
  Start of MODEL    1
  663   HH21  ARG 117          HH21      ARG 117  -9.602 -21.064  -6.167
  Start of MODEL    1
  664   HH22  ARG 117          HH22      ARG 117 -10.763 -22.029  -5.302
  Start of MODEL    1
  665    H    THR 118           H        THR 118  -5.921 -15.191  -2.824
  Start of MODEL    1
  666    HA   THR 118           HA       THR 118  -4.497 -15.872  -0.517
  Start of MODEL    1
  667    HB   THR 118           HB       THR 118  -4.301 -13.369  -0.209
  Start of MODEL    1
  668    HG1  THR 118           HG1      THR 118  -5.285 -12.791  -2.688
  Start of MODEL    1
  669   HG21  THR 118          HG21      THR 118  -3.692 -14.506  -2.945
  Start of MODEL    1
  670   HG23  THR 118          HG22      THR 118  -2.661 -14.622  -1.517
  Start of MODEL    1
  671   HG22  THR 118          HG23      THR 118  -2.964 -13.050  -2.262
  Start of MODEL    1
  672    H    ASN 119           H        ASN 119  -4.769 -15.292   1.658
  Start of MODEL    1
  673    HA   ASN 119           HA       ASN 119  -7.542 -15.034   2.545
  Start of MODEL    1
  674    HB2  ASN 119           HB2      ASN 119  -4.974 -15.878   3.839
  Start of MODEL    1
  675    HB3  ASN 119           HB3      ASN 119  -6.255 -15.236   4.857
  Start of MODEL    1
  676   HD21  ASN 119          HD21      ASN 119  -6.566 -17.152   5.919
  Start of MODEL    1
  677   HD22  ASN 119          HD22      ASN 119  -7.294 -18.531   5.159
  Start of MODEL    1
  678    H    VAL 120           H        VAL 120  -7.580 -13.708   4.756
  Start of MODEL    1
  679    HA   VAL 120           HA       VAL 120  -5.962 -11.256   4.460
  Start of MODEL    1
  680    HB   VAL 120           HB       VAL 120  -8.623 -11.476   5.891
  Start of MODEL    1
  681    H    GLN 121           H        GLN 121  -7.684 -13.320   6.747
  Start of MODEL    1
  682    HA   GLN 121           HA       GLN 121  -5.212 -13.673   8.245
  Start of MODEL    1
  683    HB2  GLN 121           HB2      GLN 121  -7.863 -12.901   9.500
  Start of MODEL    1
  684    HB3  GLN 121           HB3      GLN 121  -6.534 -13.606  10.404
  Start of MODEL    1
  685    HG2  GLN 121           HG2      GLN 121  -5.133 -11.659   9.685
  Start of MODEL    1
  686    HG3  GLN 121           HG3      GLN 121  -6.597 -10.945   9.014
  Start of MODEL    1
  687   HE21  GLN 121          HE21      GLN 121  -6.477  -9.193  10.407
  Start of MODEL    1
  688   HE22  GLN 121          HE22      GLN 121  -6.866  -9.321  12.085
  Start of MODEL    1
  689    H5'   DG   1           H5'       DG   1  18.968  -7.212  -5.561
  Start of MODEL    1
  690    H4'   DG   1           H4'       DG   1  16.494  -7.318  -5.949
  Start of MODEL    1
  691    H3'   DG   1           H3'       DG   1  16.605  -5.014  -7.339
  Start of MODEL    1
  692    H2'   DG   1           H2'       DG   1  17.276  -3.524  -5.606
  Start of MODEL    1
  693    H1'   DG   1           H1'       DG   1  15.519  -4.966  -3.583
  Start of MODEL    1
  694    H8    DG   1           H8        DG   1  19.172  -3.846  -4.233
  Start of MODEL    1
  695    H1    DG   1           H1        DG   1  16.855  -2.636   1.627
  Start of MODEL    1
  696    H22   DG   1           H21       DG   1  13.992  -4.239   0.480
  Start of MODEL    1
  697    H21   DG   1           H22       DG   1  14.789  -3.416   1.802
  Start of MODEL    1
  698   HO5'   DG   1           H5T       DG   1  18.442  -4.583  -6.291
  Start of MODEL    1
  699   H5''   DG   1          5H''       DG   1  18.415  -6.934  -7.225
  Start of MODEL    1
  700   H2''   DG   1          2H''       DG   1  15.537  -3.434  -5.404
  Start of MODEL    1
  701    H5'   DG   2           H5'       DG   2  13.657  -3.966 -10.102
  Start of MODEL    1
  702    H4'   DG   2           H4'       DG   2  11.747  -3.089  -9.181
  Start of MODEL    1
  703    H3'   DG   2           H3'       DG   2  12.765  -1.552 -11.131
  Start of MODEL    1
  704    H2'   DG   2           H2'       DG   2  14.033  -0.091  -9.662
  Start of MODEL    1
  705    H1'   DG   2           H1'       DG   2  11.495  -0.040  -7.938
  Start of MODEL    1
  706    H8    DG   2           H8        DG   2  15.108   0.985  -8.204
  Start of MODEL    1
  707    H1    DG   2           H1        DG   2  12.631   1.494  -2.303
  Start of MODEL    1
  708    H22   DG   2           H21       DG   2   9.955  -0.257  -3.656
  Start of MODEL    1
  709    H21   DG   2           H22       DG   2  10.640   0.541  -2.259
  Start of MODEL    1
  710   H5''   DG   2          5H''       DG   2  14.632  -2.530  -9.724
  Start of MODEL    1
  711   H2''   DG   2          2H''       DG   2  12.572   0.835  -9.975
  Start of MODEL    1
  712    H5'   DT   3           H5'       DT   3   9.893  -3.241  -9.652
  Start of MODEL    1
  713    H4'   DT   3           H4'       DT   3   8.120  -5.111 -10.018
  Start of MODEL    1
  714    H3'   DT   3           H3'       DT   3   8.442  -4.747 -12.680
  Start of MODEL    1
  715    H2'   DT   3           H2'       DT   3   7.688  -2.462 -12.760
  Start of MODEL    1
  716    H1'   DT   3           H1'       DT   3   5.519  -3.233 -10.738
  Start of MODEL    1
  717    H3    DT   3           H3        DT   3   4.583   1.196 -12.107
  Start of MODEL    1
  718    H72   DT   3           H71       DT   3   6.833   1.827  -7.849
  Start of MODEL    1
  719    H71   DT   3           H72       DT   3   8.006   2.375  -9.066
  Start of MODEL    1
  720    H73   DT   3           H73       DT   3   8.286   0.855  -8.184
  Start of MODEL    1
  721    H6    DT   3           H6        DT   3   7.589  -1.116  -9.216
  Start of MODEL    1
  722   H5''   DT   3          5H''       DT   3  10.283  -4.737 -10.516
  Start of MODEL    1
  723   H2''   DT   3          2H''       DT   3   6.186  -3.323 -13.073
  Start of MODEL    1
  724    H5'   DG   4           H5'       DG   4   4.675  -8.178  -9.869
  Start of MODEL    1
  725    H4'   DG   4           H4'       DG   4   5.750  -6.780  -7.960
  Start of MODEL    1
  726    H3'   DG   4           H3'       DG   4   2.857  -6.829  -8.732
  Start of MODEL    1
  727    H2'   DG   4           H2'       DG   4   2.374  -4.975  -7.391
  Start of MODEL    1
  728    H1'   DG   4           H1'       DG   4   5.208  -4.142  -7.092
  Start of MODEL    1
  729    H8    DG   4           H8        DG   4   4.993  -1.634  -7.172
  Start of MODEL    1
  730    H1    DG   4           H1        DG   4   0.317  -1.888 -11.566
  Start of MODEL    1
  731    H22   DG   4           H21       DG   4   0.772  -5.323 -11.379
  Start of MODEL    1
  732    H21   DG   4           H22       DG   4  -0.106  -3.992 -12.097
  Start of MODEL    1
  733   H5''   DG   4          5H''       DG   4   4.720  -6.648 -10.768
  Start of MODEL    1
  734   H2''   DG   4          2H''       DG   4   3.566  -5.438  -6.180
  Start of MODEL    1
  735    H5'   DT   5           H5'       DT   5   3.740  -7.159  -4.744
  Start of MODEL    1
  736    H4'   DT   5           H4'       DT   5   3.117  -7.288  -2.242
  Start of MODEL    1
  737    H3'   DT   5           H3'       DT   5   1.802  -9.599  -2.765
  Start of MODEL    1
  738    H2'   DT   5           H2'       DT   5   0.137  -8.648  -4.237
  Start of MODEL    1
  739    H1'   DT   5           H1'       DT   5   0.042  -6.287  -2.296
  Start of MODEL    1
  740    H3    DT   5           H3        DT   5  -3.616  -5.335  -4.936
  Start of MODEL    1
  741    H71   DT   5           H71       DT   5  -0.747  -3.272  -7.844
  Start of MODEL    1
  742    H72   DT   5           H72       DT   5   0.860  -3.498  -7.118
  Start of MODEL    1
  743    H73   DT   5           H73       DT   5   0.192  -4.739  -8.201
  Start of MODEL    1
  744    H6    DT   5           H6        DT   5   1.119  -5.392  -5.451
  Start of MODEL    1
  745   H5''   DT   5          5H''       DT   5   4.204  -8.567  -3.771
  Start of MODEL    1
  746   H2''   DT   5          2H''       DT   5  -0.681  -8.572  -2.683
  Start of MODEL    1
  747    H5'   DG   6           H5'       DG   6   2.632  -7.463   1.523
  Start of MODEL    1
  748    H4'   DG   6           H4'       DG   6   3.292  -8.290   3.876
  Start of MODEL    1
  749    H3'   DG   6           H3'       DG   6   1.627 -10.408   3.492
  Start of MODEL    1
  750    H2'   DG   6           H2'       DG   6  -0.447  -9.240   3.432
  Start of MODEL    1
  751    H1'   DG   6           H1'       DG   6   0.565  -7.268   5.534
  Start of MODEL    1
  752    H8    DG   6           H8        DG   6  -1.165  -7.590   2.088
  Start of MODEL    1
  753    H1    DG   6           H1        DG   6  -3.286  -2.846   5.865
  Start of MODEL    1
  754    H22   DG   6           H21       DG   6  -0.796  -3.894   8.040
  Start of MODEL    1
  755    H21   DG   6           H22       DG   6  -2.095  -2.768   7.718
  Start of MODEL    1
  756   H5''   DG   6          5H''       DG   6   3.365  -9.058   1.735
  Start of MODEL    1
  757   H2''   DG   6          2H''       DG   6  -0.305  -9.470   5.169
  Start of MODEL    1
  758    H5'   DC   7           H5'       DC   7  -0.632 -11.371   6.465
  Start of MODEL    1
  759    H4'   DC   7           H4'       DC   7  -0.518 -12.752   8.580
  Start of MODEL    1
  760    H3'   DC   7           H3'       DC   7   2.082 -13.257   8.095
  Start of MODEL    1
  761   HO3'   DC   7           H3T       DC   7   0.084 -14.876   9.286
  Start of MODEL    1
  762    H2'   DC   7           H2'       DC   7   1.891 -14.515   6.088
  Start of MODEL    1
  763    H1'   DC   7           H1'       DC   7  -0.630 -15.895   7.085
  Start of MODEL    1
  764    H42   DC   7           H41       DC   7  -0.759 -15.513   0.466
  Start of MODEL    1
  765    H41   DC   7           H42       DC   7  -1.246 -17.136   0.899
  Start of MODEL    1
  766    H5    DC   7           H5        DC   7  -0.145 -13.848   2.092
  Start of MODEL    1
  767    H6    DC   7           H6        DC   7   0.189 -13.402   4.467
  Start of MODEL    1
  768   H5''   DC   7          5H''       DC   7   0.721 -11.042   7.566
  Start of MODEL    1
  769   H2''   DC   7          2H''       DC   7   1.730 -15.824   7.252
  Start of MODEL    2
  770    H1   GLY  25           HT1      GLY  25  -1.424 -11.074   4.273
  Start of MODEL    2
  771    H2   GLY  25           HT2      GLY  25  -3.112 -10.985   4.194
  Start of MODEL    2
  772    H3   GLY  25           HT3      GLY  25  -2.164  -9.882   3.331
  Start of MODEL    2
  773    HA3  GLY  25           HA2      GLY  25  -2.229 -12.801   2.837
  Start of MODEL    2
  774    HA2  GLY  25           HA3      GLY  25  -1.310 -11.617   1.917
  Start of MODEL    2
  775    H    ALA  26           H        ALA  26  -3.114 -13.332   0.692
  Start of MODEL    2
  776    HA   ALA  26           HA       ALA  26  -5.400 -11.581   0.080
  Start of MODEL    2
  777    HB2  ALA  26           HB1      ALA  26  -5.326 -12.400  -2.218
  Start of MODEL    2
  778    HB1  ALA  26           HB2      ALA  26  -3.916 -13.385  -1.829
  Start of MODEL    2
  779    HB3  ALA  26           HB3      ALA  26  -3.802 -11.626  -1.776
  Start of MODEL    2
  780    H    MET  27           H        MET  27  -6.991 -12.519   1.215
  Start of MODEL    2
  781    HA   MET  27           HA       MET  27  -7.316 -15.429   0.981
  Start of MODEL    2
  782    HB2  MET  27           HB2      MET  27  -6.823 -14.584   3.267
  Start of MODEL    2
  783    HB3  MET  27           HB3      MET  27  -8.280 -13.606   3.195
  Start of MODEL    2
  784    HG2  MET  27           HG2      MET  27  -8.418 -16.574   2.843
  Start of MODEL    2
  785    HG3  MET  27           HG3      MET  27  -8.316 -15.855   4.447
  Start of MODEL    2
  786    HE2  MET  27           HE1      MET  27 -12.069 -16.784   4.396
  Start of MODEL    2
  787    HE1  MET  27           HE2      MET  27 -10.531 -16.894   5.252
  Start of MODEL    2
  788    HE3  MET  27           HE3      MET  27 -10.745 -17.729   3.714
  Start of MODEL    2
  789    H    GLY  28           H        GLY  28  -9.367 -12.589   1.684
  Start of MODEL    2
  790    HA2  GLY  28           HA2      GLY  28 -10.910 -12.600  -0.582
  Start of MODEL    2
  791    HA3  GLY  28           HA3      GLY  28 -11.646 -13.811   0.463
  Start of MODEL    2
  792    H    SER  29           H        SER  29 -10.187 -10.630   1.015
  Start of MODEL    2
  793    HA   SER  29           HA       SER  29 -12.435 -10.017   2.766
  Start of MODEL    2
  794    HB2  SER  29           HB2      SER  29  -9.781  -8.594   2.462
  Start of MODEL    2
  795    HB3  SER  29           HB3      SER  29 -11.013  -8.255   3.682
  Start of MODEL    2
  796    HG   SER  29           HG       SER  29 -10.734 -10.467   4.377
  Start of MODEL    2
  797    H    ARG  30           H        ARG  30 -13.990  -9.490   1.224
  Start of MODEL    2
  798    HA   ARG  30           HA       ARG  30 -13.604  -7.504  -0.757
  Start of MODEL    2
  799    HB2  ARG  30           HB2      ARG  30 -16.102  -7.512  -0.902
  Start of MODEL    2
  800    HB3  ARG  30           HB3      ARG  30 -15.369  -9.099  -1.063
  Start of MODEL    2
  801    HG2  ARG  30           HG2      ARG  30 -17.193  -9.474   0.312
  Start of MODEL    2
  802    HG3  ARG  30           HG3      ARG  30 -15.851  -9.355   1.447
  Start of MODEL    2
  803    HD2  ARG  30           HD2      ARG  30 -16.455  -6.908   1.666
  Start of MODEL    2
  804    HD3  ARG  30           HD3      ARG  30 -17.950  -7.301   0.819
  Start of MODEL    2
  805    HE   ARG  30           HE       ARG  30 -18.056  -9.066   2.792
  Start of MODEL    2
  806   HH11  ARG  30          HH11      ARG  30 -17.276  -5.650   2.844
  Start of MODEL    2
  807   HH12  ARG  30          HH12      ARG  30 -17.696  -5.457   4.521
  Start of MODEL    2
  808   HH21  ARG  30          HH21      ARG  30 -18.648  -8.803   4.978
  Start of MODEL    2
  809   HH22  ARG  30          HH22      ARG  30 -18.493  -7.238   5.729
  Start of MODEL    2
  810    H    ASP  31           H        ASP  31 -13.941  -7.353   2.567
  Start of MODEL    2
  811    HA   ASP  31           HA       ASP  31 -15.332  -4.918   2.896
  Start of MODEL    2
  812    HB2  ASP  31           HB2      ASP  31 -15.011  -6.639   4.655
  Start of MODEL    2
  813    HB3  ASP  31           HB3      ASP  31 -13.297  -6.248   4.702
  Start of MODEL    2
  814    H    THR  32           H        THR  32 -12.034  -5.760   2.283
  Start of MODEL    2
  815    HA   THR  32           HA       THR  32 -11.110  -3.024   2.595
  Start of MODEL    2
  816    HB   THR  32           HB       THR  32  -8.888  -4.130   1.840
  Start of MODEL    2
  817    HG1  THR  32           HG1      THR  32 -10.320  -6.134   1.299
  Start of MODEL    2
  818   HG21  THR  32          HG21      THR  32 -10.221  -4.856   4.449
  Start of MODEL    2
  819   HG23  THR  32          HG22      THR  32  -9.290  -3.398   4.108
  Start of MODEL    2
  820   HG22  THR  32          HG23      THR  32  -8.489  -4.969   4.127
  Start of MODEL    2
  821    H    MET  33           H        MET  33 -12.790  -4.303   0.155
  Start of MODEL    2
  822    HA   MET  33           HA       MET  33 -11.294  -4.162  -2.144
  Start of MODEL    2
  823    HB2  MET  33           HB2      MET  33 -14.170  -3.663  -1.563
  Start of MODEL    2
  824    HB3  MET  33           HB3      MET  33 -13.559  -3.200  -3.144
  Start of MODEL    2
  825    HG2  MET  33           HG2      MET  33 -12.805  -5.460  -3.545
  Start of MODEL    2
  826    HG3  MET  33           HG3      MET  33 -13.333  -5.940  -1.937
  Start of MODEL    2
  827    HE1  MET  33           HE1      MET  33 -14.476  -4.708  -5.492
  Start of MODEL    2
  828    HE3  MET  33           HE2      MET  33 -15.215  -3.502  -4.439
  Start of MODEL    2
  829    HE2  MET  33           HE3      MET  33 -16.230  -4.657  -5.305
  Start of MODEL    2
  830    H    PHE  34           H        PHE  34 -13.067  -1.327  -0.703
  Start of MODEL    2
  831    HA   PHE  34           HA       PHE  34 -11.517   0.348  -2.539
  Start of MODEL    2
  832    HB2  PHE  34           HB2      PHE  34 -14.165   0.760  -1.177
  Start of MODEL    2
  833    HB3  PHE  34           HB3      PHE  34 -13.246   2.117  -1.814
  Start of MODEL    2
  834    HD1  PHE  34           HD1      PHE  34 -14.870  -1.078  -2.786
  Start of MODEL    2
  835    HD2  PHE  34           HD2      PHE  34 -13.303   2.667  -4.058
  Start of MODEL    2
  836    HE1  PHE  34           HE1      PHE  34 -15.851  -1.428  -5.019
  Start of MODEL    2
  837    HE2  PHE  34           HE2      PHE  34 -14.278   2.335  -6.284
  Start of MODEL    2
  838    HZ   PHE  34           HZ       PHE  34 -15.558   0.281  -6.774
  Start of MODEL    2
  839    H    THR  35           H        THR  35 -11.438  -0.684   0.577
  Start of MODEL    2
  840    HA   THR  35           HA       THR  35 -10.725   1.927   1.694
  Start of MODEL    2
  841    HB   THR  35           HB       THR  35 -10.738   0.597   3.888
  Start of MODEL    2
  842    HG1  THR  35           HG1      THR  35 -12.372  -1.265   3.454
  Start of MODEL    2
  843   HG21  THR  35          HG21      THR  35 -13.320   0.882   2.338
  Start of MODEL    2
  844   HG23  THR  35          HG22      THR  35 -12.498   2.181   3.198
  Start of MODEL    2
  845   HG22  THR  35          HG23      THR  35 -13.159   0.814   4.094
  Start of MODEL    2
  846    H    LYS  36           H        LYS  36  -9.329  -1.104   0.720
  Start of MODEL    2
  847    HA   LYS  36           HA       LYS  36  -6.885  -0.611   2.211
  Start of MODEL    2
  848    HB2  LYS  36           HB2      LYS  36  -7.776  -2.853   2.263
  Start of MODEL    2
  849    HB3  LYS  36           HB3      LYS  36  -7.897  -2.897   0.515
  Start of MODEL    2
  850    HG2  LYS  36           HG2      LYS  36  -5.461  -2.879   0.351
  Start of MODEL    2
  851    HG3  LYS  36           HG3      LYS  36  -5.352  -2.855   2.116
  Start of MODEL    2
  852    HD2  LYS  36           HD2      LYS  36  -6.521  -4.975   2.244
  Start of MODEL    2
  853    HD3  LYS  36           HD3      LYS  36  -6.730  -4.993   0.495
  Start of MODEL    2
  854    HE2  LYS  36           HE2      LYS  36  -4.352  -5.179   0.171
  Start of MODEL    2
  855    HE3  LYS  36           HE3      LYS  36  -4.065  -5.007   1.903
  Start of MODEL    2
  856    HZ2  LYS  36           HZ1      LYS  36  -3.943  -7.303   1.292
  Start of MODEL    2
  857    HZ1  LYS  36           HZ2      LYS  36  -5.463  -7.253   0.561
  Start of MODEL    2
  858    HZ3  LYS  36           HZ3      LYS  36  -5.328  -7.074   2.244
  Start of MODEL    2
  859    H    ILE  37           H        ILE  37  -5.456   0.637   1.322
  Start of MODEL    2
  860    HA   ILE  37           HA       ILE  37  -5.290   0.897  -1.595
  Start of MODEL    2
  861    HB   ILE  37           HB       ILE  37  -4.197   2.679   0.593
  Start of MODEL    2
  862   HD11  ILE  37          HD11      ILE  37  -5.393   5.222  -0.764
  Start of MODEL    2
  863   HD13  ILE  37          HD12      ILE  37  -5.521   4.836   0.952
  Start of MODEL    2
  864   HD12  ILE  37          HD13      ILE  37  -6.980   5.111  -0.002
  Start of MODEL    2
  865    H    PHE  38           H        PHE  38  -3.549   0.233  -2.665
  Start of MODEL    2
  866    HA   PHE  38           HA       PHE  38  -1.279  -0.825  -1.142
  Start of MODEL    2
  867    HB2  PHE  38           HB2      PHE  38  -2.229  -2.370  -2.766
  Start of MODEL    2
  868    HB3  PHE  38           HB3      PHE  38  -2.087  -1.174  -4.045
  Start of MODEL    2
  869    HD1  PHE  38           HD1      PHE  38  -0.085  -0.925  -5.263
  Start of MODEL    2
  870    HD2  PHE  38           HD2      PHE  38  -0.158  -3.348  -1.765
  Start of MODEL    2
  871    HE1  PHE  38           HE1      PHE  38   2.145  -1.799  -5.825
  Start of MODEL    2
  872    HE2  PHE  38           HE2      PHE  38   2.072  -4.225  -2.322
  Start of MODEL    2
  873    HZ   PHE  38           HZ       PHE  38   3.223  -3.448  -4.350
  Start of MODEL    2
  874    H    VAL  39           H        VAL  39   0.551   0.334  -1.013
  Start of MODEL    2
  875    HA   VAL  39           HA       VAL  39   0.818   2.642  -2.824
  Start of MODEL    2
  876    HB   VAL  39           HB       VAL  39   2.310   2.300  -0.233
  Start of MODEL    2
  877    H    GLY  40           H        GLY  40   2.530   2.750  -4.128
  Start of MODEL    2
  878    HA2  GLY  40           HA2      GLY  40   4.525   0.577  -3.907
  Start of MODEL    2
  879    HA3  GLY  40           HA3      GLY  40   3.734   0.929  -5.435
  Start of MODEL    2
  880    H    GLY  41           H        GLY  41   6.571   0.958  -4.822
  Start of MODEL    2
  881    HA2  GLY  41           HA2      GLY  41   8.290   2.204  -5.756
  Start of MODEL    2
  882    HA3  GLY  41           HA3      GLY  41   7.135   3.483  -6.097
  Start of MODEL    2
  883    H    LEU  42           H        LEU  42   7.135   2.322  -2.899
  Start of MODEL    2
  884    HA   LEU  42           HA       LEU  42   7.961   4.861  -1.866
  Start of MODEL    2
  885    HB2  LEU  42           HB2      LEU  42   7.257   2.238  -0.565
  Start of MODEL    2
  886    HB3  LEU  42           HB3      LEU  42   7.728   3.653   0.353
  Start of MODEL    2
  887    HG   LEU  42           HG       LEU  42   5.323   3.476  -1.462
  Start of MODEL    2
  888   HD12  LEU  42          HD11      LEU  42   4.034   3.448   0.599
  Start of MODEL    2
  889   HD11  LEU  42          HD12      LEU  42   5.522   3.470   1.548
  Start of MODEL    2
  890   HD13  LEU  42          HD13      LEU  42   5.137   2.072   0.539
  Start of MODEL    2
  891   HD22  LEU  42          HD21      LEU  42   4.711   5.624  -0.433
  Start of MODEL    2
  892   HD21  LEU  42          HD22      LEU  42   6.224   5.735  -1.334
  Start of MODEL    2
  893   HD23  LEU  42          HD23      LEU  42   6.250   5.642   0.427
  Start of MODEL    2
  894    HA   PRO  43           HA       PRO  43  12.330   3.966  -1.435
  Start of MODEL    2
  895    HB2  PRO  43           HB2      PRO  43  12.756   5.866   0.529
  Start of MODEL    2
  896    HB3  PRO  43           HB3      PRO  43  12.803   6.183  -1.207
  Start of MODEL    2
  897    HG2  PRO  43           HG2      PRO  43  10.614   6.694   0.754
  Start of MODEL    2
  898    HG3  PRO  43           HG3      PRO  43  11.126   7.660  -0.643
  Start of MODEL    2
  899    HD2  PRO  43           HD2      PRO  43   8.930   6.093  -0.696
  Start of MODEL    2
  900    HD3  PRO  43           HD3      PRO  43   9.934   6.371  -2.134
  Start of MODEL    2
  901    H    TYR  44           H        TYR  44  13.553   2.813   0.042
  Start of MODEL    2
  902    HA   TYR  44           HA       TYR  44  12.096   1.243   1.867
  Start of MODEL    2
  903    HB2  TYR  44           HB2      TYR  44  15.102   1.535   1.632
  Start of MODEL    2
  904    HB3  TYR  44           HB3      TYR  44  14.253   0.219   2.436
  Start of MODEL    2
  905    HD1  TYR  44           HD1      TYR  44  12.193  -0.599   0.616
  Start of MODEL    2
  906    HD2  TYR  44           HD2      TYR  44  16.131   0.743  -0.273
  Start of MODEL    2
  907    HE1  TYR  44           HE1      TYR  44  12.129  -1.845  -1.504
  Start of MODEL    2
  908    HE2  TYR  44           HE2      TYR  44  16.073  -0.491  -2.397
  Start of MODEL    2
  909    HH   TYR  44           HH       TYR  44  14.814  -2.517  -3.325
  Start of MODEL    2
  910    H    HIS  45           H        HIS  45  13.542   4.300   2.226
  Start of MODEL    2
  911    HA   HIS  45           HA       HIS  45  14.012   4.194   5.049
  Start of MODEL    2
  912    HB2  HIS  45           HB2      HIS  45  13.483   6.766   3.597
  Start of MODEL    2
  913    HB3  HIS  45           HB3      HIS  45  14.558   6.465   4.954
  Start of MODEL    2
  914    HD1  HIS  45           HD1      HIS  45  16.943   5.738   4.434
  Start of MODEL    2
  915    HD2  HIS  45           HD2      HIS  45  14.526   6.123   1.070
  Start of MODEL    2
  916    HE1  HIS  45           HE1      HIS  45  18.503   5.649   2.463
  Start of MODEL    2
  917    HE2  HIS  45           HE2      HIS  45  17.022   5.801   0.432
  Start of MODEL    2
  918    H    THR  46           H        THR  46  11.194   4.820   3.087
  Start of MODEL    2
  919    HA   THR  46           HA       THR  46   9.641   6.353   4.733
  Start of MODEL    2
  920    HB   THR  46           HB       THR  46   8.700   4.013   3.060
  Start of MODEL    2
  921    HG1  THR  46           HG1      THR  46   9.739   6.506   2.428
  Start of MODEL    2
  922   HG23  THR  46          HG21      THR  46   6.961   4.927   4.547
  Start of MODEL    2
  923   HG22  THR  46          HG22      THR  46   6.609   5.261   2.850
  Start of MODEL    2
  924   HG21  THR  46          HG23      THR  46   7.249   6.539   3.887
  Start of MODEL    2
  925    H    SER  47           H        SER  47   8.462   6.044   6.578
  Start of MODEL    2
  926    HA   SER  47           HA       SER  47   8.542   3.354   7.754
  Start of MODEL    2
  927    HB2  SER  47           HB2      SER  47   8.275   4.498   9.938
  Start of MODEL    2
  928    HB3  SER  47           HB3      SER  47   9.724   5.034   9.090
  Start of MODEL    2
  929    HG   SER  47           HG       SER  47   8.939   6.981   9.001
  Start of MODEL    2
  930    H    ASP  48           H        ASP  48   6.666   2.745   9.046
  Start of MODEL    2
  931    HA   ASP  48           HA       ASP  48   4.224   2.922   7.808
  Start of MODEL    2
  932    HB2  ASP  48           HB2      ASP  48   4.477   2.657  10.807
  Start of MODEL    2
  933    HB3  ASP  48           HB3      ASP  48   3.270   1.931   9.748
  Start of MODEL    2
  934    H    LYS  49           H        LYS  49   5.651   5.094  10.149
  Start of MODEL    2
  935    HA   LYS  49           HA       LYS  49   3.312   6.598  10.693
  Start of MODEL    2
  936    HB2  LYS  49           HB2      LYS  49   5.347   6.592  12.135
  Start of MODEL    2
  937    HB3  LYS  49           HB3      LYS  49   6.186   7.514  10.893
  Start of MODEL    2
  938    HG2  LYS  49           HG2      LYS  49   4.635   9.348  11.151
  Start of MODEL    2
  939    HG3  LYS  49           HG3      LYS  49   3.700   8.424  12.327
  Start of MODEL    2
  940    HD2  LYS  49           HD2      LYS  49   6.554   9.358  12.635
  Start of MODEL    2
  941    HD3  LYS  49           HD3      LYS  49   5.137  10.021  13.454
  Start of MODEL    2
  942    HE2  LYS  49           HE2      LYS  49   4.766   7.774  14.473
  Start of MODEL    2
  943    HE3  LYS  49           HE3      LYS  49   6.292   7.252  13.763
  Start of MODEL    2
  944    HZ1  LYS  49           HZ1      LYS  49   7.336   9.146  15.013
  Start of MODEL    2
  945    HZ3  LYS  49           HZ2      LYS  49   6.743   7.876  15.969
  Start of MODEL    2
  946    HZ2  LYS  49           HZ3      LYS  49   5.867   9.318  15.845
  Start of MODEL    2
  947    H    THR  50           H        THR  50   5.879   6.872   8.279
  Start of MODEL    2
  948    HA   THR  50           HA       THR  50   5.212   9.418   7.293
  Start of MODEL    2
  949    HB   THR  50           HB       THR  50   6.427   7.096   5.781
  Start of MODEL    2
  950    HG1  THR  50           HG1      THR  50   7.779   9.249   7.062
  Start of MODEL    2
  951   HG22  THR  50          HG21      THR  50   7.433   8.827   4.351
  Start of MODEL    2
  952   HG21  THR  50          HG22      THR  50   6.539  10.065   5.232
  Start of MODEL    2
  953   HG23  THR  50          HG23      THR  50   5.671   8.866   4.275
  Start of MODEL    2
  954    H    LEU  51           H        LEU  51   4.005   6.195   6.547
  Start of MODEL    2
  955    HA   LEU  51           HA       LEU  51   2.351   7.063   4.374
  Start of MODEL    2
  956    HB2  LEU  51           HB2      LEU  51   2.277   4.572   6.074
  Start of MODEL    2
  957    HB3  LEU  51           HB3      LEU  51   1.187   4.855   4.728
  Start of MODEL    2
  958    HG   LEU  51           HG       LEU  51   4.188   4.586   4.578
  Start of MODEL    2
  959   HD12  LEU  51          HD11      LEU  51   3.697   2.593   3.285
  Start of MODEL    2
  960   HD11  LEU  51          HD12      LEU  51   1.968   2.868   3.487
  Start of MODEL    2
  961   HD13  LEU  51          HD13      LEU  51   2.970   2.485   4.887
  Start of MODEL    2
  962   HD21  LEU  51          HD21      LEU  51   3.356   6.273   3.000
  Start of MODEL    2
  963   HD23  LEU  51          HD22      LEU  51   2.199   5.100   2.367
  Start of MODEL    2
  964   HD22  LEU  51          HD23      LEU  51   3.931   4.825   2.172
  Start of MODEL    2
  965    H    HIS  52           H        HIS  52   1.825   6.422   7.786
  Start of MODEL    2
  966    HA   HIS  52           HA       HIS  52  -0.871   7.010   7.990
  Start of MODEL    2
  967    HB2  HIS  52           HB2      HIS  52   0.352   6.191   9.916
  Start of MODEL    2
  968    HB3  HIS  52           HB3      HIS  52   1.321   7.662   9.975
  Start of MODEL    2
  969    HD1  HIS  52           HD1      HIS  52   0.379   9.631  11.275
  Start of MODEL    2
  970    HD2  HIS  52           HD2      HIS  52  -2.393   6.563  10.692
  Start of MODEL    2
  971    HE1  HIS  52           HE1      HIS  52  -1.621  10.231  12.684
  Start of MODEL    2
  972    HE2  HIS  52           HE2      HIS  52  -3.235   8.313  12.409
  Start of MODEL    2
  973    H    GLU  53           H        GLU  53   1.800   9.371   8.433
  Start of MODEL    2
  974    HA   GLU  53           HA       GLU  53   0.186  11.593   8.809
  Start of MODEL    2
  975    HB2  GLU  53           HB2      GLU  53   2.858  11.666   7.404
  Start of MODEL    2
  976    HB3  GLU  53           HB3      GLU  53   2.110  12.945   8.345
  Start of MODEL    2
  977    HG2  GLU  53           HG2      GLU  53   3.184  10.339   9.392
  Start of MODEL    2
  978    HG3  GLU  53           HG3      GLU  53   3.914  11.931   9.581
  Start of MODEL    2
  979    H    TYR  54           H        TYR  54   1.440  10.291   5.739
  Start of MODEL    2
  980    HA   TYR  54           HA       TYR  54   0.676  12.598   4.257
  Start of MODEL    2
  981    HB2  TYR  54           HB2      TYR  54   2.445  10.756   3.726
  Start of MODEL    2
  982    HB3  TYR  54           HB3      TYR  54   1.083   9.906   3.003
  Start of MODEL    2
  983    HD1  TYR  54           HD1      TYR  54   0.075  10.676   0.970
  Start of MODEL    2
  984    HD2  TYR  54           HD2      TYR  54   3.270  12.861   2.742
  Start of MODEL    2
  985    HE1  TYR  54           HE1      TYR  54   0.342  11.957  -1.109
  Start of MODEL    2
  986    HE2  TYR  54           HE2      TYR  54   3.543  14.150   0.664
  Start of MODEL    2
  987    HH   TYR  54           HH       TYR  54   1.231  14.143  -1.810
  Start of MODEL    2
  988    H    PHE  55           H        PHE  55  -0.656   9.290   4.363
  Start of MODEL    2
  989    HA   PHE  55           HA       PHE  55  -2.840   9.915   2.698
  Start of MODEL    2
  990    HB2  PHE  55           HB2      PHE  55  -2.248   7.558   4.466
  Start of MODEL    2
  991    HB3  PHE  55           HB3      PHE  55  -3.736   7.678   3.530
  Start of MODEL    2
  992    HD1  PHE  55           HD1      PHE  55  -0.134   7.195   3.401
  Start of MODEL    2
  993    HD2  PHE  55           HD2      PHE  55  -3.688   7.582   1.096
  Start of MODEL    2
  994    HE1  PHE  55           HE1      PHE  55   1.047   6.295   1.441
  Start of MODEL    2
  995    HE2  PHE  55           HE2      PHE  55  -2.514   6.682  -0.869
  Start of MODEL    2
  996    HZ   PHE  55           HZ       PHE  55  -0.162   6.091  -0.736
  Start of MODEL    2
  997    H    GLU  56           H        GLU  56  -2.502  10.164   6.183
  Start of MODEL    2
  998    HA   GLU  56           HA       GLU  56  -5.262   9.938   6.748
  Start of MODEL    2
  999    HB2  GLU  56           HB2      GLU  56  -4.799  10.700   8.946
  Start of MODEL    2
 1000    HB3  GLU  56           HB3      GLU  56  -3.408   9.746   8.450
  Start of MODEL    2
 1001    HG2  GLU  56           HG2      GLU  56  -2.042  11.609   8.251
  Start of MODEL    2
 1002    HG3  GLU  56           HG3      GLU  56  -3.404  12.718   8.123
  Start of MODEL    2
 1003    H    GLN  57           H        GLN  57  -3.419  12.420   5.335
  Start of MODEL    2
 1004    HA   GLN  57           HA       GLN  57  -4.982  14.664   6.003
  Start of MODEL    2
 1005    HB2  GLN  57           HB2      GLN  57  -3.311  14.129   3.544
  Start of MODEL    2
 1006    HB3  GLN  57           HB3      GLN  57  -3.937  15.704   4.016
  Start of MODEL    2
 1007    HG2  GLN  57           HG2      GLN  57  -2.075  14.056   5.708
  Start of MODEL    2
 1008    HG3  GLN  57           HG3      GLN  57  -1.545  15.311   4.592
  Start of MODEL    2
 1009   HE21  GLN  57          HE21      GLN  57  -0.627  16.444   6.311
  Start of MODEL    2
 1010   HE22  GLN  57          HE22      GLN  57  -1.585  17.338   7.440
  Start of MODEL    2
 1011    H    PHE  58           H        PHE  58  -5.599  11.997   3.940
  Start of MODEL    2
 1012    HA   PHE  58           HA       PHE  58  -7.606  13.447   2.390
  Start of MODEL    2
 1013    HB2  PHE  58           HB2      PHE  58  -6.839  10.518   2.247
  Start of MODEL    2
 1014    HB3  PHE  58           HB3      PHE  58  -7.927  11.353   1.151
  Start of MODEL    2
 1015    HD1  PHE  58           HD1      PHE  58  -4.438  10.973   2.205
  Start of MODEL    2
 1016    HD2  PHE  58           HD2      PHE  58  -7.105  12.743  -0.596
  Start of MODEL    2
 1017    HE1  PHE  58           HE1      PHE  58  -2.530  11.555   0.757
  Start of MODEL    2
 1018    HE2  PHE  58           HE2      PHE  58  -5.208  13.332  -2.045
  Start of MODEL    2
 1019    HZ   PHE  58           HZ       PHE  58  -2.921  12.709  -1.387
  Start of MODEL    2
 1020    H    GLY  59           H        GLY  59  -7.347  11.448   5.160
  Start of MODEL    2
 1021    HA2  GLY  59           HA2      GLY  59  -9.863  11.837   6.145
  Start of MODEL    2
 1022    HA3  GLY  59           HA3      GLY  59 -10.020  10.418   5.113
  Start of MODEL    2
 1023    H    ASP  60           H        ASP  60 -10.615   9.664   7.442
  Start of MODEL    2
 1024    HA   ASP  60           HA       ASP  60  -8.482   9.279   9.282
  Start of MODEL    2
 1025    HB2  ASP  60           HB2      ASP  60 -11.253   8.095   9.121
  Start of MODEL    2
 1026    HB3  ASP  60           HB3      ASP  60 -10.126   7.731  10.423
  Start of MODEL    2
 1027    H    ILE  61           H        ILE  61  -7.173   7.600   9.587
  Start of MODEL    2
 1028    HA   ILE  61           HA       ILE  61  -7.312   5.402   7.654
  Start of MODEL    2
 1029    HB   ILE  61           HB       ILE  61  -5.049   6.683   9.140
  Start of MODEL    2
 1030   HD13  ILE  61          HD11      ILE  61  -3.454   7.830   7.551
  Start of MODEL    2
 1031   HD12  ILE  61          HD12      ILE  61  -3.588   7.494   5.826
  Start of MODEL    2
 1032   HD11  ILE  61          HD13      ILE  61  -3.021   6.237   6.926
  Start of MODEL    2
 1033    H    GLU  62           H        GLU  62  -7.557   3.386   8.277
  Start of MODEL    2
 1034    HA   GLU  62           HA       GLU  62  -8.162   2.762  11.021
  Start of MODEL    2
 1035    HB2  GLU  62           HB2      GLU  62  -8.623   1.623   8.412
  Start of MODEL    2
 1036    HB3  GLU  62           HB3      GLU  62  -7.956   0.405   9.486
  Start of MODEL    2
 1037    HG2  GLU  62           HG2      GLU  62 -10.395   2.080  10.027
  Start of MODEL    2
 1038    HG3  GLU  62           HG3      GLU  62 -10.399   0.405   9.478
  Start of MODEL    2
 1039    H    GLU  63           H        GLU  63  -5.697   1.994   8.614
  Start of MODEL    2
 1040    HA   GLU  63           HA       GLU  63  -3.711   1.501  10.636
  Start of MODEL    2
 1041    HB2  GLU  63           HB2      GLU  63  -4.907  -0.659  10.575
  Start of MODEL    2
 1042    HB3  GLU  63           HB3      GLU  63  -4.595  -0.775   8.850
  Start of MODEL    2
 1043    HG2  GLU  63           HG2      GLU  63  -2.253  -1.009   9.213
  Start of MODEL    2
 1044    HG3  GLU  63           HG3      GLU  63  -2.430  -0.643  10.932
  Start of MODEL    2
 1045    H    ALA  64           H        ALA  64  -1.657   1.885   9.831
  Start of MODEL    2
 1046    HA   ALA  64           HA       ALA  64  -1.349   1.977   6.920
  Start of MODEL    2
 1047    HB3  ALA  64           HB1      ALA  64  -1.860   4.265   7.649
  Start of MODEL    2
 1048    HB2  ALA  64           HB2      ALA  64  -0.211   4.130   7.038
  Start of MODEL    2
 1049    HB1  ALA  64           HB3      ALA  64  -0.504   4.202   8.776
  Start of MODEL    2
 1050    H    VAL  65           H        VAL  65   0.300   0.667   6.455
  Start of MODEL    2
 1051    HA   VAL  65           HA       VAL  65   2.647   0.655   8.220
  Start of MODEL    2
 1052    HB   VAL  65           HB       VAL  65   2.814  -1.793   8.108
  Start of MODEL    2
 1053    H    VAL  66           H        VAL  66   4.588   0.083   7.241
  Start of MODEL    2
 1054    HA   VAL  66           HA       VAL  66   4.574  -0.021   4.305
  Start of MODEL    2
 1055    HB   VAL  66           HB       VAL  66   6.945   0.199   6.185
  Start of MODEL    2
 1056    H    ILE  67           H        ILE  67   5.321  -1.874   3.182
  Start of MODEL    2
 1057    HA   ILE  67           HA       ILE  67   4.878  -4.229   4.812
  Start of MODEL    2
 1058    HB   ILE  67           HB       ILE  67   4.989  -3.885   1.825
  Start of MODEL    2
 1059   HD12  ILE  67          HD11      ILE  67   1.586  -4.254   4.333
  Start of MODEL    2
 1060   HD11  ILE  67          HD12      ILE  67   3.206  -4.072   5.008
  Start of MODEL    2
 1061   HD13  ILE  67          HD13      ILE  67   2.693  -5.627   4.349
  Start of MODEL    2
 1062    H    THR  68           H        THR  68   6.268  -5.620   5.400
  Start of MODEL    2
 1063    HA   THR  68           HA       THR  68   9.000  -5.510   4.321
  Start of MODEL    2
 1064    HB   THR  68           HB       THR  68   9.774  -6.098   6.626
  Start of MODEL    2
 1065    HG1  THR  68           HG1      THR  68   7.417  -5.202   7.783
  Start of MODEL    2
 1066   HG21  THR  68          HG21      THR  68   8.194  -3.527   6.460
  Start of MODEL    2
 1067   HG23  THR  68          HG22      THR  68   9.837  -3.767   5.864
  Start of MODEL    2
 1068   HG22  THR  68          HG23      THR  68   9.503  -3.867   7.593
  Start of MODEL    2
 1069    H    ASP  69           H        ASP  69   9.999  -7.540   3.990
  Start of MODEL    2
 1070    HA   ASP  69           HA       ASP  69   8.474  -9.825   3.697
  Start of MODEL    2
 1071    HB2  ASP  69           HB2      ASP  69  10.583  -9.782   2.633
  Start of MODEL    2
 1072    HB3  ASP  69           HB3      ASP  69  11.420  -9.394   4.134
  Start of MODEL    2
 1073    H    ARG  70           H        ARG  70   7.819 -11.443   5.008
  Start of MODEL    2
 1074    HA   ARG  70           HA       ARG  70   7.686 -10.993   7.747
  Start of MODEL    2
 1075    HB2  ARG  70           HB2      ARG  70   6.598 -13.086   7.983
  Start of MODEL    2
 1076    HB3  ARG  70           HB3      ARG  70   6.069 -12.354   6.479
  Start of MODEL    2
 1077    HG2  ARG  70           HG2      ARG  70   8.172 -14.483   6.691
  Start of MODEL    2
 1078    HG3  ARG  70           HG3      ARG  70   6.472 -14.778   6.330
  Start of MODEL    2
 1079    HD2  ARG  70           HD2      ARG  70   6.829 -13.083   4.421
  Start of MODEL    2
 1080    HD3  ARG  70           HD3      ARG  70   8.544 -13.386   4.678
  Start of MODEL    2
 1081    HE   ARG  70           HE       ARG  70   6.749 -15.655   4.200
  Start of MODEL    2
 1082   HH11  ARG  70          HH11      ARG  70   9.397 -13.630   3.081
  Start of MODEL    2
 1083   HH12  ARG  70          HH12      ARG  70   9.810 -14.713   1.775
  Start of MODEL    2
 1084   HH21  ARG  70          HH21      ARG  70   7.286 -17.030   2.453
  Start of MODEL    2
 1085   HH22  ARG  70          HH22      ARG  70   8.595 -16.596   1.401
  Start of MODEL    2
 1086    H    ASN  71           H        ASN  71  10.198 -12.620   5.957
  Start of MODEL    2
 1087    HA   ASN  71           HA       ASN  71  11.186 -13.971   8.314
  Start of MODEL    2
 1088    HB2  ASN  71           HB2      ASN  71  12.329 -13.701   5.527
  Start of MODEL    2
 1089    HB3  ASN  71           HB3      ASN  71  13.059 -14.661   6.808
  Start of MODEL    2
 1090   HD21  ASN  71          HD21      ASN  71  12.125 -15.514   4.230
  Start of MODEL    2
 1091   HD22  ASN  71          HD22      ASN  71  10.912 -16.714   4.509
  Start of MODEL    2
 1092    H    THR  72           H        THR  72  12.463 -11.451   6.130
  Start of MODEL    2
 1093    HA   THR  72           HA       THR  72  14.621 -10.917   8.007
  Start of MODEL    2
 1094    HB   THR  72           HB       THR  72  15.361  -9.309   6.216
  Start of MODEL    2
 1095    HG1  THR  72           HG1      THR  72  13.312 -10.566   4.665
  Start of MODEL    2
 1096   HG23  THR  72          HG21      THR  72  16.258 -11.584   6.333
  Start of MODEL    2
 1097   HG22  THR  72          HG22      THR  72  16.071 -11.069   4.657
  Start of MODEL    2
 1098   HG21  THR  72          HG23      THR  72  14.901 -12.179   5.373
  Start of MODEL    2
 1099    H    GLN  73           H        GLN  73  11.582  -9.697   7.325
  Start of MODEL    2
 1100    HA   GLN  73           HA       GLN  73  10.337  -7.949   8.135
  Start of MODEL    2
 1101    HB2  GLN  73           HB2      GLN  73  12.609  -7.529  10.086
  Start of MODEL    2
 1102    HB3  GLN  73           HB3      GLN  73  10.944  -7.000  10.273
  Start of MODEL    2
 1103    HG2  GLN  73           HG2      GLN  73  10.182  -9.254  10.504
  Start of MODEL    2
 1104    HG3  GLN  73           HG3      GLN  73  11.778  -9.885  10.097
  Start of MODEL    2
 1105   HE21  GLN  73          HE21      GLN  73  11.246  -7.118  12.165
  Start of MODEL    2
 1106   HE22  GLN  73          HE22      GLN  73  11.792  -7.864  13.621
  Start of MODEL    2
 1107    H    LYS  74           H        LYS  74  12.229  -7.545   6.004
  Start of MODEL    2
 1108    HA   LYS  74           HA       LYS  74  13.130  -4.778   6.434
  Start of MODEL    2
 1109    HB2  LYS  74           HB2      LYS  74  13.987  -6.820   4.376
  Start of MODEL    2
 1110    HB3  LYS  74           HB3      LYS  74  14.557  -5.156   4.424
  Start of MODEL    2
 1111    HG2  LYS  74           HG2      LYS  74  14.914  -7.138   6.661
  Start of MODEL    2
 1112    HG3  LYS  74           HG3      LYS  74  16.125  -6.786   5.428
  Start of MODEL    2
 1113    HD2  LYS  74           HD2      LYS  74  16.335  -4.531   6.159
  Start of MODEL    2
 1114    HD3  LYS  74           HD3      LYS  74  14.925  -4.673   7.211
  Start of MODEL    2
 1115    HE2  LYS  74           HE2      LYS  74  17.437  -6.296   7.567
  Start of MODEL    2
 1116    HE3  LYS  74           HE3      LYS  74  17.165  -4.748   8.361
  Start of MODEL    2
 1117    HZ1  LYS  74           HZ1      LYS  74  15.469  -7.173   8.678
  Start of MODEL    2
 1118    HZ3  LYS  74           HZ2      LYS  74  15.206  -5.677   9.429
  Start of MODEL    2
 1119    HZ2  LYS  74           HZ3      LYS  74  16.583  -6.586   9.811
  Start of MODEL    2
 1120    H    SER  75           H        SER  75  12.483  -3.137   5.098
  Start of MODEL    2
 1121    HA   SER  75           HA       SER  75   9.899  -3.300   4.058
  Start of MODEL    2
 1122    HB2  SER  75           HB2      SER  75  11.988  -1.202   3.435
  Start of MODEL    2
 1123    HB3  SER  75           HB3      SER  75  10.237  -1.009   3.349
  Start of MODEL    2
 1124    HG   SER  75           HG       SER  75  11.124  -0.164   5.298
  Start of MODEL    2
 1125    H    ARG  76           H        ARG  76   9.079  -3.630   2.091
  Start of MODEL    2
 1126    HA   ARG  76           HA       ARG  76  10.932  -4.650   0.061
  Start of MODEL    2
 1127    HB2  ARG  76           HB2      ARG  76   7.957  -4.996   0.400
  Start of MODEL    2
 1128    HB3  ARG  76           HB3      ARG  76   8.870  -5.639  -0.959
  Start of MODEL    2
 1129    HG2  ARG  76           HG2      ARG  76  10.269  -6.886   0.730
  Start of MODEL    2
 1130    HG3  ARG  76           HG3      ARG  76   9.076  -6.406   1.941
  Start of MODEL    2
 1131    HD2  ARG  76           HD2      ARG  76   8.613  -8.641   1.058
  Start of MODEL    2
 1132    HD3  ARG  76           HD3      ARG  76   7.320  -7.508   0.658
  Start of MODEL    2
 1133    HE   ARG  76           HE       ARG  76   9.130  -7.497  -1.459
  Start of MODEL    2
 1134   HH11  ARG  76          HH11      ARG  76   6.940  -9.776   0.040
  Start of MODEL    2
 1135   HH12  ARG  76          HH12      ARG  76   6.600 -10.614  -1.437
  Start of MODEL    2
 1136   HH21  ARG  76          HH21      ARG  76   8.689  -8.571  -3.393
  Start of MODEL    2
 1137   HH22  ARG  76          HH22      ARG  76   7.591  -9.925  -3.403
  Start of MODEL    2
 1138    H    GLY  77           H        GLY  77  10.224  -1.786   0.611
  Start of MODEL    2
 1139    HA2  GLY  77           HA2      GLY  77  10.109   0.115  -0.682
  Start of MODEL    2
 1140    HA3  GLY  77           HA3      GLY  77  10.130  -0.932  -2.089
  Start of MODEL    2
 1141    H    TYR  78           H        TYR  78   7.574  -1.557   0.109
  Start of MODEL    2
 1142    HA   TYR  78           HA       TYR  78   5.799   0.418  -0.968
  Start of MODEL    2
 1143    HB2  TYR  78           HB2      TYR  78   4.173  -1.189  -1.920
  Start of MODEL    2
 1144    HB3  TYR  78           HB3      TYR  78   5.689  -1.136  -2.806
  Start of MODEL    2
 1145    HD1  TYR  78           HD1      TYR  78   3.600  -3.150  -0.549
  Start of MODEL    2
 1146    HD2  TYR  78           HD2      TYR  78   7.084  -3.059  -2.980
  Start of MODEL    2
 1147    HE1  TYR  78           HE1      TYR  78   3.747  -5.595  -0.418
  Start of MODEL    2
 1148    HE2  TYR  78           HE2      TYR  78   7.249  -5.501  -2.852
  Start of MODEL    2
 1149    HH   TYR  78           HH       TYR  78   4.709  -7.436  -1.693
  Start of MODEL    2
 1150    H    GLY  79           H        GLY  79   3.486   0.015  -0.106
  Start of MODEL    2
 1151    HA2  GLY  79           HA2      GLY  79   3.494  -1.366   2.459
  Start of MODEL    2
 1152    HA3  GLY  79           HA3      GLY  79   3.400   0.382   2.530
  Start of MODEL    2
 1153    H    PHE  80           H        PHE  80   1.389  -0.539   3.706
  Start of MODEL    2
 1154    HA   PHE  80           HA       PHE  80  -0.823  -0.399   1.797
  Start of MODEL    2
 1155    HB2  PHE  80           HB2      PHE  80  -0.478  -2.417   3.991
  Start of MODEL    2
 1156    HB3  PHE  80           HB3      PHE  80  -2.082  -1.945   3.442
  Start of MODEL    2
 1157    HD1  PHE  80           HD1      PHE  80   0.830  -3.918   2.783
  Start of MODEL    2
 1158    HD2  PHE  80           HD2      PHE  80  -2.700  -2.325   1.044
  Start of MODEL    2
 1159    HE1  PHE  80           HE1      PHE  80   1.030  -5.520   0.933
  Start of MODEL    2
 1160    HE2  PHE  80           HE2      PHE  80  -2.519  -3.925  -0.813
  Start of MODEL    2
 1161    HZ   PHE  80           HZ       PHE  80  -0.758  -5.574  -0.844
  Start of MODEL    2
 1162    H    VAL  81           H        VAL  81  -2.445   0.803   2.324
  Start of MODEL    2
 1163    HA   VAL  81           HA       VAL  81  -2.692   1.798   5.097
  Start of MODEL    2
 1164    HB   VAL  81           HB       VAL  81  -3.009   3.418   2.565
  Start of MODEL    2
 1165    H    THR  82           H        THR  82  -4.599   1.360   5.973
  Start of MODEL    2
 1166    HA   THR  82           HA       THR  82  -6.829   0.688   4.185
  Start of MODEL    2
 1167    HB   THR  82           HB       THR  82  -6.686   0.058   7.140
  Start of MODEL    2
 1168    HG1  THR  82           HG1      THR  82  -5.532  -1.689   6.707
  Start of MODEL    2
 1169   HG21  THR  82          HG21      THR  82  -8.263  -1.205   4.889
  Start of MODEL    2
 1170   HG23  THR  82          HG22      THR  82  -8.895  -0.011   6.023
  Start of MODEL    2
 1171   HG22  THR  82          HG23      THR  82  -8.385  -1.596   6.606
  Start of MODEL    2
 1172    H    MET  83           H        MET  83  -8.050   2.428   3.894
  Start of MODEL    2
 1173    HA   MET  83           HA       MET  83  -8.116   4.566   5.828
  Start of MODEL    2
 1174    HB2  MET  83           HB2      MET  83  -9.602   4.241   3.208
  Start of MODEL    2
 1175    HB3  MET  83           HB3      MET  83  -9.531   5.712   4.172
  Start of MODEL    2
 1176    HG2  MET  83           HG2      MET  83  -7.133   4.363   2.953
  Start of MODEL    2
 1177    HG3  MET  83           HG3      MET  83  -8.011   5.703   2.215
  Start of MODEL    2
 1178    HE3  MET  83           HE1      MET  83  -8.013   8.185   3.152
  Start of MODEL    2
 1179    HE2  MET  83           HE2      MET  83  -7.336   8.625   4.719
  Start of MODEL    2
 1180    HE1  MET  83           HE3      MET  83  -8.745   7.567   4.633
  Start of MODEL    2
 1181    H    LYS  84           H        LYS  84  -9.962   5.339   6.843
  Start of MODEL    2
 1182    HA   LYS  84           HA       LYS  84 -11.681   3.251   7.782
  Start of MODEL    2
 1183    HB2  LYS  84           HB2      LYS  84 -10.726   5.096   9.196
  Start of MODEL    2
 1184    HB3  LYS  84           HB3      LYS  84 -11.820   6.206   8.387
  Start of MODEL    2
 1185    HG2  LYS  84           HG2      LYS  84 -13.600   5.524   9.572
  Start of MODEL    2
 1186    HG3  LYS  84           HG3      LYS  84 -13.092   3.834   9.558
  Start of MODEL    2
 1187    HD2  LYS  84           HD2      LYS  84 -11.832   5.973  11.270
  Start of MODEL    2
 1188    HD3  LYS  84           HD3      LYS  84 -13.097   4.868  11.825
  Start of MODEL    2
 1189    HE2  LYS  84           HE2      LYS  84 -11.607   2.973  11.171
  Start of MODEL    2
 1190    HE3  LYS  84           HE3      LYS  84 -10.340   4.150  10.841
  Start of MODEL    2
 1191    HZ3  LYS  84           HZ1      LYS  84 -10.261   4.756  13.117
  Start of MODEL    2
 1192    HZ2  LYS  84           HZ2      LYS  84 -10.231   3.058  13.053
  Start of MODEL    2
 1193    HZ1  LYS  84           HZ3      LYS  84 -11.661   3.867  13.482
  Start of MODEL    2
 1194    H    ASP  85           H        ASP  85 -11.843   5.494   5.233
  Start of MODEL    2
 1195    HA   ASP  85           HA       ASP  85 -14.641   4.788   4.777
  Start of MODEL    2
 1196    HB2  ASP  85           HB2      ASP  85 -15.111   6.867   5.671
  Start of MODEL    2
 1197    HB3  ASP  85           HB3      ASP  85 -13.568   7.554   5.171
  Start of MODEL    2
 1198    H    ARG  86           H        ARG  86 -15.251   4.709   2.620
  Start of MODEL    2
 1199    HA   ARG  86           HA       ARG  86 -13.312   4.060   0.732
  Start of MODEL    2
 1200    HB2  ARG  86           HB2      ARG  86 -15.549   3.182   0.668
  Start of MODEL    2
 1201    HB3  ARG  86           HB3      ARG  86 -16.229   4.788   0.481
  Start of MODEL    2
 1202    HG2  ARG  86           HG2      ARG  86 -15.094   4.939  -1.731
  Start of MODEL    2
 1203    HG3  ARG  86           HG3      ARG  86 -14.613   3.253  -1.534
  Start of MODEL    2
 1204    HD2  ARG  86           HD2      ARG  86 -17.421   4.332  -1.642
  Start of MODEL    2
 1205    HD3  ARG  86           HD3      ARG  86 -16.617   3.355  -2.866
  Start of MODEL    2
 1206    HE   ARG  86           HE       ARG  86 -16.607   1.944  -0.434
  Start of MODEL    2
 1207   HH11  ARG  86          HH11      ARG  86 -18.909   3.073  -2.828
  Start of MODEL    2
 1208   HH12  ARG  86          HH12      ARG  86 -20.025   1.770  -2.540
  Start of MODEL    2
 1209   HH21  ARG  86          HH21      ARG  86 -18.054   0.228  -0.082
  Start of MODEL    2
 1210   HH22  ARG  86          HH22      ARG  86 -19.511   0.113  -1.028
  Start of MODEL    2
 1211    H    ALA  87           H        ALA  87 -15.205   7.034   1.124
  Start of MODEL    2
 1212    HA   ALA  87           HA       ALA  87 -14.417   8.197  -1.337
  Start of MODEL    2
 1213    HB2  ALA  87           HB1      ALA  87 -15.296  10.294  -0.425
  Start of MODEL    2
 1214    HB1  ALA  87           HB2      ALA  87 -15.382   9.559   1.179
  Start of MODEL    2
 1215    HB3  ALA  87           HB3      ALA  87 -16.397   8.945  -0.128
  Start of MODEL    2
 1216    H    SER  88           H        SER  88 -13.134   8.398   1.922
  Start of MODEL    2
 1217    HA   SER  88           HA       SER  88 -11.166  10.362   1.465
  Start of MODEL    2
 1218    HB2  SER  88           HB2      SER  88 -11.047   8.049   3.416
  Start of MODEL    2
 1219    HB3  SER  88           HB3      SER  88 -10.180   9.580   3.538
  Start of MODEL    2
 1220    HG   SER  88           HG       SER  88 -13.021   9.370   3.502
  Start of MODEL    2
 1221    H    ALA  89           H        ALA  89 -11.126   6.851   1.237
  Start of MODEL    2
 1222    HA   ALA  89           HA       ALA  89  -8.414   6.512   0.602
  Start of MODEL    2
 1223    HB1  ALA  89           HB1      ALA  89 -10.768   4.772  -0.114
  Start of MODEL    2
 1224    HB3  ALA  89           HB2      ALA  89  -9.811   4.674   1.364
  Start of MODEL    2
 1225    HB2  ALA  89           HB3      ALA  89  -9.075   4.289  -0.193
  Start of MODEL    2
 1226    H    GLU  90           H        GLU  90 -11.254   6.993  -1.458
  Start of MODEL    2
 1227    HA   GLU  90           HA       GLU  90  -9.868   6.519  -3.886
  Start of MODEL    2
 1228    HB2  GLU  90           HB2      GLU  90 -12.425   6.503  -3.355
  Start of MODEL    2
 1229    HB3  GLU  90           HB3      GLU  90 -12.321   8.205  -3.800
  Start of MODEL    2
 1230    HG2  GLU  90           HG2      GLU  90 -11.124   6.135  -5.563
  Start of MODEL    2
 1231    HG3  GLU  90           HG3      GLU  90 -12.860   6.413  -5.593
  Start of MODEL    2
 1232    H    ARG  91           H        ARG  91 -10.608   9.455  -2.039
  Start of MODEL    2
 1233    HA   ARG  91           HA       ARG  91  -9.737  11.316  -3.921
  Start of MODEL    2
 1234    HB2  ARG  91           HB2      ARG  91  -9.484  11.499  -0.926
  Start of MODEL    2
 1235    HB3  ARG  91           HB3      ARG  91  -9.352  12.843  -2.054
  Start of MODEL    2
 1236    HG2  ARG  91           HG2      ARG  91 -11.707  12.082  -2.823
  Start of MODEL    2
 1237    HG3  ARG  91           HG3      ARG  91 -11.743  11.264  -1.259
  Start of MODEL    2
 1238    HD2  ARG  91           HD2      ARG  91 -12.750  13.424  -1.058
  Start of MODEL    2
 1239    HD3  ARG  91           HD3      ARG  91 -11.238  13.390  -0.162
  Start of MODEL    2
 1240    HE   ARG  91           HE       ARG  91 -10.663  14.391  -2.681
  Start of MODEL    2
 1241   HH11  ARG  91          HH11      ARG  91 -12.636  15.312   0.068
  Start of MODEL    2
 1242   HH12  ARG  91          HH12      ARG  91 -12.466  17.016  -0.225
  Start of MODEL    2
 1243   HH21  ARG  91          HH21      ARG  91 -10.444  16.645  -3.070
  Start of MODEL    2
 1244   HH22  ARG  91          HH22      ARG  91 -11.208  17.773  -1.999
  Start of MODEL    2
 1245    H    ALA  92           H        ALA  92  -7.966   9.490  -1.483
  Start of MODEL    2
 1246    HA   ALA  92           HA       ALA  92  -5.397  10.497  -2.003
  Start of MODEL    2
 1247    HB3  ALA  92           HB1      ALA  92  -5.968   9.112  -0.052
  Start of MODEL    2
 1248    HB2  ALA  92           HB2      ALA  92  -4.568   8.489  -0.923
  Start of MODEL    2
 1249    HB1  ALA  92           HB3      ALA  92  -6.140   7.712  -1.110
  Start of MODEL    2
 1250    H    CYS  93           H        CYS  93  -7.256   7.936  -3.583
  Start of MODEL    2
 1251    HA   CYS  93           HA       CYS  93  -5.007   7.078  -5.178
  Start of MODEL    2
 1252    HB2  CYS  93           HB2      CYS  93  -7.917   6.281  -5.336
  Start of MODEL    2
 1253    HB3  CYS  93           HB3      CYS  93  -6.576   5.473  -6.142
  Start of MODEL    2
 1254    HG   CYS  93           HG       CYS  93  -7.130   5.614  -2.766
  Start of MODEL    2
 1255    H    LYS  94           H        LYS  94  -7.217   9.602  -5.424
  Start of MODEL    2
 1256    HA   LYS  94           HA       LYS  94  -7.853   9.566  -8.162
  Start of MODEL    2
 1257    HB2  LYS  94           HB2      LYS  94  -8.922  10.955  -6.320
  Start of MODEL    2
 1258    HB3  LYS  94           HB3      LYS  94  -7.554  12.048  -6.475
  Start of MODEL    2
 1259    HG2  LYS  94           HG2      LYS  94  -9.455  12.874  -7.729
  Start of MODEL    2
 1260    HG3  LYS  94           HG3      LYS  94  -8.139  12.443  -8.822
  Start of MODEL    2
 1261    HD2  LYS  94           HD2      LYS  94  -9.225  10.354  -9.375
  Start of MODEL    2
 1262    HD3  LYS  94           HD3      LYS  94 -10.495  10.663  -8.190
  Start of MODEL    2
 1263    HE2  LYS  94           HE2      LYS  94  -9.937  12.304 -10.660
  Start of MODEL    2
 1264    HE3  LYS  94           HE3      LYS  94 -11.254  11.148 -10.458
  Start of MODEL    2
 1265    HZ3  LYS  94           HZ1      LYS  94 -12.074  13.344 -10.068
  Start of MODEL    2
 1266    HZ2  LYS  94           HZ2      LYS  94 -10.857  13.668  -8.942
  Start of MODEL    2
 1267    HZ1  LYS  94           HZ3      LYS  94 -12.054  12.518  -8.587
  Start of MODEL    2
 1268    H    ASP  95           H        ASP  95  -5.106  10.919  -6.413
  Start of MODEL    2
 1269    HA   ASP  95           HA       ASP  95  -3.829  11.369  -9.033
  Start of MODEL    2
 1270    HB2  ASP  95           HB2      ASP  95  -4.012  13.380  -7.459
  Start of MODEL    2
 1271    HB3  ASP  95           HB3      ASP  95  -2.872  12.537  -6.415
  Start of MODEL    2
 1272    HA   PRO  96           HA       PRO  96  -2.184   7.516  -7.353
  Start of MODEL    2
 1273    HB2  PRO  96           HB2      PRO  96  -1.307   6.513  -9.716
  Start of MODEL    2
 1274    HB3  PRO  96           HB3      PRO  96  -3.004   6.479  -9.224
  Start of MODEL    2
 1275    HG2  PRO  96           HG2      PRO  96  -1.606   8.391 -11.055
  Start of MODEL    2
 1276    HG3  PRO  96           HG3      PRO  96  -3.188   7.615 -11.248
  Start of MODEL    2
 1277    HD2  PRO  96           HD2      PRO  96  -2.921  10.164 -10.385
  Start of MODEL    2
 1278    HD3  PRO  96           HD3      PRO  96  -4.238   9.106  -9.838
  Start of MODEL    2
 1279    H    ASN  97           H        ASN  97  -0.493  10.187  -8.347
  Start of MODEL    2
 1280    HA   ASN  97           HA       ASN  97   2.080   8.782  -8.026
  Start of MODEL    2
 1281    HB2  ASN  97           HB2      ASN  97   1.473  11.093  -9.874
  Start of MODEL    2
 1282    HB3  ASN  97           HB3      ASN  97   3.082  10.457  -9.571
  Start of MODEL    2
 1283   HD21  ASN  97          HD21      ASN  97   2.231   7.691  -9.478
  Start of MODEL    2
 1284   HD22  ASN  97          HD22      ASN  97   1.878   7.238 -11.109
  Start of MODEL    2
 1285    HA   PRO  98           HA       PRO  98   1.728  12.492  -5.090
  Start of MODEL    2
 1286    HB2  PRO  98           HB2      PRO  98   1.685  10.677  -2.832
  Start of MODEL    2
 1287    HB3  PRO  98           HB3      PRO  98   0.486  11.886  -3.296
  Start of MODEL    2
 1288    HG2  PRO  98           HG2      PRO  98   0.049   9.193  -3.415
  Start of MODEL    2
 1289    HG3  PRO  98           HG3      PRO  98  -0.782  10.374  -4.441
  Start of MODEL    2
 1290    HD2  PRO  98           HD2      PRO  98   1.529   8.591  -5.086
  Start of MODEL    2
 1291    HD3  PRO  98           HD3      PRO  98   0.137   9.044  -6.092
  Start of MODEL    2
 1292    H    ILE  99           H        ILE  99   3.543  13.347  -4.135
  Start of MODEL    2
 1293    HA   ILE  99           HA       ILE  99   5.976  11.783  -4.185
  Start of MODEL    2
 1294    HB   ILE  99           HB       ILE  99   5.571  14.616  -3.192
  Start of MODEL    2
 1295   HD11  ILE  99          HD11      ILE  99   6.327  12.462  -6.212
  Start of MODEL    2
 1296   HD13  ILE  99          HD12      ILE  99   7.788  13.419  -5.968
  Start of MODEL    2
 1297   HD12  ILE  99          HD13      ILE  99   6.651  13.853  -7.244
  Start of MODEL    2
 1298    H    ILE 100           H        ILE 100   6.384  10.413  -2.568
  Start of MODEL    2
 1299    HA   ILE 100           HA       ILE 100   5.703  11.255   0.181
  Start of MODEL    2
 1300    HB   ILE 100           HB       ILE 100   5.700   8.426  -0.894
  Start of MODEL    2
 1301   HD12  ILE 100          HD11      ILE 100   1.955   8.417  -0.907
  Start of MODEL    2
 1302   HD11  ILE 100          HD12      ILE 100   2.929   7.849   0.448
  Start of MODEL    2
 1303   HD13  ILE 100          HD13      ILE 100   3.374   7.411  -1.200
  Start of MODEL    2
 1304    H    ASP 101           H        ASP 101   7.396  11.518   1.444
  Start of MODEL    2
 1305    HA   ASP 101           HA       ASP 101   9.476  11.383   2.366
  Start of MODEL    2
 1306    HB2  ASP 101           HB2      ASP 101   8.708   8.996   2.671
  Start of MODEL    2
 1307    HB3  ASP 101           HB3      ASP 101   9.572   8.591   1.194
  Start of MODEL    2
 1308    H    GLY 102           H        GLY 102   9.247  12.584  -0.134
  Start of MODEL    2
 1309    HA2  GLY 102           HA2      GLY 102  10.733  13.616  -1.559
  Start of MODEL    2
 1310    HA3  GLY 102           HA3      GLY 102  12.012  12.615  -0.899
  Start of MODEL    2
 1311    H    ARG 103           H        ARG 103   9.477  10.672  -1.933
  Start of MODEL    2
 1312    HA   ARG 103           HA       ARG 103  10.633  10.421  -4.623
  Start of MODEL    2
 1313    HB2  ARG 103           HB2      ARG 103  11.681   8.697  -3.284
  Start of MODEL    2
 1314    HB3  ARG 103           HB3      ARG 103  10.118   8.170  -2.672
  Start of MODEL    2
 1315    HG2  ARG 103           HG2      ARG 103   9.536   7.156  -4.691
  Start of MODEL    2
 1316    HG3  ARG 103           HG3      ARG 103  10.729   8.082  -5.606
  Start of MODEL    2
 1317    HD2  ARG 103           HD2      ARG 103  12.527   6.839  -4.645
  Start of MODEL    2
 1318    HD3  ARG 103           HD3      ARG 103  11.438   6.038  -3.513
  Start of MODEL    2
 1319    HE   ARG 103           HE       ARG 103  10.447   5.359  -5.940
  Start of MODEL    2
 1320   HH11  ARG 103          HH11      ARG 103  13.645   5.190  -4.546
  Start of MODEL    2
 1321   HH12  ARG 103          HH12      ARG 103  14.076   3.730  -5.374
  Start of MODEL    2
 1322   HH21  ARG 103          HH21      ARG 103  11.017   3.434  -7.066
  Start of MODEL    2
 1323   HH22  ARG 103          HH22      ARG 103  12.586   2.744  -6.827
  Start of MODEL    2
 1324    H    LYS 104           H        LYS 104   9.177  10.159  -6.227
  Start of MODEL    2
 1325    HA   LYS 104           HA       LYS 104   6.407  10.431  -5.672
  Start of MODEL    2
 1326    HB2  LYS 104           HB2      LYS 104   7.359  11.290  -7.743
  Start of MODEL    2
 1327    HB3  LYS 104           HB3      LYS 104   7.805   9.664  -8.243
  Start of MODEL    2
 1328    HG2  LYS 104           HG2      LYS 104   5.496   9.032  -8.438
  Start of MODEL    2
 1329    HG3  LYS 104           HG3      LYS 104   4.973  10.585  -7.781
  Start of MODEL    2
 1330    HD2  LYS 104           HD2      LYS 104   6.595  10.319 -10.306
  Start of MODEL    2
 1331    HD3  LYS 104           HD3      LYS 104   4.833  10.316 -10.295
  Start of MODEL    2
 1332    HE2  LYS 104           HE2      LYS 104   6.476  12.538  -9.095
  Start of MODEL    2
 1333    HE3  LYS 104           HE3      LYS 104   5.943  12.541 -10.776
  Start of MODEL    2
 1334    HZ3  LYS 104           HZ1      LYS 104   3.688  12.586 -10.103
  Start of MODEL    2
 1335    HZ2  LYS 104           HZ2      LYS 104   4.475  13.775  -9.188
  Start of MODEL    2
 1336    HZ1  LYS 104           HZ3      LYS 104   4.071  12.289  -8.483
  Start of MODEL    2
 1337    H    ALA 105           H        ALA 105   4.969   8.972  -5.189
  Start of MODEL    2
 1338    HA   ALA 105           HA       ALA 105   5.692   6.134  -5.429
  Start of MODEL    2
 1339    HB1  ALA 105           HB1      ALA 105   3.802   7.517  -3.526
  Start of MODEL    2
 1340    HB3  ALA 105           HB2      ALA 105   5.396   6.863  -3.140
  Start of MODEL    2
 1341    HB2  ALA 105           HB3      ALA 105   4.083   5.777  -3.595
  Start of MODEL    2
 1342    H    ASN 106           H        ASN 106   3.903   4.658  -5.812
  Start of MODEL    2
 1343    HA   ASN 106           HA       ASN 106   1.877   5.861  -7.583
  Start of MODEL    2
 1344    HB2  ASN 106           HB2      ASN 106   3.157   3.117  -7.690
  Start of MODEL    2
 1345    HB3  ASN 106           HB3      ASN 106   1.753   3.577  -8.649
  Start of MODEL    2
 1346   HD21  ASN 106          HD21      ASN 106   4.416   2.764  -9.503
  Start of MODEL    2
 1347   HD22  ASN 106          HD22      ASN 106   5.016   4.053 -10.479
  Start of MODEL    2
 1348    H    VAL 107           H        VAL 107  -0.031   5.921  -6.664
  Start of MODEL    2
 1349    HA   VAL 107           HA       VAL 107  -0.664   3.924  -4.596
  Start of MODEL    2
 1350    HB   VAL 107           HB       VAL 107  -1.638   6.768  -4.907
  Start of MODEL    2
 1351    H    ASN 108           H        ASN 108  -2.292   2.585  -4.952
  Start of MODEL    2
 1352    HA   ASN 108           HA       ASN 108  -4.679   3.493  -6.329
  Start of MODEL    2
 1353    HB2  ASN 108           HB2      ASN 108  -4.755   1.580  -7.875
  Start of MODEL    2
 1354    HB3  ASN 108           HB3      ASN 108  -3.347   2.585  -8.193
  Start of MODEL    2
 1355   HD21  ASN 108          HD21      ASN 108  -4.469  -0.483  -6.963
  Start of MODEL    2
 1356   HD22  ASN 108          HD22      ASN 108  -2.926  -1.263  -6.962
  Start of MODEL    2
 1357    H    LEU 109           H        LEU 109  -6.518   2.223  -5.815
  Start of MODEL    2
 1358    HA   LEU 109           HA       LEU 109  -6.596   0.908  -3.375
  Start of MODEL    2
 1359    HB2  LEU 109           HB2      LEU 109  -8.406   0.544  -5.768
  Start of MODEL    2
 1360    HB3  LEU 109           HB3      LEU 109  -8.768  -0.020  -4.148
  Start of MODEL    2
 1361    HG   LEU 109           HG       LEU 109  -8.395   2.871  -4.939
  Start of MODEL    2
 1362   HD13  LEU 109          HD11      LEU 109 -10.446   1.885  -5.862
  Start of MODEL    2
 1363   HD12  LEU 109          HD12      LEU 109 -10.795   3.075  -4.605
  Start of MODEL    2
 1364   HD11  LEU 109          HD13      LEU 109 -10.907   1.350  -4.244
  Start of MODEL    2
 1365   HD23  LEU 109          HD21      LEU 109  -9.277   1.629  -2.335
  Start of MODEL    2
 1366   HD22  LEU 109          HD22      LEU 109  -9.208   3.356  -2.688
  Start of MODEL    2
 1367   HD21  LEU 109          HD23      LEU 109  -7.723   2.405  -2.634
  Start of MODEL    2
 1368    H    ALA 110           H        ALA 110  -6.222  -1.124  -2.698
  Start of MODEL    2
 1369    HA   ALA 110           HA       ALA 110  -4.231  -2.498  -4.073
  Start of MODEL    2
 1370    HB1  ALA 110           HB1      ALA 110  -4.490  -2.463  -1.633
  Start of MODEL    2
 1371    HB3  ALA 110           HB2      ALA 110  -4.310  -4.100  -2.271
  Start of MODEL    2
 1372    HB2  ALA 110           HB3      ALA 110  -5.901  -3.515  -1.785
  Start of MODEL    2
 1373    H    TYR 111           H        TYR 111  -7.705  -3.086  -4.058
  Start of MODEL    2
 1374    HA   TYR 111           HA       TYR 111  -7.535  -5.774  -4.947
  Start of MODEL    2
 1375    HB2  TYR 111           HB2      TYR 111  -9.862  -5.743  -5.175
  Start of MODEL    2
 1376    HB3  TYR 111           HB3      TYR 111  -9.542  -4.600  -3.881
  Start of MODEL    2
 1377    HD1  TYR 111           HD1      TYR 111  -9.137  -2.066  -4.906
  Start of MODEL    2
 1378    HD2  TYR 111           HD2      TYR 111 -11.510  -5.149  -6.625
  Start of MODEL    2
 1379    HE1  TYR 111           HE1      TYR 111 -10.464  -0.372  -6.093
  Start of MODEL    2
 1380    HE2  TYR 111           HE2      TYR 111 -12.839  -3.467  -7.822
  Start of MODEL    2
 1381    HH   TYR 111           HH       TYR 111 -11.882  -0.214  -8.112
  Start of MODEL    2
 1382    H    LEU 112           H        LEU 112  -7.029  -2.843  -6.568
  Start of MODEL    2
 1383    HA   LEU 112           HA       LEU 112  -7.795  -3.650  -9.188
  Start of MODEL    2
 1384    HB2  LEU 112           HB2      LEU 112  -5.942  -1.475  -8.235
  Start of MODEL    2
 1385    HB3  LEU 112           HB3      LEU 112  -6.424  -1.693  -9.908
  Start of MODEL    2
 1386    HG   LEU 112           HG       LEU 112  -8.253  -1.037  -7.600
  Start of MODEL    2
 1387   HD11  LEU 112          HD11      LEU 112  -7.392   0.576  -9.995
  Start of MODEL    2
 1388   HD13  LEU 112          HD12      LEU 112  -6.897   0.847  -8.324
  Start of MODEL    2
 1389   HD12  LEU 112          HD13      LEU 112  -8.583   1.072  -8.794
  Start of MODEL    2
 1390   HD23  LEU 112          HD21      LEU 112  -8.894  -1.401 -10.523
  Start of MODEL    2
 1391   HD22  LEU 112          HD22      LEU 112 -10.022  -0.937  -9.250
  Start of MODEL    2
 1392   HD21  LEU 112          HD23      LEU 112  -9.291  -2.542  -9.237
  Start of MODEL    2
 1393    H    GLY 113           H        GLY 113  -5.254  -4.778  -7.307
  Start of MODEL    2
 1394    HA2  GLY 113           HA2      GLY 113  -3.842  -5.721  -9.660
  Start of MODEL    2
 1395    HA3  GLY 113           HA3      GLY 113  -2.916  -4.664  -8.598
  Start of MODEL    2
 1396    H    ALA 114           H        ALA 114  -5.243  -6.526  -6.998
  Start of MODEL    2
 1397    HA   ALA 114           HA       ALA 114  -3.197  -8.010  -5.619
  Start of MODEL    2
 1398    HB3  ALA 114           HB1      ALA 114  -4.996  -8.757  -4.173
  Start of MODEL    2
 1399    HB2  ALA 114           HB2      ALA 114  -6.200  -8.111  -5.290
  Start of MODEL    2
 1400    HB1  ALA 114           HB3      ALA 114  -5.117  -7.016  -4.428
  Start of MODEL    2
 1401    H    LYS 115           H        LYS 115  -2.919 -10.252  -5.607
  Start of MODEL    2
 1402    HA   LYS 115           HA       LYS 115  -3.845 -11.607  -7.976
  Start of MODEL    2
 1403    HB2  LYS 115           HB2      LYS 115  -1.982 -12.417  -5.761
  Start of MODEL    2
 1404    HB3  LYS 115           HB3      LYS 115  -2.580 -13.589  -6.928
  Start of MODEL    2
 1405    HG2  LYS 115           HG2      LYS 115  -0.437 -12.852  -7.649
  Start of MODEL    2
 1406    HG3  LYS 115           HG3      LYS 115  -1.646 -12.185  -8.744
  Start of MODEL    2
 1407    HD2  LYS 115           HD2      LYS 115  -1.524 -10.050  -7.461
  Start of MODEL    2
 1408    HD3  LYS 115           HD3      LYS 115  -0.191 -10.740  -6.530
  Start of MODEL    2
 1409    HE2  LYS 115           HE2      LYS 115   1.015 -11.123  -8.679
  Start of MODEL    2
 1410    HE3  LYS 115           HE3      LYS 115  -0.273 -10.249  -9.505
  Start of MODEL    2
 1411    HZ1  LYS 115           HZ1      LYS 115   0.267  -8.325  -8.044
  Start of MODEL    2
 1412    HZ3  LYS 115           HZ2      LYS 115   1.499  -8.752  -9.125
  Start of MODEL    2
 1413    HZ2  LYS 115           HZ3      LYS 115   1.625  -9.177  -7.486
  Start of MODEL    2
 1414    HA   PRO 116           HA       PRO 116  -7.320 -13.345  -5.864
  Start of MODEL    2
 1415    HB2  PRO 116           HB2      PRO 116  -8.557 -14.244  -8.055
  Start of MODEL    2
 1416    HB3  PRO 116           HB3      PRO 116  -8.405 -12.515  -7.726
  Start of MODEL    2
 1417    HG2  PRO 116           HG2      PRO 116  -6.905 -14.214  -9.659
  Start of MODEL    2
 1418    HG3  PRO 116           HG3      PRO 116  -7.402 -12.521  -9.797
  Start of MODEL    2
 1419    HD2  PRO 116           HD2      PRO 116  -4.855 -13.472  -9.049
  Start of MODEL    2
 1420    HD3  PRO 116           HD3      PRO 116  -5.449 -11.806  -8.913
  Start of MODEL    2
 1421    H    ARG 117           H        ARG 117  -5.329 -14.923  -5.194
  Start of MODEL    2
 1422    HA   ARG 117           HA       ARG 117  -4.868 -17.066  -4.568
  Start of MODEL    2
 1423    HB2  ARG 117           HB2      ARG 117  -7.516 -17.483  -5.903
  Start of MODEL    2
 1424    HB3  ARG 117           HB3      ARG 117  -6.554 -18.875  -5.431
  Start of MODEL    2
 1425    HG2  ARG 117           HG2      ARG 117  -7.306 -16.697  -3.504
  Start of MODEL    2
 1426    HG3  ARG 117           HG3      ARG 117  -8.321 -18.109  -3.799
  Start of MODEL    2
 1427    HD2  ARG 117           HD2      ARG 117  -6.311 -19.524  -3.232
  Start of MODEL    2
 1428    HD3  ARG 117           HD3      ARG 117  -5.522 -18.044  -2.689
  Start of MODEL    2
 1429    HE   ARG 117           HE       ARG 117  -7.846 -18.029  -1.307
  Start of MODEL    2
 1430   HH11  ARG 117          HH11      ARG 117  -5.427 -20.513  -1.794
  Start of MODEL    2
 1431   HH12  ARG 117          HH12      ARG 117  -5.644 -21.216  -0.217
  Start of MODEL    2
 1432   HH21  ARG 117          HH21      ARG 117  -8.142 -18.945   0.748
  Start of MODEL    2
 1433   HH22  ARG 117          HH22      ARG 117  -7.194 -20.320   1.237
  Start of MODEL    2
 1434    H    THR 118           H        THR 118  -4.120 -15.840  -7.259
  Start of MODEL    2
 1435    HA   THR 118           HA       THR 118  -3.879 -18.051  -9.050
  Start of MODEL    2
 1436    HB   THR 118           HB       THR 118  -2.236 -16.427 -10.231
  Start of MODEL    2
 1437    HG1  THR 118           HG1      THR 118  -2.612 -14.230  -9.562
  Start of MODEL    2
 1438   HG23  THR 118          HG21      THR 118  -4.525 -16.853 -10.989
  Start of MODEL    2
 1439   HG22  THR 118          HG22      THR 118  -4.109 -15.147 -11.166
  Start of MODEL    2
 1440   HG21  THR 118          HG23      THR 118  -5.131 -15.671  -9.828
  Start of MODEL    2
 1441    H    ASN 119           H        ASN 119  -1.373 -16.161  -7.299
  Start of MODEL    2
 1442    HA   ASN 119           HA       ASN 119   0.090 -18.637  -6.828
  Start of MODEL    2
 1443    HB2  ASN 119           HB2      ASN 119   0.850 -17.720  -9.063
  Start of MODEL    2
 1444    HB3  ASN 119           HB3      ASN 119   1.464 -16.315  -8.201
  Start of MODEL    2
 1445   HD21  ASN 119          HD21      ASN 119   2.930 -18.211  -9.795
  Start of MODEL    2
 1446   HD22  ASN 119          HD22      ASN 119   4.115 -18.919  -8.757
  Start of MODEL    2
 1447    H    VAL 120           H        VAL 120   0.064 -18.471  -4.668
  Start of MODEL    2
 1448    HA   VAL 120           HA       VAL 120   1.657 -16.302  -3.490
  Start of MODEL    2
 1449    HB   VAL 120           HB       VAL 120  -0.921 -17.341  -2.274
  Start of MODEL    2
 1450    H    GLN 121           H        GLN 121   3.347 -17.237  -2.485
  Start of MODEL    2
 1451    HA   GLN 121           HA       GLN 121   3.001 -19.627  -0.895
  Start of MODEL    2
 1452    HB2  GLN 121           HB2      GLN 121   3.403 -20.498  -3.178
  Start of MODEL    2
 1453    HB3  GLN 121           HB3      GLN 121   4.918 -19.609  -3.238
  Start of MODEL    2
 1454    HG2  GLN 121           HG2      GLN 121   5.749 -20.938  -1.350
  Start of MODEL    2
 1455    HG3  GLN 121           HG3      GLN 121   4.237 -21.846  -1.341
  Start of MODEL    2
 1456   HE21  GLN 121          HE21      GLN 121   7.198 -21.228  -3.042
  Start of MODEL    2
 1457   HE22  GLN 121          HE22      GLN 121   7.119 -22.602  -4.085
  Start of MODEL    2
 1458    H5'   DG   1           H5'       DG   1  12.244  -5.948  -1.494
  Start of MODEL    2
 1459    H4'   DG   1           H4'       DG   1  13.352  -4.869  -3.342
  Start of MODEL    2
 1460    H3'   DG   1           H3'       DG   1  15.342  -6.681  -3.320
  Start of MODEL    2
 1461    H2'   DG   1           H2'       DG   1  16.293  -6.048  -1.189
  Start of MODEL    2
 1462    H1'   DG   1           H1'       DG   1  15.887  -3.143  -2.067
  Start of MODEL    2
 1463    H8    DG   1           H8        DG   1  14.158  -4.299   0.994
  Start of MODEL    2
 1464    H1    DG   1           H1        DG   1  19.773  -1.465   2.253
  Start of MODEL    2
 1465    H22   DG   1           H21       DG   1  20.337  -1.775  -1.148
  Start of MODEL    2
 1466    H21   DG   1           H22       DG   1  20.946  -1.259   0.408
  Start of MODEL    2
 1467   HO5'   DG   1           H5T       DG   1  14.163  -6.099  -0.152
  Start of MODEL    2
 1468   H5''   DG   1          5H''       DG   1  13.033  -7.132  -2.551
  Start of MODEL    2
 1469   H2''   DG   1          2H''       DG   1  17.281  -5.123  -2.308
  Start of MODEL    2
 1470    H5'   DG   2           H5'       DG   2  14.861  -5.066  -8.335
  Start of MODEL    2
 1471    H4'   DG   2           H4'       DG   2  13.083  -3.782  -8.565
  Start of MODEL    2
 1472    H3'   DG   2           H3'       DG   2  14.916  -2.561 -10.161
  Start of MODEL    2
 1473    H2'   DG   2           H2'       DG   2  15.575  -0.832  -8.634
  Start of MODEL    2
 1474    H1'   DG   2           H1'       DG   2  12.644  -0.648  -7.759
  Start of MODEL    2
 1475    H8    DG   2           H8        DG   2  16.286   0.085  -6.887
  Start of MODEL    2
 1476    H1    DG   2           H1        DG   2  12.009   1.840  -2.428
  Start of MODEL    2
 1477    H22   DG   2           H21       DG   2   9.741   0.109  -4.393
  Start of MODEL    2
 1478    H21   DG   2           H22       DG   2  10.011   1.081  -2.965
  Start of MODEL    2
 1479   H5''   DG   2          5H''       DG   2  15.969  -3.701  -8.585
  Start of MODEL    2
 1480   H2''   DG   2          2H''       DG   2  14.258  -0.036  -9.477
  Start of MODEL    2
 1481    H5'   DT   3           H5'       DT   3  10.854  -4.639  -8.979
  Start of MODEL    2
 1482    H4'   DT   3           H4'       DT   3   8.730  -5.671  -9.435
  Start of MODEL    2
 1483    H3'   DT   3           H3'       DT   3   9.057  -5.563 -12.075
  Start of MODEL    2
 1484    H2'   DT   3           H2'       DT   3   9.162  -3.149 -12.269
  Start of MODEL    2
 1485    H1'   DT   3           H1'       DT   3   6.707  -2.977 -10.458
  Start of MODEL    2
 1486    H3    DT   3           H3        DT   3   7.566   1.379 -11.972
  Start of MODEL    2
 1487    H73   DT   3           H71       DT   3  11.247   0.943  -8.744
  Start of MODEL    2
 1488    H72   DT   3           H72       DT   3  10.309   0.042  -7.531
  Start of MODEL    2
 1489    H71   DT   3           H73       DT   3   9.879   1.726  -7.915
  Start of MODEL    2
 1490    H6    DT   3           H6        DT   3   9.383  -1.706  -8.815
  Start of MODEL    2
 1491   H5''   DT   3          5H''       DT   3  10.946  -5.537 -10.514
  Start of MODEL    2
 1492   H2''   DT   3          2H''       DT   3   7.476  -3.479 -12.678
  Start of MODEL    2
 1493    H5'   DG   4           H5'       DG   4   4.213  -7.091  -9.293
  Start of MODEL    2
 1494    H4'   DG   4           H4'       DG   4   5.875  -6.271  -7.431
  Start of MODEL    2
 1495    H3'   DG   4           H3'       DG   4   3.118  -5.909  -7.804
  Start of MODEL    2
 1496    H2'   DG   4           H2'       DG   4   3.137  -3.584  -8.235
  Start of MODEL    2
 1497    H1'   DG   4           H1'       DG   4   5.737  -3.329  -6.646
  Start of MODEL    2
 1498    H8    DG   4           H8        DG   4   6.853  -1.097  -7.129
  Start of MODEL    2
 1499    H1    DG   4           H1        DG   4   3.119  -0.066 -12.249
  Start of MODEL    2
 1500    H22   DG   4           H21       DG   4   1.912  -3.261 -11.619
  Start of MODEL    2
 1501    H21   DG   4           H22       DG   4   1.834  -1.827 -12.614
  Start of MODEL    2
 1502   H5''   DG   4          5H''       DG   4   4.935  -5.749 -10.205
  Start of MODEL    2
 1503   H2''   DG   4          2H''       DG   4   3.364  -3.479  -6.491
  Start of MODEL    2
 1504    H5'   DT   5           H5'       DT   5   3.681  -8.859  -2.817
  Start of MODEL    2
 1505    H4'   DT   5           H4'       DT   5   2.186  -8.036  -1.404
  Start of MODEL    2
 1506    H3'   DT   5           H3'       DT   5   0.938 -10.070  -2.709
  Start of MODEL    2
 1507    H2'   DT   5           H2'       DT   5  -0.313  -8.733  -4.265
  Start of MODEL    2
 1508    H1'   DT   5           H1'       DT   5  -0.745  -6.705  -2.009
  Start of MODEL    2
 1509    H3    DT   5           H3        DT   5  -3.085  -3.983  -4.672
  Start of MODEL    2
 1510    H72   DT   5           H71       DT   5   1.459  -4.643  -7.148
  Start of MODEL    2
 1511    H73   DT   5           H72       DT   5   0.444  -5.857  -7.962
  Start of MODEL    2
 1512    H71   DT   5           H73       DT   5  -0.007  -4.135  -8.020
  Start of MODEL    2
 1513    H6    DT   5           H6        DT   5   0.904  -6.510  -5.291
  Start of MODEL    2
 1514   H5''   DT   5          5H''       DT   5   2.474  -9.152  -4.087
  Start of MODEL    2
 1515   H2''   DT   5          2H''       DT   5  -1.454  -8.836  -2.933
  Start of MODEL    2
 1516    H5'   DG   6           H5'       DG   6   2.987  -7.618   1.327
  Start of MODEL    2
 1517    H4'   DG   6           H4'       DG   6   3.535  -8.383   3.622
  Start of MODEL    2
 1518    H3'   DG   6           H3'       DG   6   1.916 -10.536   3.254
  Start of MODEL    2
 1519    H2'   DG   6           H2'       DG   6  -0.191  -9.447   3.288
  Start of MODEL    2
 1520    H1'   DG   6           H1'       DG   6   0.807  -7.491   5.411
  Start of MODEL    2
 1521    H8    DG   6           H8        DG   6  -1.056  -7.846   2.036
  Start of MODEL    2
 1522    H1    DG   6           H1        DG   6  -3.231  -3.263   5.976
  Start of MODEL    2
 1523    H22   DG   6           H21       DG   6  -0.570  -4.190   7.997
  Start of MODEL    2
 1524    H21   DG   6           H22       DG   6  -1.969  -3.162   7.780
  Start of MODEL    2
 1525   H5''   DG   6          5H''       DG   6   3.306  -9.357   1.472
  Start of MODEL    2
 1526   H2''   DG   6          2H''       DG   6   0.014  -9.716   5.014
  Start of MODEL    2
 1527    H5'   DC   7           H5'       DC   7   3.737 -12.036   2.000
  Start of MODEL    2
 1528    H4'   DC   7           H4'       DC   7   5.395 -13.578   2.931
  Start of MODEL    2
 1529    H3'   DC   7           H3'       DC   7   3.638 -14.258   1.005
  Start of MODEL    2
 1530   HO3'   DC   7           H3T       DC   7   4.878 -16.402   1.209
  Start of MODEL    2
 1531    H2'   DC   7           H2'       DC   7   1.963 -15.267   2.374
  Start of MODEL    2
 1532    H1'   DC   7           H1'       DC   7   4.145 -16.540   4.090
  Start of MODEL    2
 1533    H42   DC   7           H41       DC   7  -1.523 -16.162   7.520
  Start of MODEL    2
 1534    H41   DC   7           H42       DC   7  -0.589 -17.482   8.185
  Start of MODEL    2
 1535    H5    DC   7           H5        DC   7  -0.719 -14.750   5.719
  Start of MODEL    2
 1536    H6    DC   7           H6        DC   7   1.117 -14.366   4.158
  Start of MODEL    2
 1537   H5''   DC   7          5H''       DC   7   2.516 -12.704   3.102
  Start of MODEL    2
 1538   H2''   DC   7          2H''       DC   7   2.954 -16.673   2.012
  Start of MODEL    3
 1539    H1   GLY  25           HT1      GLY  25 -10.291 -17.371  -3.080
  Start of MODEL    3
 1540    H2   GLY  25           HT2      GLY  25  -8.689 -16.831  -3.140
  Start of MODEL    3
 1541    H3   GLY  25           HT3      GLY  25  -9.328 -17.709  -4.439
  Start of MODEL    3
 1542    HA3  GLY  25           HA2      GLY  25 -10.961 -15.888  -4.794
  Start of MODEL    3
 1543    HA2  GLY  25           HA3      GLY  25  -9.286 -15.455  -5.111
  Start of MODEL    3
 1544    H    ALA  26           H        ALA  26  -9.594 -13.259  -4.734
  Start of MODEL    3
 1545    HA   ALA  26           HA       ALA  26  -9.433 -12.618  -1.898
  Start of MODEL    3
 1546    HB1  ALA  26           HB1      ALA  26  -7.704 -11.807  -3.461
  Start of MODEL    3
 1547    HB3  ALA  26           HB2      ALA  26  -8.518 -10.500  -2.601
  Start of MODEL    3
 1548    HB2  ALA  26           HB3      ALA  26  -8.934 -10.842  -4.280
  Start of MODEL    3
 1549    H    MET  27           H        MET  27 -11.880 -12.838  -4.048
  Start of MODEL    3
 1550    HA   MET  27           HA       MET  27 -13.236 -10.367  -3.709
  Start of MODEL    3
 1551    HB2  MET  27           HB2      MET  27 -13.588 -12.010  -5.583
  Start of MODEL    3
 1552    HB3  MET  27           HB3      MET  27 -14.445 -13.035  -4.443
  Start of MODEL    3
 1553    HG2  MET  27           HG2      MET  27 -16.011 -11.786  -5.771
  Start of MODEL    3
 1554    HG3  MET  27           HG3      MET  27 -16.091 -11.253  -4.092
  Start of MODEL    3
 1555    HE3  MET  27           HE1      MET  27 -17.387  -9.603  -6.458
  Start of MODEL    3
 1556    HE2  MET  27           HE2      MET  27 -16.874  -7.961  -6.064
  Start of MODEL    3
 1557    HE1  MET  27           HE3      MET  27 -17.409  -9.050  -4.782
  Start of MODEL    3
 1558    H    GLY  28           H        GLY  28 -12.665 -12.830  -1.556
  Start of MODEL    3
 1559    HA2  GLY  28           HA2      GLY  28 -15.151 -12.906  -0.158
  Start of MODEL    3
 1560    HA3  GLY  28           HA3      GLY  28 -13.605 -13.493   0.435
  Start of MODEL    3
 1561    H    SER  29           H        SER  29 -12.435 -10.749  -0.105
  Start of MODEL    3
 1562    HA   SER  29           HA       SER  29 -13.435  -9.538   2.370
  Start of MODEL    3
 1563    HB2  SER  29           HB2      SER  29 -11.006 -10.127   2.228
  Start of MODEL    3
 1564    HB3  SER  29           HB3      SER  29 -10.844  -8.965   0.913
  Start of MODEL    3
 1565    HG   SER  29           HG       SER  29 -11.988  -8.087   3.326
  Start of MODEL    3
 1566    H    ARG  30           H        ARG  30 -15.141  -8.382   1.723
  Start of MODEL    3
 1567    HA   ARG  30           HA       ARG  30 -14.796  -6.496  -0.497
  Start of MODEL    3
 1568    HB2  ARG  30           HB2      ARG  30 -17.373  -6.298  -0.207
  Start of MODEL    3
 1569    HB3  ARG  30           HB3      ARG  30 -16.700  -7.714  -0.992
  Start of MODEL    3
 1570    HG2  ARG  30           HG2      ARG  30 -18.386  -8.472   0.474
  Start of MODEL    3
 1571    HG3  ARG  30           HG3      ARG  30 -16.841  -8.895   1.217
  Start of MODEL    3
 1572    HD2  ARG  30           HD2      ARG  30 -18.095  -8.016   2.972
  Start of MODEL    3
 1573    HD3  ARG  30           HD3      ARG  30 -17.051  -6.688   2.459
  Start of MODEL    3
 1574    HE   ARG  30           HE       ARG  30 -19.707  -6.782   1.281
  Start of MODEL    3
 1575   HH11  ARG  30          HH11      ARG  30 -17.626  -5.413   3.733
  Start of MODEL    3
 1576   HH12  ARG  30          HH12      ARG  30 -18.622  -4.008   3.971
  Start of MODEL    3
 1577   HH21  ARG  30          HH21      ARG  30 -21.031  -4.988   1.602
  Start of MODEL    3
 1578   HH22  ARG  30          HH22      ARG  30 -20.592  -3.784   2.788
  Start of MODEL    3
 1579    H    ASP  31           H        ASP  31 -14.441  -6.579   2.695
  Start of MODEL    3
 1580    HA   ASP  31           HA       ASP  31 -15.567  -3.982   3.327
  Start of MODEL    3
 1581    HB2  ASP  31           HB2      ASP  31 -14.156  -4.508   5.508
  Start of MODEL    3
 1582    HB3  ASP  31           HB3      ASP  31 -15.707  -5.286   5.212
  Start of MODEL    3
 1583    H    THR  32           H        THR  32 -12.517  -5.409   2.477
  Start of MODEL    3
 1584    HA   THR  32           HA       THR  32 -11.099  -2.870   2.877
  Start of MODEL    3
 1585    HB   THR  32           HB       THR  32  -9.100  -4.164   2.068
  Start of MODEL    3
 1586    HG1  THR  32           HG1      THR  32 -10.481  -6.564   2.491
  Start of MODEL    3
 1587   HG23  THR  32          HG21      THR  32  -9.580  -3.906   4.470
  Start of MODEL    3
 1588   HG22  THR  32          HG22      THR  32  -8.786  -5.438   4.104
  Start of MODEL    3
 1589   HG21  THR  32          HG23      THR  32 -10.520  -5.397   4.429
  Start of MODEL    3
 1590    H    MET  33           H        MET  33 -12.998  -4.167   0.512
  Start of MODEL    3
 1591    HA   MET  33           HA       MET  33 -11.626  -4.171  -1.838
  Start of MODEL    3
 1592    HB2  MET  33           HB2      MET  33 -13.986  -4.781  -1.616
  Start of MODEL    3
 1593    HB3  MET  33           HB3      MET  33 -14.415  -3.098  -1.423
  Start of MODEL    3
 1594    HG2  MET  33           HG2      MET  33 -13.659  -2.602  -3.657
  Start of MODEL    3
 1595    HG3  MET  33           HG3      MET  33 -13.109  -4.261  -3.869
  Start of MODEL    3
 1596    HE1  MET  33           HE1      MET  33 -15.328  -6.045  -2.681
  Start of MODEL    3
 1597    HE3  MET  33           HE2      MET  33 -14.625  -6.293  -4.280
  Start of MODEL    3
 1598    HE2  MET  33           HE3      MET  33 -16.376  -6.291  -4.078
  Start of MODEL    3
 1599    H    PHE  34           H        PHE  34 -13.325  -1.276  -0.548
  Start of MODEL    3
 1600    HA   PHE  34           HA       PHE  34 -11.827   0.296  -2.524
  Start of MODEL    3
 1601    HB2  PHE  34           HB2      PHE  34 -14.394   0.823  -1.029
  Start of MODEL    3
 1602    HB3  PHE  34           HB3      PHE  34 -13.541   2.081  -1.909
  Start of MODEL    3
 1603    HD1  PHE  34           HD1      PHE  34 -15.601  -0.901  -2.170
  Start of MODEL    3
 1604    HD2  PHE  34           HD2      PHE  34 -13.448   2.051  -4.351
  Start of MODEL    3
 1605    HE1  PHE  34           HE1      PHE  34 -16.743  -1.595  -4.233
  Start of MODEL    3
 1606    HE2  PHE  34           HE2      PHE  34 -14.589   1.364  -6.416
  Start of MODEL    3
 1607    HZ   PHE  34           HZ       PHE  34 -16.320  -0.350  -6.345
  Start of MODEL    3
 1608    H    THR  35           H        THR  35 -11.525  -0.608   0.594
  Start of MODEL    3
 1609    HA   THR  35           HA       THR  35 -10.764   2.047   1.568
  Start of MODEL    3
 1610    HB   THR  35           HB       THR  35 -10.749   0.911   3.822
  Start of MODEL    3
 1611    HG1  THR  35           HG1      THR  35 -12.229  -1.126   3.530
  Start of MODEL    3
 1612   HG21  THR  35          HG21      THR  35 -13.333   0.840   2.252
  Start of MODEL    3
 1613   HG23  THR  35          HG22      THR  35 -12.659   2.244   3.082
  Start of MODEL    3
 1614   HG22  THR  35          HG23      THR  35 -13.205   0.848   4.014
  Start of MODEL    3
 1615    H    LYS  36           H        LYS  36  -9.448  -1.079   0.698
  Start of MODEL    3
 1616    HA   LYS  36           HA       LYS  36  -6.982  -0.645   2.143
  Start of MODEL    3
 1617    HB2  LYS  36           HB2      LYS  36  -7.989  -2.868   2.040
  Start of MODEL    3
 1618    HB3  LYS  36           HB3      LYS  36  -7.967  -2.822   0.289
  Start of MODEL    3
 1619    HG2  LYS  36           HG2      LYS  36  -5.591  -3.018   0.246
  Start of MODEL    3
 1620    HG3  LYS  36           HG3      LYS  36  -5.497  -2.818   2.002
  Start of MODEL    3
 1621    HD2  LYS  36           HD2      LYS  36  -6.673  -4.881   2.367
  Start of MODEL    3
 1622    HD3  LYS  36           HD3      LYS  36  -7.003  -5.050   0.645
  Start of MODEL    3
 1623    HE2  LYS  36           HE2      LYS  36  -4.216  -5.002   1.770
  Start of MODEL    3
 1624    HE3  LYS  36           HE3      LYS  36  -5.144  -6.490   1.608
  Start of MODEL    3
 1625    HZ3  LYS  36           HZ1      LYS  36  -5.309  -6.088  -0.764
  Start of MODEL    3
 1626    HZ2  LYS  36           HZ2      LYS  36  -3.686  -6.128  -0.284
  Start of MODEL    3
 1627    HZ1  LYS  36           HZ3      LYS  36  -4.433  -4.649  -0.609
  Start of MODEL    3
 1628    H    ILE  37           H        ILE  37  -5.578   0.697   1.318
  Start of MODEL    3
 1629    HA   ILE  37           HA       ILE  37  -5.354   1.084  -1.572
  Start of MODEL    3
 1630    HB   ILE  37           HB       ILE  37  -4.152   2.654   0.715
  Start of MODEL    3
 1631   HD12  ILE  37          HD11      ILE  37  -6.793   5.280   0.259
  Start of MODEL    3
 1632   HD11  ILE  37          HD12      ILE  37  -5.198   5.320  -0.491
  Start of MODEL    3
 1633   HD13  ILE  37          HD13      ILE  37  -5.364   4.874   1.206
  Start of MODEL    3
 1634    H    PHE  38           H        PHE  38  -3.603   0.394  -2.681
  Start of MODEL    3
 1635    HA   PHE  38           HA       PHE  38  -1.361  -0.719  -1.151
  Start of MODEL    3
 1636    HB2  PHE  38           HB2      PHE  38  -2.237  -2.221  -2.861
  Start of MODEL    3
 1637    HB3  PHE  38           HB3      PHE  38  -2.056  -0.977  -4.092
  Start of MODEL    3
 1638    HD1  PHE  38           HD1      PHE  38  -0.141  -0.938  -5.387
  Start of MODEL    3
 1639    HD2  PHE  38           HD2      PHE  38  -0.055  -2.892  -1.609
  Start of MODEL    3
 1640    HE1  PHE  38           HE1      PHE  38   2.145  -1.715  -5.846
  Start of MODEL    3
 1641    HE2  PHE  38           HE2      PHE  38   2.233  -3.672  -2.060
  Start of MODEL    3
 1642    HZ   PHE  38           HZ       PHE  38   3.336  -3.088  -4.180
  Start of MODEL    3
 1643    H    VAL  39           H        VAL  39   0.436   0.444  -0.926
  Start of MODEL    3
 1644    HA   VAL  39           HA       VAL  39   0.782   2.799  -2.643
  Start of MODEL    3
 1645    HB   VAL  39           HB       VAL  39   2.210   2.301  -0.043
  Start of MODEL    3
 1646    H    GLY  40           H        GLY  40   2.438   2.854  -4.021
  Start of MODEL    3
 1647    HA2  GLY  40           HA2      GLY  40   4.474   0.726  -3.771
  Start of MODEL    3
 1648    HA3  GLY  40           HA3      GLY  40   3.664   1.027  -5.303
  Start of MODEL    3
 1649    H    GLY  41           H        GLY  41   6.492   1.120  -4.786
  Start of MODEL    3
 1650    HA2  GLY  41           HA2      GLY  41   8.183   2.394  -5.728
  Start of MODEL    3
 1651    HA3  GLY  41           HA3      GLY  41   6.989   3.629  -6.096
  Start of MODEL    3
 1652    H    LEU  42           H        LEU  42   7.355   2.389  -2.878
  Start of MODEL    3
 1653    HA   LEU  42           HA       LEU  42   8.021   5.033  -1.908
  Start of MODEL    3
 1654    HB2  LEU  42           HB2      LEU  42   7.423   2.407  -0.534
  Start of MODEL    3
 1655    HB3  LEU  42           HB3      LEU  42   7.862   3.865   0.335
  Start of MODEL    3
 1656    HG   LEU  42           HG       LEU  42   5.437   3.581  -1.438
  Start of MODEL    3
 1657   HD13  LEU  42          HD11      LEU  42   5.292   2.167   0.547
  Start of MODEL    3
 1658   HD12  LEU  42          HD12      LEU  42   4.184   3.533   0.660
  Start of MODEL    3
 1659   HD11  LEU  42          HD13      LEU  42   5.696   3.546   1.568
  Start of MODEL    3
 1660   HD23  LEU  42          HD21      LEU  42   6.294   5.763   0.464
  Start of MODEL    3
 1661   HD22  LEU  42          HD22      LEU  42   4.762   5.699  -0.408
  Start of MODEL    3
 1662   HD21  LEU  42          HD23      LEU  42   6.277   5.868  -1.295
  Start of MODEL    3
 1663    HA   PRO  43           HA       PRO  43  12.404   4.197  -1.405
  Start of MODEL    3
 1664    HB2  PRO  43           HB2      PRO  43  12.802   5.906   0.733
  Start of MODEL    3
 1665    HB3  PRO  43           HB3      PRO  43  12.846   6.399  -0.962
  Start of MODEL    3
 1666    HG2  PRO  43           HG2      PRO  43  10.659   6.684   1.038
  Start of MODEL    3
 1667    HG3  PRO  43           HG3      PRO  43  11.144   7.782  -0.267
  Start of MODEL    3
 1668    HD2  PRO  43           HD2      PRO  43   8.969   6.172  -0.436
  Start of MODEL    3
 1669    HD3  PRO  43           HD3      PRO  43   9.934   6.638  -1.850
  Start of MODEL    3
 1670    H    TYR  44           H        TYR  44  13.576   2.859  -0.061
  Start of MODEL    3
 1671    HA   TYR  44           HA       TYR  44  12.036   1.013   1.367
  Start of MODEL    3
 1672    HB2  TYR  44           HB2      TYR  44  15.023   1.421   1.345
  Start of MODEL    3
 1673    HB3  TYR  44           HB3      TYR  44  14.214   0.008   2.014
  Start of MODEL    3
 1674    HD1  TYR  44           HD1      TYR  44  12.500  -1.130   0.300
  Start of MODEL    3
 1675    HD2  TYR  44           HD2      TYR  44  15.850   1.249  -0.789
  Start of MODEL    3
 1676    HE1  TYR  44           HE1      TYR  44  12.510  -2.172  -1.929
  Start of MODEL    3
 1677    HE2  TYR  44           HE2      TYR  44  15.878   0.215  -3.019
  Start of MODEL    3
 1678    HH   TYR  44           HH       TYR  44  13.325  -1.611  -4.224
  Start of MODEL    3
 1679    H    HIS  45           H        HIS  45  13.842   3.796   2.497
  Start of MODEL    3
 1680    HA   HIS  45           HA       HIS  45  13.813   2.974   5.230
  Start of MODEL    3
 1681    HB2  HIS  45           HB2      HIS  45  14.950   4.938   5.731
  Start of MODEL    3
 1682    HB3  HIS  45           HB3      HIS  45  15.412   4.656   4.058
  Start of MODEL    3
 1683    HD1  HIS  45           HD1      HIS  45  14.621   7.327   6.104
  Start of MODEL    3
 1684    HD2  HIS  45           HD2      HIS  45  13.262   6.166   2.350
  Start of MODEL    3
 1685    HE1  HIS  45           HE1      HIS  45  13.607   9.388   5.084
  Start of MODEL    3
 1686    HE2  HIS  45           HE2      HIS  45  12.527   8.582   2.959
  Start of MODEL    3
 1687    H    THR  46           H        THR  46  11.340   4.242   3.275
  Start of MODEL    3
 1688    HA   THR  46           HA       THR  46   9.952   5.928   4.981
  Start of MODEL    3
 1689    HB   THR  46           HB       THR  46   8.919   3.981   2.912
  Start of MODEL    3
 1690    HG1  THR  46           HG1      THR  46   9.629   6.740   2.914
  Start of MODEL    3
 1691   HG22  THR  46          HG21      THR  46   6.871   5.356   2.873
  Start of MODEL    3
 1692   HG21  THR  46          HG22      THR  46   7.468   6.269   4.261
  Start of MODEL    3
 1693   HG23  THR  46          HG23      THR  46   7.093   4.552   4.428
  Start of MODEL    3
 1694    H    SER  47           H        SER  47   8.553   5.662   6.644
  Start of MODEL    3
 1695    HA   SER  47           HA       SER  47   8.390   2.947   7.758
  Start of MODEL    3
 1696    HB2  SER  47           HB2      SER  47   8.177   4.108   9.966
  Start of MODEL    3
 1697    HB3  SER  47           HB3      SER  47   9.719   4.393   9.165
  Start of MODEL    3
 1698    HG   SER  47           HG       SER  47   8.575   6.364   8.311
  Start of MODEL    3
 1699    H    ASP  48           H        ASP  48   6.484   2.543   9.132
  Start of MODEL    3
 1700    HA   ASP  48           HA       ASP  48   4.053   2.863   7.896
  Start of MODEL    3
 1701    HB2  ASP  48           HB2      ASP  48   4.281   2.763  10.904
  Start of MODEL    3
 1702    HB3  ASP  48           HB3      ASP  48   3.028   2.067   9.884
  Start of MODEL    3
 1703    H    LYS  49           H        LYS  49   5.597   4.925  10.262
  Start of MODEL    3
 1704    HA   LYS  49           HA       LYS  49   3.496   6.691  10.801
  Start of MODEL    3
 1705    HB2  LYS  49           HB2      LYS  49   5.538   6.633  12.126
  Start of MODEL    3
 1706    HB3  LYS  49           HB3      LYS  49   6.479   7.177  10.746
  Start of MODEL    3
 1707    HG2  LYS  49           HG2      LYS  49   5.305   9.313  10.784
  Start of MODEL    3
 1708    HG3  LYS  49           HG3      LYS  49   4.339   8.759  12.153
  Start of MODEL    3
 1709    HD2  LYS  49           HD2      LYS  49   7.327   8.746  12.298
  Start of MODEL    3
 1710    HD3  LYS  49           HD3      LYS  49   6.430  10.238  12.577
  Start of MODEL    3
 1711    HE2  LYS  49           HE2      LYS  49   6.894   9.133  14.684
  Start of MODEL    3
 1712    HE3  LYS  49           HE3      LYS  49   5.163   9.140  14.364
  Start of MODEL    3
 1713    HZ2  LYS  49           HZ1      LYS  49   5.976   7.017  15.242
  Start of MODEL    3
 1714    HZ1  LYS  49           HZ2      LYS  49   6.960   6.825  13.872
  Start of MODEL    3
 1715    HZ3  LYS  49           HZ3      LYS  49   5.272   6.848  13.711
  Start of MODEL    3
 1716    H    THR  50           H        THR  50   5.966   6.736   8.259
  Start of MODEL    3
 1717    HA   THR  50           HA       THR  50   5.365   9.252   7.175
  Start of MODEL    3
 1718    HB   THR  50           HB       THR  50   6.371   6.859   5.614
  Start of MODEL    3
 1719    HG1  THR  50           HG1      THR  50   8.431   8.255   6.339
  Start of MODEL    3
 1720   HG23  THR  50          HG21      THR  50   5.820   8.806   4.247
  Start of MODEL    3
 1721   HG22  THR  50          HG22      THR  50   7.567   8.573   4.305
  Start of MODEL    3
 1722   HG21  THR  50          HG23      THR  50   6.814   9.834   5.282
  Start of MODEL    3
 1723    H    LEU  51           H        LEU  51   4.057   6.032   6.500
  Start of MODEL    3
 1724    HA   LEU  51           HA       LEU  51   2.370   6.941   4.341
  Start of MODEL    3
 1725    HB2  LEU  51           HB2      LEU  51   2.359   4.404   5.963
  Start of MODEL    3
 1726    HB3  LEU  51           HB3      LEU  51   1.184   4.732   4.703
  Start of MODEL    3
 1727    HG   LEU  51           HG       LEU  51   4.155   4.364   4.386
  Start of MODEL    3
 1728   HD12  LEU  51          HD11      LEU  51   3.483   2.523   2.937
  Start of MODEL    3
 1729   HD11  LEU  51          HD12      LEU  51   1.785   2.875   3.266
  Start of MODEL    3
 1730   HD13  LEU  51          HD13      LEU  51   2.841   2.321   4.567
  Start of MODEL    3
 1731   HD21  LEU  51          HD21      LEU  51   3.470   6.202   2.964
  Start of MODEL    3
 1732   HD23  LEU  51          HD22      LEU  51   2.129   5.245   2.336
  Start of MODEL    3
 1733   HD22  LEU  51          HD23      LEU  51   3.792   4.769   1.988
  Start of MODEL    3
 1734    H    HIS  52           H        HIS  52   1.931   6.238   7.755
  Start of MODEL    3
 1735    HA   HIS  52           HA       HIS  52  -0.798   6.657   8.002
  Start of MODEL    3
 1736    HB2  HIS  52           HB2      HIS  52   0.821   5.853   9.783
  Start of MODEL    3
 1737    HB3  HIS  52           HB3      HIS  52   1.264   7.536  10.036
  Start of MODEL    3
 1738    HD1  HIS  52           HD1      HIS  52  -0.749   9.128  10.907
  Start of MODEL    3
 1739    HD2  HIS  52           HD2      HIS  52  -1.392   5.020  11.140
  Start of MODEL    3
 1740    HE1  HIS  52           HE1      HIS  52  -2.620   8.822  12.549
  Start of MODEL    3
 1741    HE2  HIS  52           HE2      HIS  52  -3.129   6.360  12.506
  Start of MODEL    3
 1742    H    GLU  53           H        GLU  53   1.772   9.092   8.565
  Start of MODEL    3
 1743    HA   GLU  53           HA       GLU  53   0.143  11.277   8.987
  Start of MODEL    3
 1744    HB2  GLU  53           HB2      GLU  53   2.860  11.208   7.662
  Start of MODEL    3
 1745    HB3  GLU  53           HB3      GLU  53   2.115  12.628   8.371
  Start of MODEL    3
 1746    HG2  GLU  53           HG2      GLU  53   2.529  10.211  10.054
  Start of MODEL    3
 1747    HG3  GLU  53           HG3      GLU  53   3.899  11.253   9.673
  Start of MODEL    3
 1748    H    TYR  54           H        TYR  54   1.481  10.125   5.905
  Start of MODEL    3
 1749    HA   TYR  54           HA       TYR  54   0.681  12.447   4.473
  Start of MODEL    3
 1750    HB2  TYR  54           HB2      TYR  54   2.509  10.770   3.840
  Start of MODEL    3
 1751    HB3  TYR  54           HB3      TYR  54   1.208   9.761   3.209
  Start of MODEL    3
 1752    HD1  TYR  54           HD1      TYR  54   0.067  10.330   1.185
  Start of MODEL    3
 1753    HD2  TYR  54           HD2      TYR  54   3.038  12.934   2.764
  Start of MODEL    3
 1754    HE1  TYR  54           HE1      TYR  54   0.119  11.552  -0.945
  Start of MODEL    3
 1755    HE2  TYR  54           HE2      TYR  54   3.096  14.165   0.636
  Start of MODEL    3
 1756    HH   TYR  54           HH       TYR  54   0.723  13.736  -1.786
  Start of MODEL    3
 1757    H    PHE  55           H        PHE  55  -0.664   9.136   4.442
  Start of MODEL    3
 1758    HA   PHE  55           HA       PHE  55  -2.776   9.860   2.713
  Start of MODEL    3
 1759    HB2  PHE  55           HB2      PHE  55  -2.163   7.415   4.320
  Start of MODEL    3
 1760    HB3  PHE  55           HB3      PHE  55  -3.664   7.553   3.408
  Start of MODEL    3
 1761    HD1  PHE  55           HD1      PHE  55  -0.015   7.305   3.180
  Start of MODEL    3
 1762    HD2  PHE  55           HD2      PHE  55  -3.668   7.501   1.013
  Start of MODEL    3
 1763    HE1  PHE  55           HE1      PHE  55   1.162   6.589   1.143
  Start of MODEL    3
 1764    HE2  PHE  55           HE2      PHE  55  -2.499   6.782  -1.026
  Start of MODEL    3
 1765    HZ   PHE  55           HZ       PHE  55  -0.082   6.326  -0.966
  Start of MODEL    3
 1766    H    GLU  56           H        GLU  56  -2.554   9.906   6.214
  Start of MODEL    3
 1767    HA   GLU  56           HA       GLU  56  -5.358   9.645   6.622
  Start of MODEL    3
 1768    HB2  GLU  56           HB2      GLU  56  -4.988  10.173   8.911
  Start of MODEL    3
 1769    HB3  GLU  56           HB3      GLU  56  -3.646   9.173   8.380
  Start of MODEL    3
 1770    HG2  GLU  56           HG2      GLU  56  -2.231  11.146   8.207
  Start of MODEL    3
 1771    HG3  GLU  56           HG3      GLU  56  -3.575  12.169   8.712
  Start of MODEL    3
 1772    H    GLN  57           H        GLN  57  -3.405  12.224   5.580
  Start of MODEL    3
 1773    HA   GLN  57           HA       GLN  57  -5.033  14.373   6.447
  Start of MODEL    3
 1774    HB2  GLN  57           HB2      GLN  57  -3.076  14.157   4.158
  Start of MODEL    3
 1775    HB3  GLN  57           HB3      GLN  57  -3.852  15.658   4.650
  Start of MODEL    3
 1776    HG2  GLN  57           HG2      GLN  57  -2.816  15.512   6.838
  Start of MODEL    3
 1777    HG3  GLN  57           HG3      GLN  57  -2.090  13.965   6.414
  Start of MODEL    3
 1778   HE21  GLN  57          HE21      GLN  57  -2.332  16.549   4.116
  Start of MODEL    3
 1779   HE22  GLN  57          HE22      GLN  57  -0.648  16.947   4.066
  Start of MODEL    3
 1780    H    PHE  58           H        PHE  58  -5.653  11.933   4.247
  Start of MODEL    3
 1781    HA   PHE  58           HA       PHE  58  -7.413  13.536   2.564
  Start of MODEL    3
 1782    HB2  PHE  58           HB2      PHE  58  -6.696  10.602   2.570
  Start of MODEL    3
 1783    HB3  PHE  58           HB3      PHE  58  -7.921  11.282   1.509
  Start of MODEL    3
 1784    HD1  PHE  58           HD1      PHE  58  -4.331  11.642   2.431
  Start of MODEL    3
 1785    HD2  PHE  58           HD2      PHE  58  -7.333  12.116  -0.545
  Start of MODEL    3
 1786    HE1  PHE  58           HE1      PHE  58  -2.594  12.216   0.784
  Start of MODEL    3
 1787    HE2  PHE  58           HE2      PHE  58  -5.606  12.699  -2.203
  Start of MODEL    3
 1788    HZ   PHE  58           HZ       PHE  58  -3.232  12.749  -1.538
  Start of MODEL    3
 1789    H    GLY  59           H        GLY  59  -7.526  11.759   5.454
  Start of MODEL    3
 1790    HA2  GLY  59           HA2      GLY  59 -10.070  12.525   6.183
  Start of MODEL    3
 1791    HA3  GLY  59           HA3      GLY  59 -10.279  10.985   5.364
  Start of MODEL    3
 1792    H    ASP  60           H        ASP  60 -10.149   9.222   6.566
  Start of MODEL    3
 1793    HA   ASP  60           HA       ASP  60  -8.680   9.375   9.117
  Start of MODEL    3
 1794    HB2  ASP  60           HB2      ASP  60 -11.318   7.965   8.626
  Start of MODEL    3
 1795    HB3  ASP  60           HB3      ASP  60 -10.405   7.926  10.132
  Start of MODEL    3
 1796    H    ILE  61           H        ILE  61  -7.088   7.928   9.246
  Start of MODEL    3
 1797    HA   ILE  61           HA       ILE  61  -7.191   5.536   7.583
  Start of MODEL    3
 1798    HB   ILE  61           HB       ILE  61  -4.988   6.864   9.120
  Start of MODEL    3
 1799   HD11  ILE  61          HD11      ILE  61  -2.920   5.957   6.970
  Start of MODEL    3
 1800   HD13  ILE  61          HD12      ILE  61  -3.124   7.617   7.534
  Start of MODEL    3
 1801   HD12  ILE  61          HD13      ILE  61  -3.277   7.242   5.819
  Start of MODEL    3
 1802    H    GLU  62           H        GLU  62  -7.570   3.573   8.316
  Start of MODEL    3
 1803    HA   GLU  62           HA       GLU  62  -8.144   3.200  11.130
  Start of MODEL    3
 1804    HB2  GLU  62           HB2      GLU  62  -9.349   2.246   8.931
  Start of MODEL    3
 1805    HB3  GLU  62           HB3      GLU  62  -8.228   0.923   9.227
  Start of MODEL    3
 1806    HG2  GLU  62           HG2      GLU  62  -9.119   0.629  11.452
  Start of MODEL    3
 1807    HG3  GLU  62           HG3      GLU  62 -10.175   2.023  11.228
  Start of MODEL    3
 1808    H    GLU  63           H        GLU  63  -5.820   2.108   8.712
  Start of MODEL    3
 1809    HA   GLU  63           HA       GLU  63  -3.840   1.572  10.746
  Start of MODEL    3
 1810    HB2  GLU  63           HB2      GLU  63  -5.432  -0.548  10.183
  Start of MODEL    3
 1811    HB3  GLU  63           HB3      GLU  63  -4.235  -0.728   8.911
  Start of MODEL    3
 1812    HG2  GLU  63           HG2      GLU  63  -3.582  -0.537  11.838
  Start of MODEL    3
 1813    HG3  GLU  63           HG3      GLU  63  -3.761  -2.045  10.952
  Start of MODEL    3
 1814    H    ALA  64           H        ALA  64  -1.802   1.983   9.880
  Start of MODEL    3
 1815    HA   ALA  64           HA       ALA  64  -1.517   1.933   6.964
  Start of MODEL    3
 1816    HB2  ALA  64           HB1      ALA  64  -0.679   4.289   8.641
  Start of MODEL    3
 1817    HB1  ALA  64           HB2      ALA  64  -2.100   4.243   7.598
  Start of MODEL    3
 1818    HB3  ALA  64           HB3      ALA  64  -0.485   4.116   6.896
  Start of MODEL    3
 1819    H    VAL  65           H        VAL  65   0.157   0.661   6.543
  Start of MODEL    3
 1820    HA   VAL  65           HA       VAL  65   2.580   0.911   8.180
  Start of MODEL    3
 1821    HB   VAL  65           HB       VAL  65   2.890  -1.581   8.140
  Start of MODEL    3
 1822    H    VAL  66           H        VAL  66   4.504   0.440   7.177
  Start of MODEL    3
 1823    HA   VAL  66           HA       VAL  66   4.446   0.147   4.263
  Start of MODEL    3
 1824    HB   VAL  66           HB       VAL  66   6.767   0.607   6.155
  Start of MODEL    3
 1825    H    ILE  67           H        ILE  67   5.282  -1.731   3.237
  Start of MODEL    3
 1826    HA   ILE  67           HA       ILE  67   4.859  -4.018   4.972
  Start of MODEL    3
 1827    HB   ILE  67           HB       ILE  67   5.049  -3.802   1.972
  Start of MODEL    3
 1828   HD12  ILE  67          HD11      ILE  67   1.464  -4.004   4.254
  Start of MODEL    3
 1829   HD11  ILE  67          HD12      ILE  67   3.008  -3.730   5.060
  Start of MODEL    3
 1830   HD13  ILE  67          HD13      ILE  67   2.605  -5.333   4.451
  Start of MODEL    3
 1831    H    THR  68           H        THR  68   6.366  -5.278   5.679
  Start of MODEL    3
 1832    HA   THR  68           HA       THR  68   9.055  -5.112   4.506
  Start of MODEL    3
 1833    HB   THR  68           HB       THR  68   9.864  -5.717   6.829
  Start of MODEL    3
 1834    HG1  THR  68           HG1      THR  68   7.714  -4.676   8.114
  Start of MODEL    3
 1835   HG21  THR  68          HG21      THR  68   8.385  -3.099   6.546
  Start of MODEL    3
 1836   HG23  THR  68          HG22      THR  68  10.024  -3.426   5.986
  Start of MODEL    3
 1837   HG22  THR  68          HG23      THR  68   9.662  -3.436   7.710
  Start of MODEL    3
 1838    H    ASP  69           H        ASP  69  10.133  -7.128   4.194
  Start of MODEL    3
 1839    HA   ASP  69           HA       ASP  69   8.602  -9.369   3.753
  Start of MODEL    3
 1840    HB2  ASP  69           HB2      ASP  69  10.754  -9.121   2.732
  Start of MODEL    3
 1841    HB3  ASP  69           HB3      ASP  69  11.553  -9.103   4.301
  Start of MODEL    3
 1842    H    ARG  70           H        ARG  70   8.036 -11.113   4.848
  Start of MODEL    3
 1843    HA   ARG  70           HA       ARG  70   7.595 -10.999   7.569
  Start of MODEL    3
 1844    HB2  ARG  70           HB2      ARG  70   6.268 -12.319   6.037
  Start of MODEL    3
 1845    HB3  ARG  70           HB3      ARG  70   7.635 -13.363   5.700
  Start of MODEL    3
 1846    HG2  ARG  70           HG2      ARG  70   6.669 -13.135   8.491
  Start of MODEL    3
 1847    HG3  ARG  70           HG3      ARG  70   5.733 -14.097   7.344
  Start of MODEL    3
 1848    HD2  ARG  70           HD2      ARG  70   7.847 -15.314   6.806
  Start of MODEL    3
 1849    HD3  ARG  70           HD3      ARG  70   8.615 -14.429   8.122
  Start of MODEL    3
 1850    HE   ARG  70           HE       ARG  70   6.378 -16.324   8.475
  Start of MODEL    3
 1851   HH11  ARG  70          HH11      ARG  70   9.240 -14.714   9.646
  Start of MODEL    3
 1852   HH12  ARG  70          HH12      ARG  70   9.390 -15.698  11.071
  Start of MODEL    3
 1853   HH21  ARG  70          HH21      ARG  70   6.548 -17.651  10.313
  Start of MODEL    3
 1854   HH22  ARG  70          HH22      ARG  70   7.823 -17.367  11.464
  Start of MODEL    3
 1855    H    ASN  71           H        ASN  71  10.387 -12.408   5.899
  Start of MODEL    3
 1856    HA   ASN  71           HA       ASN  71  11.202 -13.688   8.382
  Start of MODEL    3
 1857    HB2  ASN  71           HB2      ASN  71  12.003 -13.981   5.526
  Start of MODEL    3
 1858    HB3  ASN  71           HB3      ASN  71  13.028 -14.625   6.807
  Start of MODEL    3
 1859   HD21  ASN  71          HD21      ASN  71  12.328 -16.368   7.994
  Start of MODEL    3
 1860   HD22  ASN  71          HD22      ASN  71  10.971 -17.333   7.513
  Start of MODEL    3
 1861    H    THR  72           H        THR  72  11.864 -10.770   6.815
  Start of MODEL    3
 1862    HA   THR  72           HA       THR  72  14.531 -10.643   8.048
  Start of MODEL    3
 1863    HB   THR  72           HB       THR  72  15.231  -9.133   6.153
  Start of MODEL    3
 1864    HG1  THR  72           HG1      THR  72  13.038 -10.301   4.761
  Start of MODEL    3
 1865   HG22  THR  72          HG21      THR  72  15.705 -10.951   4.589
  Start of MODEL    3
 1866   HG21  THR  72          HG22      THR  72  14.516 -11.969   5.400
  Start of MODEL    3
 1867   HG23  THR  72          HG23      THR  72  15.975 -11.467   6.254
  Start of MODEL    3
 1868    H    GLN  73           H        GLN  73  11.578  -9.215   7.270
  Start of MODEL    3
 1869    HA   GLN  73           HA       GLN  73  10.426  -7.377   8.015
  Start of MODEL    3
 1870    HB2  GLN  73           HB2      GLN  73  12.676  -7.147  10.022
  Start of MODEL    3
 1871    HB3  GLN  73           HB3      GLN  73  11.127  -6.314  10.108
  Start of MODEL    3
 1872    HG2  GLN  73           HG2      GLN  73   9.973  -8.458  10.277
  Start of MODEL    3
 1873    HG3  GLN  73           HG3      GLN  73  11.527  -9.297  10.185
  Start of MODEL    3
 1874   HE21  GLN  73          HE21      GLN  73  11.132 -10.262  12.201
  Start of MODEL    3
 1875   HE22  GLN  73          HE22      GLN  73  11.273  -9.378  13.683
  Start of MODEL    3
 1876    H    LYS  74           H        LYS  74  12.466  -7.294   5.981
  Start of MODEL    3
 1877    HA   LYS  74           HA       LYS  74  13.457  -4.546   6.105
  Start of MODEL    3
 1878    HB2  LYS  74           HB2      LYS  74  13.880  -6.777   4.111
  Start of MODEL    3
 1879    HB3  LYS  74           HB3      LYS  74  14.490  -5.145   3.877
  Start of MODEL    3
 1880    HG2  LYS  74           HG2      LYS  74  15.190  -6.888   6.227
  Start of MODEL    3
 1881    HG3  LYS  74           HG3      LYS  74  16.164  -6.744   4.763
  Start of MODEL    3
 1882    HD2  LYS  74           HD2      LYS  74  16.457  -4.369   5.160
  Start of MODEL    3
 1883    HD3  LYS  74           HD3      LYS  74  15.409  -4.454   6.576
  Start of MODEL    3
 1884    HE2  LYS  74           HE2      LYS  74  18.016  -5.938   6.263
  Start of MODEL    3
 1885    HE3  LYS  74           HE3      LYS  74  17.815  -4.424   7.144
  Start of MODEL    3
 1886    HZ1  LYS  74           HZ1      LYS  74  16.203  -5.577   8.585
  Start of MODEL    3
 1887    HZ3  LYS  74           HZ2      LYS  74  17.763  -6.231   8.679
  Start of MODEL    3
 1888    HZ2  LYS  74           HZ3      LYS  74  16.562  -7.035   7.796
  Start of MODEL    3
 1889    H    SER  75           H        SER  75  12.565  -2.901   4.964
  Start of MODEL    3
 1890    HA   SER  75           HA       SER  75   9.926  -3.110   4.081
  Start of MODEL    3
 1891    HB2  SER  75           HB2      SER  75  11.935  -0.967   3.364
  Start of MODEL    3
 1892    HB3  SER  75           HB3      SER  75  10.179  -0.813   3.327
  Start of MODEL    3
 1893    HG   SER  75           HG       SER  75  11.080   0.065   5.239
  Start of MODEL    3
 1894    H    ARG  76           H        ARG  76   9.003  -3.441   2.161
  Start of MODEL    3
 1895    HA   ARG  76           HA       ARG  76  10.748  -4.468   0.049
  Start of MODEL    3
 1896    HB2  ARG  76           HB2      ARG  76   7.735  -4.544   0.077
  Start of MODEL    3
 1897    HB3  ARG  76           HB3      ARG  76   8.833  -5.555  -0.850
  Start of MODEL    3
 1898    HG2  ARG  76           HG2      ARG  76   9.669  -6.353   1.465
  Start of MODEL    3
 1899    HG3  ARG  76           HG3      ARG  76   8.146  -5.687   2.055
  Start of MODEL    3
 1900    HD2  ARG  76           HD2      ARG  76   7.809  -8.013   1.606
  Start of MODEL    3
 1901    HD3  ARG  76           HD3      ARG  76   6.962  -7.093   0.360
  Start of MODEL    3
 1902    HE   ARG  76           HE       ARG  76   8.820  -7.605  -1.141
  Start of MODEL    3
 1903   HH11  ARG  76          HH11      ARG  76   8.334  -9.606   1.671
  Start of MODEL    3
 1904   HH12  ARG  76          HH12      ARG  76   9.397 -10.870   1.139
  Start of MODEL    3
 1905   HH21  ARG  76          HH21      ARG  76  10.177  -9.307  -1.917
  Start of MODEL    3
 1906   HH22  ARG  76          HH22      ARG  76  10.421 -10.711  -0.933
  Start of MODEL    3
 1907    H    GLY  77           H        GLY  77  10.023  -1.589   0.815
  Start of MODEL    3
 1908    HA2  GLY  77           HA2      GLY  77   9.968   0.407  -0.336
  Start of MODEL    3
 1909    HA3  GLY  77           HA3      GLY  77  10.118  -0.528  -1.815
  Start of MODEL    3
 1910    H    TYR  78           H        TYR  78   7.505  -1.376   0.179
  Start of MODEL    3
 1911    HA   TYR  78           HA       TYR  78   5.671   0.548  -0.889
  Start of MODEL    3
 1912    HB2  TYR  78           HB2      TYR  78   4.164  -1.130  -1.924
  Start of MODEL    3
 1913    HB3  TYR  78           HB3      TYR  78   5.687  -0.953  -2.775
  Start of MODEL    3
 1914    HD1  TYR  78           HD1      TYR  78   3.875  -3.152  -0.378
  Start of MODEL    3
 1915    HD2  TYR  78           HD2      TYR  78   7.013  -2.821  -3.232
  Start of MODEL    3
 1916    HE1  TYR  78           HE1      TYR  78   4.160  -5.596  -0.346
  Start of MODEL    3
 1917    HE2  TYR  78           HE2      TYR  78   7.311  -5.258  -3.198
  Start of MODEL    3
 1918    HH   TYR  78           HH       TYR  78   5.051  -7.362  -1.828
  Start of MODEL    3
 1919    H    GLY  79           H        GLY  79   3.381   0.001  -0.073
  Start of MODEL    3
 1920    HA2  GLY  79           HA2      GLY  79   3.363  -1.566   2.359
  Start of MODEL    3
 1921    HA3  GLY  79           HA3      GLY  79   3.338   0.170   2.617
  Start of MODEL    3
 1922    H    PHE  80           H        PHE  80   1.291  -0.543   3.694
  Start of MODEL    3
 1923    HA   PHE  80           HA       PHE  80  -0.894  -0.392   1.758
  Start of MODEL    3
 1924    HB2  PHE  80           HB2      PHE  80  -0.597  -2.428   3.943
  Start of MODEL    3
 1925    HB3  PHE  80           HB3      PHE  80  -2.190  -1.945   3.368
  Start of MODEL    3
 1926    HD1  PHE  80           HD1      PHE  80   0.860  -3.742   2.616
  Start of MODEL    3
 1927    HD2  PHE  80           HD2      PHE  80  -2.887  -2.472   1.067
  Start of MODEL    3
 1928    HE1  PHE  80           HE1      PHE  80   1.093  -5.341   0.774
  Start of MODEL    3
 1929    HE2  PHE  80           HE2      PHE  80  -2.671  -4.072  -0.786
  Start of MODEL    3
 1930    HZ   PHE  80           HZ       PHE  80  -0.772  -5.476  -0.980
  Start of MODEL    3
 1931    H    VAL  81           H        VAL  81  -2.481   0.819   2.247
  Start of MODEL    3
 1932    HA   VAL  81           HA       VAL  81  -2.669   1.938   4.969
  Start of MODEL    3
 1933    HB   VAL  81           HB       VAL  81  -3.076   3.387   2.344
  Start of MODEL    3
 1934    H    THR  82           H        THR  82  -4.530   1.522   5.933
  Start of MODEL    3
 1935    HA   THR  82           HA       THR  82  -6.811   0.672   4.290
  Start of MODEL    3
 1936    HB   THR  82           HB       THR  82  -6.379   0.219   7.252
  Start of MODEL    3
 1937    HG1  THR  82           HG1      THR  82  -5.103  -0.922   5.249
  Start of MODEL    3
 1938   HG22  THR  82          HG21      THR  82  -8.125  -1.495   6.984
  Start of MODEL    3
 1939   HG21  THR  82          HG22      THR  82  -8.303  -1.049   5.285
  Start of MODEL    3
 1940   HG23  THR  82          HG23      THR  82  -8.722   0.109   6.551
  Start of MODEL    3
 1941    H    MET  83           H        MET  83  -8.025   2.436   3.927
  Start of MODEL    3
 1942    HA   MET  83           HA       MET  83  -8.166   4.555   5.887
  Start of MODEL    3
 1943    HB2  MET  83           HB2      MET  83  -9.581   4.270   3.229
  Start of MODEL    3
 1944    HB3  MET  83           HB3      MET  83  -9.518   5.729   4.216
  Start of MODEL    3
 1945    HG2  MET  83           HG2      MET  83  -7.148   4.367   2.962
  Start of MODEL    3
 1946    HG3  MET  83           HG3      MET  83  -7.957   5.799   2.333
  Start of MODEL    3
 1947    HE3  MET  83           HE1      MET  83  -7.696   8.195   3.284
  Start of MODEL    3
 1948    HE2  MET  83           HE2      MET  83  -7.048   8.549   4.891
  Start of MODEL    3
 1949    HE1  MET  83           HE3      MET  83  -8.549   7.639   4.728
  Start of MODEL    3
 1950    H    LYS  84           H        LYS  84  -9.890   5.100   7.081
  Start of MODEL    3
 1951    HA   LYS  84           HA       LYS  84 -11.675   3.025   7.809
  Start of MODEL    3
 1952    HB2  LYS  84           HB2      LYS  84 -10.831   4.724   9.378
  Start of MODEL    3
 1953    HB3  LYS  84           HB3      LYS  84 -11.758   5.957   8.535
  Start of MODEL    3
 1954    HG2  LYS  84           HG2      LYS  84 -13.798   5.079   9.257
  Start of MODEL    3
 1955    HG3  LYS  84           HG3      LYS  84 -13.069   3.540   9.716
  Start of MODEL    3
 1956    HD2  LYS  84           HD2      LYS  84 -12.302   6.114  11.050
  Start of MODEL    3
 1957    HD3  LYS  84           HD3      LYS  84 -13.687   5.162  11.589
  Start of MODEL    3
 1958    HE2  LYS  84           HE2      LYS  84 -10.842   4.171  11.388
  Start of MODEL    3
 1959    HE3  LYS  84           HE3      LYS  84 -11.661   4.642  12.874
  Start of MODEL    3
 1960    HZ1  LYS  84           HZ1      LYS  84 -13.330   2.865  12.347
  Start of MODEL    3
 1961    HZ3  LYS  84           HZ2      LYS  84 -11.780   2.305  12.735
  Start of MODEL    3
 1962    HZ2  LYS  84           HZ3      LYS  84 -12.289   2.326  11.120
  Start of MODEL    3
 1963    H    ASP  85           H        ASP  85 -11.771   5.368   5.326
  Start of MODEL    3
 1964    HA   ASP  85           HA       ASP  85 -14.536   4.661   4.767
  Start of MODEL    3
 1965    HB2  ASP  85           HB2      ASP  85 -14.634   6.828   5.992
  Start of MODEL    3
 1966    HB3  ASP  85           HB3      ASP  85 -13.609   7.538   4.748
  Start of MODEL    3
 1967    H    ARG  86           H        ARG  86 -15.093   4.787   2.562
  Start of MODEL    3
 1968    HA   ARG  86           HA       ARG  86 -13.014   4.166   0.791
  Start of MODEL    3
 1969    HB2  ARG  86           HB2      ARG  86 -15.135   3.249   0.286
  Start of MODEL    3
 1970    HB3  ARG  86           HB3      ARG  86 -15.915   4.830   0.338
  Start of MODEL    3
 1971    HG2  ARG  86           HG2      ARG  86 -14.492   5.461  -1.643
  Start of MODEL    3
 1972    HG3  ARG  86           HG3      ARG  86 -14.039   3.764  -1.752
  Start of MODEL    3
 1973    HD2  ARG  86           HD2      ARG  86 -16.273   3.113  -2.221
  Start of MODEL    3
 1974    HD3  ARG  86           HD3      ARG  86 -16.895   4.714  -1.803
  Start of MODEL    3
 1975    HE   ARG  86           HE       ARG  86 -15.008   4.955  -3.886
  Start of MODEL    3
 1976   HH11  ARG  86          HH11      ARG  86 -18.277   3.817  -3.329
  Start of MODEL    3
 1977   HH12  ARG  86          HH12      ARG  86 -18.783   4.113  -4.966
  Start of MODEL    3
 1978   HH21  ARG  86          HH21      ARG  86 -15.664   5.384  -5.982
  Start of MODEL    3
 1979   HH22  ARG  86          HH22      ARG  86 -17.281   4.981  -6.489
  Start of MODEL    3
 1980    H    ALA  87           H        ALA  87 -14.824   7.181   1.276
  Start of MODEL    3
 1981    HA   ALA  87           HA       ALA  87 -14.052   8.358  -1.170
  Start of MODEL    3
 1982    HB1  ALA  87           HB1      ALA  87 -15.953   9.126   0.238
  Start of MODEL    3
 1983    HB3  ALA  87           HB2      ALA  87 -14.878  10.433  -0.263
  Start of MODEL    3
 1984    HB2  ALA  87           HB3      ALA  87 -14.790   9.797   1.382
  Start of MODEL    3
 1985    H    SER  88           H        SER  88 -12.639   8.442   2.056
  Start of MODEL    3
 1986    HA   SER  88           HA       SER  88 -10.595  10.300   1.482
  Start of MODEL    3
 1987    HB2  SER  88           HB2      SER  88 -10.544   8.038   3.493
  Start of MODEL    3
 1988    HB3  SER  88           HB3      SER  88  -9.576   9.512   3.536
  Start of MODEL    3
 1989    HG   SER  88           HG       SER  88 -11.408  10.699   3.932
  Start of MODEL    3
 1990    H    ALA  89           H        ALA  89 -10.752   6.751   1.332
  Start of MODEL    3
 1991    HA   ALA  89           HA       ALA  89  -8.068   6.308   0.599
  Start of MODEL    3
 1992    HB1  ALA  89           HB1      ALA  89 -10.492   4.649  -0.090
  Start of MODEL    3
 1993    HB3  ALA  89           HB2      ALA  89  -9.575   4.541   1.414
  Start of MODEL    3
 1994    HB2  ALA  89           HB3      ALA  89  -8.814   4.111  -0.118
  Start of MODEL    3
 1995    H    GLU  90           H        GLU  90 -10.987   6.788  -1.334
  Start of MODEL    3
 1996    HA   GLU  90           HA       GLU  90  -9.717   6.255  -3.792
  Start of MODEL    3
 1997    HB2  GLU  90           HB2      GLU  90 -12.169   6.051  -3.389
  Start of MODEL    3
 1998    HB3  GLU  90           HB3      GLU  90 -12.264   7.810  -3.408
  Start of MODEL    3
 1999    HG2  GLU  90           HG2      GLU  90 -11.349   7.833  -5.667
  Start of MODEL    3
 2000    HG3  GLU  90           HG3      GLU  90 -11.267   6.074  -5.647
  Start of MODEL    3
 2001    H    ARG  91           H        ARG  91 -10.309   9.273  -2.017
  Start of MODEL    3
 2002    HA   ARG  91           HA       ARG  91  -9.497  10.995  -4.082
  Start of MODEL    3
 2003    HB2  ARG  91           HB2      ARG  91  -9.106  11.317  -1.105
  Start of MODEL    3
 2004    HB3  ARG  91           HB3      ARG  91  -8.855  12.587  -2.293
  Start of MODEL    3
 2005    HG2  ARG  91           HG2      ARG  91 -11.373  11.858  -2.904
  Start of MODEL    3
 2006    HG3  ARG  91           HG3      ARG  91 -11.347  11.506  -1.173
  Start of MODEL    3
 2007    HD2  ARG  91           HD2      ARG  91 -10.665  14.120  -2.501
  Start of MODEL    3
 2008    HD3  ARG  91           HD3      ARG  91 -12.102  13.768  -1.549
  Start of MODEL    3
 2009    HE   ARG  91           HE       ARG  91 -10.284  13.318   0.286
  Start of MODEL    3
 2010   HH11  ARG  91          HH11      ARG  91 -10.375  15.876  -2.096
  Start of MODEL    3
 2011   HH12  ARG  91          HH12      ARG  91  -9.450  16.990  -1.139
  Start of MODEL    3
 2012   HH21  ARG  91          HH21      ARG  91  -9.083  14.804   1.578
  Start of MODEL    3
 2013   HH22  ARG  91          HH22      ARG  91  -8.708  16.380   0.954
  Start of MODEL    3
 2014    H    ALA  92           H        ALA  92  -7.716   9.196  -1.642
  Start of MODEL    3
 2015    HA   ALA  92           HA       ALA  92  -5.145  10.120  -2.292
  Start of MODEL    3
 2016    HB1  ALA  92           HB1      ALA  92  -5.962   7.434  -1.190
  Start of MODEL    3
 2017    HB3  ALA  92           HB2      ALA  92  -5.644   8.887  -0.242
  Start of MODEL    3
 2018    HB2  ALA  92           HB3      ALA  92  -4.339   8.122  -1.148
  Start of MODEL    3
 2019    H    CYS  93           H        CYS  93  -7.079   7.418  -3.621
  Start of MODEL    3
 2020    HA   CYS  93           HA       CYS  93  -4.889   6.508  -5.251
  Start of MODEL    3
 2021    HB2  CYS  93           HB2      CYS  93  -7.793   5.672  -5.247
  Start of MODEL    3
 2022    HB3  CYS  93           HB3      CYS  93  -6.464   4.819  -6.024
  Start of MODEL    3
 2023    HG   CYS  93           HG       CYS  93  -6.853   5.257  -2.654
  Start of MODEL    3
 2024    H    LYS  94           H        LYS  94  -7.199   8.947  -5.593
  Start of MODEL    3
 2025    HA   LYS  94           HA       LYS  94  -7.841   8.624  -8.332
  Start of MODEL    3
 2026    HB2  LYS  94           HB2      LYS  94  -9.136   9.999  -6.657
  Start of MODEL    3
 2027    HB3  LYS  94           HB3      LYS  94  -7.866  11.208  -6.763
  Start of MODEL    3
 2028    HG2  LYS  94           HG2      LYS  94  -9.752  11.824  -8.149
  Start of MODEL    3
 2029    HG3  LYS  94           HG3      LYS  94  -8.338  11.493  -9.150
  Start of MODEL    3
 2030    HD2  LYS  94           HD2      LYS  94  -9.911  10.329 -10.329
  Start of MODEL    3
 2031    HD3  LYS  94           HD3      LYS  94  -9.402   9.070  -9.207
  Start of MODEL    3
 2032    HE2  LYS  94           HE2      LYS  94 -11.791  10.868  -8.787
  Start of MODEL    3
 2033    HE3  LYS  94           HE3      LYS  94 -11.872   9.256  -9.486
  Start of MODEL    3
 2034    HZ1  LYS  94           HZ1      LYS  94 -10.772   8.512  -7.330
  Start of MODEL    3
 2035    HZ3  LYS  94           HZ2      LYS  94 -12.403   8.959  -7.261
  Start of MODEL    3
 2036    HZ2  LYS  94           HZ3      LYS  94 -11.208  10.030  -6.712
  Start of MODEL    3
 2037    H    ASP  95           H        ASP  95  -5.242  10.256  -6.624
  Start of MODEL    3
 2038    HA   ASP  95           HA       ASP  95  -4.012  10.867  -9.225
  Start of MODEL    3
 2039    HB2  ASP  95           HB2      ASP  95  -4.143  12.681  -7.427
  Start of MODEL    3
 2040    HB3  ASP  95           HB3      ASP  95  -2.951  11.736  -6.535
  Start of MODEL    3
 2041    HA   PRO  96           HA       PRO  96  -1.921   7.034  -8.394
  Start of MODEL    3
 2042    HB2  PRO  96           HB2      PRO  96  -0.638   6.847 -10.767
  Start of MODEL    3
 2043    HB3  PRO  96           HB3      PRO  96  -2.354   6.479 -10.559
  Start of MODEL    3
 2044    HG2  PRO  96           HG2      PRO  96  -1.059   8.957 -11.617
  Start of MODEL    3
 2045    HG3  PRO  96           HG3      PRO  96  -2.493   8.103 -12.213
  Start of MODEL    3
 2046    HD2  PRO  96           HD2      PRO  96  -2.629  10.342 -10.682
  Start of MODEL    3
 2047    HD3  PRO  96           HD3      PRO  96  -3.876   9.079 -10.659
  Start of MODEL    3
 2048    H    ASN  97           H        ASN  97  -0.410  10.110  -8.775
  Start of MODEL    3
 2049    HA   ASN  97           HA       ASN  97   2.142   8.884  -8.004
  Start of MODEL    3
 2050    HB2  ASN  97           HB2      ASN  97   1.761  10.761 -10.322
  Start of MODEL    3
 2051    HB3  ASN  97           HB3      ASN  97   3.306  10.635  -9.494
  Start of MODEL    3
 2052   HD21  ASN  97          HD21      ASN  97   2.885   7.748  -8.976
  Start of MODEL    3
 2053   HD22  ASN  97          HD22      ASN  97   3.199   6.975 -10.490
  Start of MODEL    3
 2054    HA   PRO  98           HA       PRO  98   1.443  12.681  -5.383
  Start of MODEL    3
 2055    HB2  PRO  98           HB2      PRO  98   1.401  10.818  -3.136
  Start of MODEL    3
 2056    HB3  PRO  98           HB3      PRO  98   0.228  12.066  -3.566
  Start of MODEL    3
 2057    HG2  PRO  98           HG2      PRO  98  -0.329   9.427  -3.772
  Start of MODEL    3
 2058    HG3  PRO  98           HG3      PRO  98  -1.017  10.639  -4.870
  Start of MODEL    3
 2059    HD2  PRO  98           HD2      PRO  98   1.306   8.788  -5.315
  Start of MODEL    3
 2060    HD3  PRO  98           HD3      PRO  98  -0.027   9.206  -6.417
  Start of MODEL    3
 2061    H    ILE  99           H        ILE  99   3.200  13.598  -4.374
  Start of MODEL    3
 2062    HA   ILE  99           HA       ILE  99   5.664  12.077  -4.333
  Start of MODEL    3
 2063    HB   ILE  99           HB       ILE  99   5.187  14.936  -3.468
  Start of MODEL    3
 2064   HD13  ILE  99          HD11      ILE  99   7.434  13.541  -6.155
  Start of MODEL    3
 2065   HD12  ILE  99          HD12      ILE  99   6.314  13.942  -7.458
  Start of MODEL    3
 2066   HD11  ILE  99          HD13      ILE  99   5.940  12.623  -6.349
  Start of MODEL    3
 2067    H    ILE 100           H        ILE 100   6.093  10.787  -2.689
  Start of MODEL    3
 2068    HA   ILE 100           HA       ILE 100   5.359  11.650   0.044
  Start of MODEL    3
 2069    HB   ILE 100           HB       ILE 100   5.422   8.797  -0.952
  Start of MODEL    3
 2070   HD11  ILE 100          HD11      ILE 100   2.573   8.212   0.196
  Start of MODEL    3
 2071   HD13  ILE 100          HD12      ILE 100   3.140   7.721  -1.401
  Start of MODEL    3
 2072   HD12  ILE 100          HD13      ILE 100   1.690   8.712  -1.245
  Start of MODEL    3
 2073    H    ASP 101           H        ASP 101   6.955  11.613   1.496
  Start of MODEL    3
 2074    HA   ASP 101           HA       ASP 101   9.039  11.436   2.434
  Start of MODEL    3
 2075    HB2  ASP 101           HB2      ASP 101   8.281   8.942   2.058
  Start of MODEL    3
 2076    HB3  ASP 101           HB3      ASP 101   9.539   8.950   0.830
  Start of MODEL    3
 2077    H    GLY 102           H        GLY 102   8.752  12.929  -0.003
  Start of MODEL    3
 2078    HA2  GLY 102           HA2      GLY 102  10.137  14.092  -1.434
  Start of MODEL    3
 2079    HA3  GLY 102           HA3      GLY 102  11.498  13.234  -0.733
  Start of MODEL    3
 2080    H    ARG 103           H        ARG 103   9.062  11.186  -1.930
  Start of MODEL    3
 2081    HA   ARG 103           HA       ARG 103  10.457  10.907  -4.498
  Start of MODEL    3
 2082    HB2  ARG 103           HB2      ARG 103  11.501   9.222  -3.202
  Start of MODEL    3
 2083    HB3  ARG 103           HB3      ARG 103   9.980   8.733  -2.467
  Start of MODEL    3
 2084    HG2  ARG 103           HG2      ARG 103   9.290   7.578  -4.350
  Start of MODEL    3
 2085    HG3  ARG 103           HG3      ARG 103  10.382   8.465  -5.416
  Start of MODEL    3
 2086    HD2  ARG 103           HD2      ARG 103  12.265   7.278  -4.615
  Start of MODEL    3
 2087    HD3  ARG 103           HD3      ARG 103  11.350   6.611  -3.261
  Start of MODEL    3
 2088    HE   ARG 103           HE       ARG 103  10.007   5.668  -5.386
  Start of MODEL    3
 2089   HH11  ARG 103          HH11      ARG 103  13.427   5.720  -4.679
  Start of MODEL    3
 2090   HH12  ARG 103          HH12      ARG 103  13.726   4.151  -5.360
  Start of MODEL    3
 2091   HH21  ARG 103          HH21      ARG 103  10.390   3.616  -6.307
  Start of MODEL    3
 2092   HH22  ARG 103          HH22      ARG 103  11.990   2.952  -6.296
  Start of MODEL    3
 2093    H    LYS 104           H        LYS 104   9.201  10.360  -6.225
  Start of MODEL    3
 2094    HA   LYS 104           HA       LYS 104   6.395  10.595  -6.044
  Start of MODEL    3
 2095    HB2  LYS 104           HB2      LYS 104   7.592  11.172  -8.074
  Start of MODEL    3
 2096    HB3  LYS 104           HB3      LYS 104   8.140   9.514  -8.258
  Start of MODEL    3
 2097    HG2  LYS 104           HG2      LYS 104   5.790   8.808  -8.547
  Start of MODEL    3
 2098    HG3  LYS 104           HG3      LYS 104   5.307  10.504  -8.462
  Start of MODEL    3
 2099    HD2  LYS 104           HD2      LYS 104   7.206   9.328 -10.488
  Start of MODEL    3
 2100    HD3  LYS 104           HD3      LYS 104   5.506   9.705 -10.779
  Start of MODEL    3
 2101    HE2  LYS 104           HE2      LYS 104   5.894  12.034 -10.435
  Start of MODEL    3
 2102    HE3  LYS 104           HE3      LYS 104   7.542  11.736  -9.886
  Start of MODEL    3
 2103    HZ3  LYS 104           HZ1      LYS 104   8.147  11.006 -12.075
  Start of MODEL    3
 2104    HZ2  LYS 104           HZ2      LYS 104   7.420  12.532 -12.196
  Start of MODEL    3
 2105    HZ1  LYS 104           HZ3      LYS 104   6.544  11.141 -12.619
  Start of MODEL    3
 2106    H    ALA 105           H        ALA 105   5.005   9.150  -5.300
  Start of MODEL    3
 2107    HA   ALA 105           HA       ALA 105   5.708   6.303  -5.423
  Start of MODEL    3
 2108    HB3  ALA 105           HB1      ALA 105   5.302   7.188  -3.178
  Start of MODEL    3
 2109    HB2  ALA 105           HB2      ALA 105   4.095   5.981  -3.621
  Start of MODEL    3
 2110    HB1  ALA 105           HB3      ALA 105   3.685   7.696  -3.669
  Start of MODEL    3
 2111    H    ASN 106           H        ASN 106   3.944   4.789  -5.855
  Start of MODEL    3
 2112    HA   ASN 106           HA       ASN 106   1.978   5.918  -7.745
  Start of MODEL    3
 2113    HB2  ASN 106           HB2      ASN 106   3.803   4.298  -8.589
  Start of MODEL    3
 2114    HB3  ASN 106           HB3      ASN 106   2.913   3.055  -7.720
  Start of MODEL    3
 2115   HD21  ASN 106          HD21      ASN 106   3.433   3.310 -10.553
  Start of MODEL    3
 2116   HD22  ASN 106          HD22      ASN 106   1.891   3.324 -11.325
  Start of MODEL    3
 2117    H    VAL 107           H        VAL 107  -0.011   5.934  -6.911
  Start of MODEL    3
 2118    HA   VAL 107           HA       VAL 107  -0.683   3.955  -4.837
  Start of MODEL    3
 2119    HB   VAL 107           HB       VAL 107  -1.982   6.641  -5.344
  Start of MODEL    3
 2120    H    ASN 108           H        ASN 108  -2.507   2.746  -4.944
  Start of MODEL    3
 2121    HA   ASN 108           HA       ASN 108  -4.646   3.328  -6.747
  Start of MODEL    3
 2122    HB2  ASN 108           HB2      ASN 108  -4.545   1.302  -8.095
  Start of MODEL    3
 2123    HB3  ASN 108           HB3      ASN 108  -3.054   2.213  -8.310
  Start of MODEL    3
 2124   HD21  ASN 108          HD21      ASN 108  -4.498  -0.686  -7.073
  Start of MODEL    3
 2125   HD22  ASN 108          HD22      ASN 108  -3.021  -1.520  -6.737
  Start of MODEL    3
 2126    H    LEU 109           H        LEU 109  -6.546   2.265  -6.088
  Start of MODEL    3
 2127    HA   LEU 109           HA       LEU 109  -6.747   1.046  -3.618
  Start of MODEL    3
 2128    HB2  LEU 109           HB2      LEU 109  -8.467   0.705  -6.076
  Start of MODEL    3
 2129    HB3  LEU 109           HB3      LEU 109  -8.882   0.023  -4.515
  Start of MODEL    3
 2130    HG   LEU 109           HG       LEU 109  -8.528   2.977  -5.059
  Start of MODEL    3
 2131   HD13  LEU 109          HD11      LEU 109 -10.492   2.145  -6.198
  Start of MODEL    3
 2132   HD12  LEU 109          HD12      LEU 109 -10.977   3.074  -4.777
  Start of MODEL    3
 2133   HD11  LEU 109          HD13      LEU 109 -11.021   1.309  -4.739
  Start of MODEL    3
 2134   HD23  LEU 109          HD21      LEU 109  -9.543   1.496  -2.636
  Start of MODEL    3
 2135   HD22  LEU 109          HD22      LEU 109  -9.523   3.246  -2.842
  Start of MODEL    3
 2136   HD21  LEU 109          HD23      LEU 109  -8.007   2.350  -2.762
  Start of MODEL    3
 2137    H    ALA 110           H        ALA 110  -6.338  -0.948  -2.823
  Start of MODEL    3
 2138    HA   ALA 110           HA       ALA 110  -4.428  -2.446  -4.219
  Start of MODEL    3
 2139    HB3  ALA 110           HB1      ALA 110  -4.468  -2.246  -1.797
  Start of MODEL    3
 2140    HB2  ALA 110           HB2      ALA 110  -4.445  -3.936  -2.307
  Start of MODEL    3
 2141    HB1  ALA 110           HB3      ALA 110  -5.948  -3.206  -1.738
  Start of MODEL    3
 2142    H    TYR 111           H        TYR 111  -7.904  -2.961  -3.905
  Start of MODEL    3
 2143    HA   TYR 111           HA       TYR 111  -7.811  -5.695  -4.668
  Start of MODEL    3
 2144    HB2  TYR 111           HB2      TYR 111 -10.123  -5.687  -4.606
  Start of MODEL    3
 2145    HB3  TYR 111           HB3      TYR 111  -9.731  -4.361  -3.522
  Start of MODEL    3
 2146    HD1  TYR 111           HD1      TYR 111  -9.527  -2.008  -4.806
  Start of MODEL    3
 2147    HD2  TYR 111           HD2      TYR 111 -11.851  -5.325  -6.106
  Start of MODEL    3
 2148    HE1  TYR 111           HE1      TYR 111 -10.935  -0.492  -6.130
  Start of MODEL    3
 2149    HE2  TYR 111           HE2      TYR 111 -13.271  -3.820  -7.434
  Start of MODEL    3
 2150    HH   TYR 111           HH       TYR 111 -13.908  -1.507  -7.533
  Start of MODEL    3
 2151    H    LEU 112           H        LEU 112  -7.506  -2.800  -6.422
  Start of MODEL    3
 2152    HA   LEU 112           HA       LEU 112  -8.371  -3.703  -8.969
  Start of MODEL    3
 2153    HB2  LEU 112           HB2      LEU 112  -6.498  -1.480  -8.166
  Start of MODEL    3
 2154    HB3  LEU 112           HB3      LEU 112  -7.023  -1.764  -9.815
  Start of MODEL    3
 2155    HG   LEU 112           HG       LEU 112  -8.816  -1.068  -7.492
  Start of MODEL    3
 2156   HD13  LEU 112          HD11      LEU 112  -7.440   0.804  -8.254
  Start of MODEL    3
 2157   HD12  LEU 112          HD12      LEU 112  -9.137   1.042  -8.664
  Start of MODEL    3
 2158   HD11  LEU 112          HD13      LEU 112  -7.993   0.537  -9.907
  Start of MODEL    3
 2159   HD22  LEU 112          HD21      LEU 112 -10.589  -0.974  -9.138
  Start of MODEL    3
 2160   HD21  LEU 112          HD22      LEU 112  -9.856  -2.580  -9.123
  Start of MODEL    3
 2161   HD23  LEU 112          HD23      LEU 112  -9.462  -1.440 -10.411
  Start of MODEL    3
 2162    H    GLY 113           H        GLY 113  -5.764  -4.726  -7.156
  Start of MODEL    3
 2163    HA2  GLY 113           HA2      GLY 113  -4.423  -5.753  -9.524
  Start of MODEL    3
 2164    HA3  GLY 113           HA3      GLY 113  -3.468  -4.690  -8.501
  Start of MODEL    3
 2165    H    ALA 114           H        ALA 114  -5.781  -6.556  -6.826
  Start of MODEL    3
 2166    HA   ALA 114           HA       ALA 114  -3.639  -8.025  -5.536
  Start of MODEL    3
 2167    HB3  ALA 114           HB1      ALA 114  -5.428  -7.054  -4.177
  Start of MODEL    3
 2168    HB2  ALA 114           HB2      ALA 114  -5.350  -8.805  -3.993
  Start of MODEL    3
 2169    HB1  ALA 114           HB3      ALA 114  -6.607  -8.078  -4.994
  Start of MODEL    3
 2170    H    LYS 115           H        LYS 115  -2.994  -9.966  -6.135
  Start of MODEL    3
 2171    HA   LYS 115           HA       LYS 115  -4.484 -11.451  -8.111
  Start of MODEL    3
 2172    HB2  LYS 115           HB2      LYS 115  -1.868 -12.180  -6.783
  Start of MODEL    3
 2173    HB3  LYS 115           HB3      LYS 115  -2.545 -12.888  -8.245
  Start of MODEL    3
 2174    HG2  LYS 115           HG2      LYS 115  -2.442 -10.574  -9.258
  Start of MODEL    3
 2175    HG3  LYS 115           HG3      LYS 115  -1.463 -10.115  -7.865
  Start of MODEL    3
 2176    HD2  LYS 115           HD2      LYS 115   0.103 -11.977  -8.463
  Start of MODEL    3
 2177    HD3  LYS 115           HD3      LYS 115  -0.828 -12.197  -9.949
  Start of MODEL    3
 2178    HE2  LYS 115           HE2      LYS 115  -0.424  -9.718 -10.367
  Start of MODEL    3
 2179    HE3  LYS 115           HE3      LYS 115   0.769  -9.810  -9.072
  Start of MODEL    3
 2180    HZ2  LYS 115           HZ1      LYS 115   0.821 -11.118 -11.722
  Start of MODEL    3
 2181    HZ1  LYS 115           HZ2      LYS 115   1.728 -11.737 -10.434
  Start of MODEL    3
 2182    HZ3  LYS 115           HZ3      LYS 115   2.003 -10.156 -10.977
  Start of MODEL    3
 2183    HA   PRO 116           HA       PRO 116  -6.468 -14.193  -5.276
  Start of MODEL    3
 2184    HB2  PRO 116           HB2      PRO 116  -6.979 -16.286  -6.899
  Start of MODEL    3
 2185    HB3  PRO 116           HB3      PRO 116  -7.820 -14.741  -7.051
  Start of MODEL    3
 2186    HG2  PRO 116           HG2      PRO 116  -5.532 -15.817  -8.643
  Start of MODEL    3
 2187    HG3  PRO 116           HG3      PRO 116  -6.973 -14.949  -9.200
  Start of MODEL    3
 2188    HD2  PRO 116           HD2      PRO 116  -4.541 -13.765  -8.867
  Start of MODEL    3
 2189    HD3  PRO 116           HD3      PRO 116  -6.078 -12.898  -8.699
  Start of MODEL    3
 2190    H    ARG 117           H        ARG 117  -3.504 -14.305  -5.330
  Start of MODEL    3
 2191    HA   ARG 117           HA       ARG 117  -3.023 -17.176  -4.910
  Start of MODEL    3
 2192    HB2  ARG 117           HB2      ARG 117  -1.450 -15.758  -6.356
  Start of MODEL    3
 2193    HB3  ARG 117           HB3      ARG 117  -0.945 -14.980  -4.866
  Start of MODEL    3
 2194    HG2  ARG 117           HG2      ARG 117  -0.754 -17.945  -5.336
  Start of MODEL    3
 2195    HG3  ARG 117           HG3      ARG 117   0.548 -16.814  -5.695
  Start of MODEL    3
 2196    HD2  ARG 117           HD2      ARG 117   0.658 -16.159  -3.364
  Start of MODEL    3
 2197    HD3  ARG 117           HD3      ARG 117  -0.713 -17.198  -2.980
  Start of MODEL    3
 2198    HE   ARG 117           HE       ARG 117   1.985 -18.104  -3.729
  Start of MODEL    3
 2199   HH11  ARG 117          HH11      ARG 117  -1.165 -18.708  -2.316
  Start of MODEL    3
 2200   HH12  ARG 117          HH12      ARG 117  -0.758 -20.305  -1.777
  Start of MODEL    3
 2201   HH21  ARG 117          HH21      ARG 117   2.538 -20.185  -3.001
  Start of MODEL    3
 2202   HH22  ARG 117          HH22      ARG 117   1.361 -21.153  -2.162
  Start of MODEL    3
 2203    H    THR 118           H        THR 118  -2.343 -14.038  -3.409
  Start of MODEL    3
 2204    HA   THR 118           HA       THR 118  -2.306 -15.261  -0.780
  Start of MODEL    3
 2205    HB   THR 118           HB       THR 118  -0.627 -13.567  -1.166
  Start of MODEL    3
 2206    HG1  THR 118           HG1      THR 118  -1.034 -12.322   0.635
  Start of MODEL    3
 2207   HG22  THR 118          HG21      THR 118  -1.214 -11.218  -1.612
  Start of MODEL    3
 2208   HG21  THR 118          HG22      THR 118  -2.907 -11.683  -1.779
  Start of MODEL    3
 2209   HG23  THR 118          HG23      THR 118  -1.713 -12.285  -2.927
  Start of MODEL    3
 2210    H    ASN 119           H        ASN 119  -4.064 -15.418   0.428
  Start of MODEL    3
 2211    HA   ASN 119           HA       ASN 119  -6.453 -13.929  -0.418
  Start of MODEL    3
 2212    HB2  ASN 119           HB2      ASN 119  -6.210 -16.499   1.164
  Start of MODEL    3
 2213    HB3  ASN 119           HB3      ASN 119  -7.730 -15.681   0.811
  Start of MODEL    3
 2214   HD21  ASN 119          HD21      ASN 119  -5.147 -17.603  -0.462
  Start of MODEL    3
 2215   HD22  ASN 119          HD22      ASN 119  -5.878 -17.945  -1.989
  Start of MODEL    3
 2216    H    VAL 120           H        VAL 120  -4.192 -13.103   1.399
  Start of MODEL    3
 2217    HA   VAL 120           HA       VAL 120  -4.002 -11.618   3.109
  Start of MODEL    3
 2218    HB   VAL 120           HB       VAL 120  -6.992 -11.930   3.444
  Start of MODEL    3
 2219    H    GLN 121           H        GLN 121  -6.315 -14.185   3.969
  Start of MODEL    3
 2220    HA   GLN 121           HA       GLN 121  -4.552 -14.994   6.147
  Start of MODEL    3
 2221    HB2  GLN 121           HB2      GLN 121  -6.358 -15.038   7.782
  Start of MODEL    3
 2222    HB3  GLN 121           HB3      GLN 121  -6.141 -13.405   7.167
  Start of MODEL    3
 2223    HG2  GLN 121           HG2      GLN 121  -8.047 -13.824   5.612
  Start of MODEL    3
 2224    HG3  GLN 121           HG3      GLN 121  -8.309 -15.357   6.439
  Start of MODEL    3
 2225   HE21  GLN 121          HE21      GLN 121  -7.505 -14.146   9.031
  Start of MODEL    3
 2226   HE22  GLN 121          HE22      GLN 121  -8.878 -13.215   9.533
  Start of MODEL    3
 2227    H5'   DG   1           H5'       DG   1  20.401  -4.508  -5.106
  Start of MODEL    3
 2228    H4'   DG   1           H4'       DG   1  17.993  -4.350  -5.961
  Start of MODEL    3
 2229    H3'   DG   1           H3'       DG   1  18.392  -1.699  -6.338
  Start of MODEL    3
 2230    H2'   DG   1           H2'       DG   1  18.706  -1.035  -4.067
  Start of MODEL    3
 2231    H1'   DG   1           H1'       DG   1  16.573  -3.039  -3.192
  Start of MODEL    3
 2232    H8    DG   1           H8        DG   1  20.269  -2.132  -2.422
  Start of MODEL    3
 2233    H1    DG   1           H1        DG   1  16.371  -2.707   2.648
  Start of MODEL    3
 2234    H22   DG   1           H21       DG   1  13.937  -3.427   0.296
  Start of MODEL    3
 2235    H21   DG   1           H22       DG   1  14.343  -3.221   1.984
  Start of MODEL    3
 2236   HO5'   DG   1           H5T       DG   1  20.095  -2.060  -4.519
  Start of MODEL    3
 2237   H5''   DG   1          5H''       DG   1  20.095  -3.800  -6.699
  Start of MODEL    3
 2238   H2''   DG   1          2H''       DG   1  16.960  -0.885  -4.186
  Start of MODEL    3
 2239   H5''   DG   2           H5'       DG   2  13.922  -3.596  -9.452
  Start of MODEL    3
 2240    H4'   DG   2           H4'       DG   2  12.176  -2.309  -9.753
  Start of MODEL    3
 2241    H3'   DG   2           H3'       DG   2  13.917  -0.785 -11.148
  Start of MODEL    3
 2242    H2'   DG   2           H2'       DG   2  14.605   0.612  -9.296
  Start of MODEL    3
 2243    H1'   DG   2           H1'       DG   2  11.640   0.691  -8.508
  Start of MODEL    3
 2244    H8    DG   2           H8        DG   2  14.786   2.240  -7.691
  Start of MODEL    3
 2245    H1    DG   2           H1        DG   2  11.430   0.799  -2.403
  Start of MODEL    3
 2246    H22   DG   2           H21       DG   2   9.678  -1.326  -4.542
  Start of MODEL    3
 2247    H21   DG   2           H22       DG   2   9.875  -0.719  -2.920
  Start of MODEL    3
 2248    H5'   DG   2          5H''       DG   2  14.986  -2.243  -9.881
  Start of MODEL    3
 2249   H2''   DG   2          2H''       DG   2  13.337   1.578 -10.033
  Start of MODEL    3
 2250    H5'   DT   3           H5'       DT   3  10.034  -2.837  -9.806
  Start of MODEL    3
 2251    H4'   DT   3           H4'       DT   3   8.136  -4.257 -10.281
  Start of MODEL    3
 2252    H3'   DT   3           H3'       DT   3   8.393  -3.949 -12.925
  Start of MODEL    3
 2253    H2'   DT   3           H2'       DT   3   7.910  -1.581 -13.016
  Start of MODEL    3
 2254    H1'   DT   3           H1'       DT   3   5.587  -2.073 -11.091
  Start of MODEL    3
 2255    H3    DT   3           H3        DT   3   5.046   2.386 -12.202
  Start of MODEL    3
 2256    H73   DT   3           H71       DT   3   9.374   2.652  -9.734
  Start of MODEL    3
 2257    H72   DT   3           H72       DT   3   8.732   1.701  -8.373
  Start of MODEL    3
 2258    H71   DT   3           H73       DT   3   8.018   3.283  -8.769
  Start of MODEL    3
 2259    H6    DT   3           H6        DT   3   8.195  -0.227  -9.752
  Start of MODEL    3
 2260   H5''   DT   3          5H''       DT   3  10.274  -3.735 -11.318
  Start of MODEL    3
 2261   H2''   DT   3          2H''       DT   3   6.336  -2.287 -13.371
  Start of MODEL    3
 2262    H5'   DG   4           H5'       DG   4   4.630  -6.829  -9.552
  Start of MODEL    3
 2263    H4'   DG   4           H4'       DG   4   6.215  -5.320  -8.096
  Start of MODEL    3
 2264    H3'   DG   4           H3'       DG   4   3.530  -6.028  -7.821
  Start of MODEL    3
 2265    H2'   DG   4           H2'       DG   4   2.580  -3.934  -8.377
  Start of MODEL    3
 2266    H1'   DG   4           H1'       DG   4   5.105  -2.564  -7.324
  Start of MODEL    3
 2267    H8    DG   4           H8        DG   4   5.343  -0.178  -8.236
  Start of MODEL    3
 2268    H1    DG   4           H1        DG   4   0.250  -0.948 -12.073
  Start of MODEL    3
 2269    H22   DG   4           H21       DG   4   0.321  -4.239 -11.007
  Start of MODEL    3
 2270    H21   DG   4           H22       DG   4  -0.454  -3.025 -12.000
  Start of MODEL    3
 2271   H5''   DG   4          5H''       DG   4   4.611  -5.391 -10.599
  Start of MODEL    3
 2272   H2''   DG   4          2H''       DG   4   3.001  -3.572  -6.708
  Start of MODEL    3
 2273    H5'   DT   5           H5'       DT   5   3.787  -8.669  -3.651
  Start of MODEL    3
 2274    H4'   DT   5           H4'       DT   5   2.756  -7.541  -1.906
  Start of MODEL    3
 2275    H3'   DT   5           H3'       DT   5   1.401  -9.659  -2.854
  Start of MODEL    3
 2276    H2'   DT   5           H2'       DT   5   0.019  -8.394  -4.401
  Start of MODEL    3
 2277    H1'   DT   5           H1'       DT   5  -0.364  -6.420  -2.093
  Start of MODEL    3
 2278    H3    DT   5           H3        DT   5  -3.367  -4.130  -4.518
  Start of MODEL    3
 2279    H73   DT   5           H71       DT   5   0.636  -5.164  -7.840
  Start of MODEL    3
 2280    H71   DT   5           H72       DT   5  -0.622  -3.950  -8.170
  Start of MODEL    3
 2281    H72   DT   5           H73       DT   5   0.828  -3.494  -7.250
  Start of MODEL    3
 2282    H6    DT   5           H6        DT   5   0.966  -5.872  -5.439
  Start of MODEL    3
 2283   H5''   DT   5          5H''       DT   5   2.457  -8.342  -4.779
  Start of MODEL    3
 2284   H2''   DT   5          2H''       DT   5  -1.040  -8.595  -3.017
  Start of MODEL    3
 2285    H5'   DG   6           H5'       DG   6   2.654  -7.307   1.433
  Start of MODEL    3
 2286    H4'   DG   6           H4'       DG   6   3.392  -8.060   3.781
  Start of MODEL    3
 2287    H3'   DG   6           H3'       DG   6   1.867 -10.289   3.450
  Start of MODEL    3
 2288    H2'   DG   6           H2'       DG   6  -0.284  -9.257   3.387
  Start of MODEL    3
 2289    H1'   DG   6           H1'       DG   6   0.632  -7.221   5.471
  Start of MODEL    3
 2290    H8    DG   6           H8        DG   6  -1.135  -7.632   2.051
  Start of MODEL    3
 2291    H1    DG   6           H1        DG   6  -3.500  -3.081   5.913
  Start of MODEL    3
 2292    H22   DG   6           H21       DG   6  -0.934  -3.999   8.051
  Start of MODEL    3
 2293    H21   DG   6           H22       DG   6  -2.297  -2.946   7.749
  Start of MODEL    3
 2294   H5''   DG   6          5H''       DG   6   3.450  -8.878   1.648
  Start of MODEL    3
 2295   H2''   DG   6          2H''       DG   6  -0.117  -9.467   5.126
  Start of MODEL    3
 2296    H5'   DC   7           H5'       DC   7   4.139 -13.120   4.076
  Start of MODEL    3
 2297    H4'   DC   7           H4'       DC   7   2.955 -14.969   4.278
  Start of MODEL    3
 2298    H3'   DC   7           H3'       DC   7   0.512 -13.276   3.817
  Start of MODEL    3
 2299   HO3'   DC   7           H3T       DC   7   1.928 -14.309   2.176
  Start of MODEL    3
 2300    H2'   DC   7           H2'       DC   7  -0.839 -15.046   4.703
  Start of MODEL    3
 2301    H1'   DC   7           H1'       DC   7   1.003 -15.858   6.694
  Start of MODEL    3
 2302    H42   DC   7           H41       DC   7  -2.997 -11.147   9.100
  Start of MODEL    3
 2303    H41   DC   7           H42       DC   7  -2.882 -12.412  10.304
  Start of MODEL    3
 2304    H5    DC   7           H5        DC   7  -1.813 -11.228   6.991
  Start of MODEL    3
 2305    H6    DC   7           H6        DC   7  -0.307 -12.548   5.602
  Start of MODEL    3
 2306   H5''   DC   7          5H''       DC   7   2.652 -12.334   3.516
  Start of MODEL    3
 2307   H2''   DC   7          2H''       DC   7   0.430 -16.246   4.489
  Start of MODEL    4
 2308    H1   GLY  25           HT1      GLY  25 -15.288 -11.763  -6.882
  Start of MODEL    4
 2309    H2   GLY  25           HT2      GLY  25 -16.252 -10.620  -6.095
  Start of MODEL    4
 2310    H3   GLY  25           HT3      GLY  25 -16.183 -12.212  -5.512
  Start of MODEL    4
 2311    HA3  GLY  25           HA2      GLY  25 -14.857 -10.813  -4.113
  Start of MODEL    4
 2312    HA2  GLY  25           HA3      GLY  25 -13.983 -10.225  -5.520
  Start of MODEL    4
 2313    H    ALA  26           H        ALA  26 -12.067 -10.941  -4.383
  Start of MODEL    4
 2314    HA   ALA  26           HA       ALA  26 -11.314 -13.594  -5.218
  Start of MODEL    4
 2315    HB3  ALA  26           HB1      ALA  26  -9.752 -11.724  -5.406
  Start of MODEL    4
 2316    HB2  ALA  26           HB2      ALA  26  -9.101 -13.000  -4.378
  Start of MODEL    4
 2317    HB1  ALA  26           HB3      ALA  26  -9.762 -11.535  -3.652
  Start of MODEL    4
 2318    H    MET  27           H        MET  27 -11.776 -11.897  -2.164
  Start of MODEL    4
 2319    HA   MET  27           HA       MET  27 -12.094 -14.500  -0.851
  Start of MODEL    4
 2320    HB2  MET  27           HB2      MET  27 -10.985 -13.635   1.158
  Start of MODEL    4
 2321    HB3  MET  27           HB3      MET  27  -9.899 -13.605  -0.223
  Start of MODEL    4
 2322    HG2  MET  27           HG2      MET  27 -10.365 -11.203  -0.501
  Start of MODEL    4
 2323    HG3  MET  27           HG3      MET  27 -11.371 -11.255   0.945
  Start of MODEL    4
 2324    HE2  MET  27           HE1      MET  27  -8.654 -12.289   3.651
  Start of MODEL    4
 2325    HE1  MET  27           HE2      MET  27  -9.718 -13.334   2.708
  Start of MODEL    4
 2326    HE3  MET  27           HE3      MET  27 -10.347 -11.850   3.421
  Start of MODEL    4
 2327    H    GLY  28           H        GLY  28 -13.259 -14.185   1.332
  Start of MODEL    4
 2328    HA2  GLY  28           HA2      GLY  28 -15.760 -12.972   0.751
  Start of MODEL    4
 2329    HA3  GLY  28           HA3      GLY  28 -15.295 -13.707   2.276
  Start of MODEL    4
 2330    H    SER  29           H        SER  29 -12.927 -11.708   2.200
  Start of MODEL    4
 2331    HA   SER  29           HA       SER  29 -14.294  -9.647   3.678
  Start of MODEL    4
 2332    HB2  SER  29           HB2      SER  29 -11.361  -9.877   2.955
  Start of MODEL    4
 2333    HB3  SER  29           HB3      SER  29 -12.056  -8.794   4.164
  Start of MODEL    4
 2334    HG   SER  29           HG       SER  29 -12.946 -11.006   4.954
  Start of MODEL    4
 2335    H    ARG  30           H        ARG  30 -15.506  -8.432   2.331
  Start of MODEL    4
 2336    HA   ARG  30           HA       ARG  30 -14.194  -7.205   0.012
  Start of MODEL    4
 2337    HB2  ARG  30           HB2      ARG  30 -16.432  -6.655  -0.807
  Start of MODEL    4
 2338    HB3  ARG  30           HB3      ARG  30 -16.288  -8.379  -0.501
  Start of MODEL    4
 2339    HG2  ARG  30           HG2      ARG  30 -17.482  -6.503   1.513
  Start of MODEL    4
 2340    HG3  ARG  30           HG3      ARG  30 -18.439  -7.225   0.219
  Start of MODEL    4
 2341    HD2  ARG  30           HD2      ARG  30 -18.036  -9.413   1.023
  Start of MODEL    4
 2342    HD3  ARG  30           HD3      ARG  30 -16.765  -8.853   2.110
  Start of MODEL    4
 2343    HE   ARG  30           HE       ARG  30 -18.908  -7.544   3.047
  Start of MODEL    4
 2344   HH11  ARG  30          HH11      ARG  30 -18.435 -10.904   2.202
  Start of MODEL    4
 2345   HH12  ARG  30          HH12      ARG  30 -19.504 -11.500   3.429
  Start of MODEL    4
 2346   HH21  ARG  30          HH21      ARG  30 -20.301  -8.327   4.695
  Start of MODEL    4
 2347   HH22  ARG  30          HH22      ARG  30 -20.581 -10.039   4.836
  Start of MODEL    4
 2348    H    ASP  31           H        ASP  31 -14.942  -6.588   3.159
  Start of MODEL    4
 2349    HA   ASP  31           HA       ASP  31 -15.885  -3.932   3.103
  Start of MODEL    4
 2350    HB2  ASP  31           HB2      ASP  31 -15.116  -3.856   5.457
  Start of MODEL    4
 2351    HB3  ASP  31           HB3      ASP  31 -16.047  -5.311   5.103
  Start of MODEL    4
 2352    H    THR  32           H        THR  32 -12.801  -5.318   2.540
  Start of MODEL    4
 2353    HA   THR  32           HA       THR  32 -11.404  -2.793   2.984
  Start of MODEL    4
 2354    HB   THR  32           HB       THR  32  -9.607  -4.750   2.069
  Start of MODEL    4
 2355    HG1  THR  32           HG1      THR  32 -11.309  -5.836   4.086
  Start of MODEL    4
 2356   HG21  THR  32          HG21      THR  32 -10.262  -3.895   4.891
  Start of MODEL    4
 2357   HG23  THR  32          HG22      THR  32  -9.154  -3.076   3.793
  Start of MODEL    4
 2358   HG22  THR  32          HG23      THR  32  -8.778  -4.694   4.376
  Start of MODEL    4
 2359    H    MET  33           H        MET  33 -13.025  -4.257   0.476
  Start of MODEL    4
 2360    HA   MET  33           HA       MET  33 -11.256  -4.205  -1.645
  Start of MODEL    4
 2361    HB2  MET  33           HB2      MET  33 -14.224  -3.953  -1.478
  Start of MODEL    4
 2362    HB3  MET  33           HB3      MET  33 -13.424  -3.701  -3.023
  Start of MODEL    4
 2363    HG2  MET  33           HG2      MET  33 -12.453  -5.896  -2.931
  Start of MODEL    4
 2364    HG3  MET  33           HG3      MET  33 -13.112  -6.157  -1.321
  Start of MODEL    4
 2365    HE3  MET  33           HE1      MET  33 -14.847  -4.498  -4.487
  Start of MODEL    4
 2366    HE2  MET  33           HE2      MET  33 -15.617  -5.921  -5.190
  Start of MODEL    4
 2367    HE1  MET  33           HE3      MET  33 -13.858  -5.807  -5.125
  Start of MODEL    4
 2368    H    PHE  34           H        PHE  34 -13.306  -1.475  -0.510
  Start of MODEL    4
 2369    HA   PHE  34           HA       PHE  34 -12.015   0.137  -2.588
  Start of MODEL    4
 2370    HB2  PHE  34           HB2      PHE  34 -14.594   0.565  -1.066
  Start of MODEL    4
 2371    HB3  PHE  34           HB3      PHE  34 -13.917   1.713  -2.214
  Start of MODEL    4
 2372    HD1  PHE  34           HD1      PHE  34 -15.436  -1.613  -1.841
  Start of MODEL    4
 2373    HD2  PHE  34           HD2      PHE  34 -14.151   1.392  -4.569
  Start of MODEL    4
 2374    HE1  PHE  34           HE1      PHE  34 -16.611  -2.772  -3.661
  Start of MODEL    4
 2375    HE2  PHE  34           HE2      PHE  34 -15.328   0.234  -6.397
  Start of MODEL    4
 2376    HZ   PHE  34           HZ       PHE  34 -16.572  -1.806  -5.960
  Start of MODEL    4
 2377    H    THR  35           H        THR  35 -11.609  -0.572   0.568
  Start of MODEL    4
 2378    HA   THR  35           HA       THR  35 -11.029   2.195   1.373
  Start of MODEL    4
 2379    HB   THR  35           HB       THR  35 -11.024   1.224   3.713
  Start of MODEL    4
 2380    HG1  THR  35           HG1      THR  35 -12.517  -0.856   3.458
  Start of MODEL    4
 2381   HG23  THR  35          HG21      THR  35 -12.943   2.479   2.860
  Start of MODEL    4
 2382   HG22  THR  35          HG22      THR  35 -13.477   1.137   3.877
  Start of MODEL    4
 2383   HG21  THR  35          HG23      THR  35 -13.584   1.010   2.120
  Start of MODEL    4
 2384    H    LYS  36           H        LYS  36  -9.573  -0.863   0.678
  Start of MODEL    4
 2385    HA   LYS  36           HA       LYS  36  -7.189  -0.312   2.245
  Start of MODEL    4
 2386    HB2  LYS  36           HB2      LYS  36  -8.128  -2.540   2.347
  Start of MODEL    4
 2387    HB3  LYS  36           HB3      LYS  36  -8.130  -2.666   0.600
  Start of MODEL    4
 2388    HG2  LYS  36           HG2      LYS  36  -5.739  -2.824   0.556
  Start of MODEL    4
 2389    HG3  LYS  36           HG3      LYS  36  -5.647  -2.494   2.292
  Start of MODEL    4
 2390    HD2  LYS  36           HD2      LYS  36  -6.815  -4.533   2.801
  Start of MODEL    4
 2391    HD3  LYS  36           HD3      LYS  36  -7.125  -4.832   1.094
  Start of MODEL    4
 2392    HE2  LYS  36           HE2      LYS  36  -4.818  -5.244   0.673
  Start of MODEL    4
 2393    HE3  LYS  36           HE3      LYS  36  -4.362  -4.700   2.287
  Start of MODEL    4
 2394    HZ3  LYS  36           HZ1      LYS  36  -4.357  -7.070   2.267
  Start of MODEL    4
 2395    HZ2  LYS  36           HZ2      LYS  36  -5.907  -7.134   1.598
  Start of MODEL    4
 2396    HZ1  LYS  36           HZ3      LYS  36  -5.698  -6.577   3.180
  Start of MODEL    4
 2397    H    ILE  37           H        ILE  37  -5.604   0.796   1.363
  Start of MODEL    4
 2398    HA   ILE  37           HA       ILE  37  -5.401   1.000  -1.557
  Start of MODEL    4
 2399    HB   ILE  37           HB       ILE  37  -4.116   2.709   0.590
  Start of MODEL    4
 2400   HD12  ILE  37          HD11      ILE  37  -6.672   5.391  -0.029
  Start of MODEL    4
 2401   HD11  ILE  37          HD12      ILE  37  -5.085   5.306  -0.797
  Start of MODEL    4
 2402   HD13  ILE  37          HD13      ILE  37  -5.245   5.008   0.935
  Start of MODEL    4
 2403    H    PHE  38           H        PHE  38  -3.710   0.160  -2.605
  Start of MODEL    4
 2404    HA   PHE  38           HA       PHE  38  -1.465  -0.891  -1.043
  Start of MODEL    4
 2405    HB2  PHE  38           HB2      PHE  38  -2.421  -2.484  -2.626
  Start of MODEL    4
 2406    HB3  PHE  38           HB3      PHE  38  -2.249  -1.326  -3.940
  Start of MODEL    4
 2407    HD1  PHE  38           HD1      PHE  38  -0.254  -1.197  -5.175
  Start of MODEL    4
 2408    HD2  PHE  38           HD2      PHE  38  -0.340  -3.373  -1.519
  Start of MODEL    4
 2409    HE1  PHE  38           HE1      PHE  38   1.988  -2.095  -5.661
  Start of MODEL    4
 2410    HE2  PHE  38           HE2      PHE  38   1.896  -4.274  -1.994
  Start of MODEL    4
 2411    HZ   PHE  38           HZ       PHE  38   3.067  -3.635  -4.070
  Start of MODEL    4
 2412    H    VAL  39           H        VAL  39   0.405   0.245  -0.980
  Start of MODEL    4
 2413    HA   VAL  39           HA       VAL  39   0.637   2.484  -2.873
  Start of MODEL    4
 2414    HB   VAL  39           HB       VAL  39   2.092   2.308  -0.249
  Start of MODEL    4
 2415    H    GLY  40           H        GLY  40   2.422   2.634  -4.095
  Start of MODEL    4
 2416    HA2  GLY  40           HA2      GLY  40   4.426   0.475  -3.797
  Start of MODEL    4
 2417    HA3  GLY  40           HA3      GLY  40   3.665   0.790  -5.352
  Start of MODEL    4
 2418    H    GLY  41           H        GLY  41   6.423   0.879  -5.039
  Start of MODEL    4
 2419    HA2  GLY  41           HA2      GLY  41   8.106   2.214  -5.873
  Start of MODEL    4
 2420    HA3  GLY  41           HA3      GLY  41   6.891   3.442  -6.190
  Start of MODEL    4
 2421    H    LEU  42           H        LEU  42   6.825   2.430  -2.993
  Start of MODEL    4
 2422    HA   LEU  42           HA       LEU  42   7.586   4.957  -1.987
  Start of MODEL    4
 2423    HB2  LEU  42           HB2      LEU  42   7.166   2.290  -0.638
  Start of MODEL    4
 2424    HB3  LEU  42           HB3      LEU  42   7.523   3.764   0.238
  Start of MODEL    4
 2425    HG   LEU  42           HG       LEU  42   5.097   3.346  -1.506
  Start of MODEL    4
 2426   HD12  LEU  42          HD11      LEU  42   3.872   3.250   0.615
  Start of MODEL    4
 2427   HD11  LEU  42          HD12      LEU  42   5.401   3.300   1.492
  Start of MODEL    4
 2428   HD13  LEU  42          HD13      LEU  42   5.023   1.921   0.458
  Start of MODEL    4
 2429   HD23  LEU  42          HD21      LEU  42   5.845   5.566   0.395
  Start of MODEL    4
 2430   HD22  LEU  42          HD22      LEU  42   4.309   5.414  -0.462
  Start of MODEL    4
 2431   HD21  LEU  42          HD23      LEU  42   5.803   5.677  -1.364
  Start of MODEL    4
 2432    HA   PRO  43           HA       PRO  43  12.015   4.421  -1.798
  Start of MODEL    4
 2433    HB2  PRO  43           HB2      PRO  43  12.396   6.329   0.170
  Start of MODEL    4
 2434    HB3  PRO  43           HB3      PRO  43  12.320   6.676  -1.559
  Start of MODEL    4
 2435    HG2  PRO  43           HG2      PRO  43  10.206   6.964   0.524
  Start of MODEL    4
 2436    HG3  PRO  43           HG3      PRO  43  10.556   7.999  -0.871
  Start of MODEL    4
 2437    HD2  PRO  43           HD2      PRO  43   8.496   6.262  -0.859
  Start of MODEL    4
 2438    HD3  PRO  43           HD3      PRO  43   9.411   6.631  -2.337
  Start of MODEL    4
 2439    H    TYR  44           H        TYR  44  13.360   3.293  -0.411
  Start of MODEL    4
 2440    HA   TYR  44           HA       TYR  44  12.058   1.602   1.407
  Start of MODEL    4
 2441    HB2  TYR  44           HB2      TYR  44  15.016   2.100   1.081
  Start of MODEL    4
 2442    HB3  TYR  44           HB3      TYR  44  14.301   0.743   1.942
  Start of MODEL    4
 2443    HD1  TYR  44           HD1      TYR  44  12.296  -0.350   0.301
  Start of MODEL    4
 2444    HD2  TYR  44           HD2      TYR  44  15.950   1.446  -0.926
  Start of MODEL    4
 2445    HE1  TYR  44           HE1      TYR  44  12.205  -1.620  -1.806
  Start of MODEL    4
 2446    HE2  TYR  44           HE2      TYR  44  15.885   0.179  -3.036
  Start of MODEL    4
 2447    HH   TYR  44           HH       TYR  44  14.858  -1.909  -3.897
  Start of MODEL    4
 2448    H    HIS  45           H        HIS  45  13.350   4.728   1.900
  Start of MODEL    4
 2449    HA   HIS  45           HA       HIS  45  13.840   4.536   4.706
  Start of MODEL    4
 2450    HB2  HIS  45           HB2      HIS  45  12.987   7.052   3.268
  Start of MODEL    4
 2451    HB3  HIS  45           HB3      HIS  45  13.888   6.932   4.769
  Start of MODEL    4
 2452    HD1  HIS  45           HD1      HIS  45  16.406   6.734   4.609
  Start of MODEL    4
 2453    HD2  HIS  45           HD2      HIS  45  14.447   6.566   0.955
  Start of MODEL    4
 2454    HE1  HIS  45           HE1      HIS  45  18.221   6.943   2.874
  Start of MODEL    4
 2455    HE2  HIS  45           HE2      HIS  45  16.979   7.088   0.680
  Start of MODEL    4
 2456    H    THR  46           H        THR  46  10.940   4.893   2.826
  Start of MODEL    4
 2457    HA   THR  46           HA       THR  46   9.334   6.344   4.467
  Start of MODEL    4
 2458    HB   THR  46           HB       THR  46   8.446   3.929   2.877
  Start of MODEL    4
 2459    HG1  THR  46           HG1      THR  46   9.366   5.132   1.353
  Start of MODEL    4
 2460   HG22  THR  46          HG21      THR  46   6.331   5.135   2.664
  Start of MODEL    4
 2461   HG21  THR  46          HG22      THR  46   6.966   6.442   3.663
  Start of MODEL    4
 2462   HG23  THR  46          HG23      THR  46   6.720   4.842   4.358
  Start of MODEL    4
 2463    H    SER  47           H        SER  47   8.336   6.042   6.396
  Start of MODEL    4
 2464    HA   SER  47           HA       SER  47   8.489   3.365   7.582
  Start of MODEL    4
 2465    HB2  SER  47           HB2      SER  47   8.465   4.497   9.774
  Start of MODEL    4
 2466    HB3  SER  47           HB3      SER  47   9.827   5.026   8.790
  Start of MODEL    4
 2467    HG   SER  47           HG       SER  47   8.681   6.905   8.285
  Start of MODEL    4
 2468    H    ASP  48           H        ASP  48   6.757   2.856   9.121
  Start of MODEL    4
 2469    HA   ASP  48           HA       ASP  48   4.235   2.924   8.038
  Start of MODEL    4
 2470    HB2  ASP  48           HB2      ASP  48   4.686   2.835  11.021
  Start of MODEL    4
 2471    HB3  ASP  48           HB3      ASP  48   3.432   2.023  10.087
  Start of MODEL    4
 2472    H    LYS  49           H        LYS  49   5.718   5.201  10.247
  Start of MODEL    4
 2473    HA   LYS  49           HA       LYS  49   3.393   6.713  10.810
  Start of MODEL    4
 2474    HB2  LYS  49           HB2      LYS  49   5.214   7.050  12.281
  Start of MODEL    4
 2475    HB3  LYS  49           HB3      LYS  49   6.331   7.363  10.959
  Start of MODEL    4
 2476    HG2  LYS  49           HG2      LYS  49   5.290   9.486  10.515
  Start of MODEL    4
 2477    HG3  LYS  49           HG3      LYS  49   4.034   9.169  11.708
  Start of MODEL    4
 2478    HD2  LYS  49           HD2      LYS  49   6.924   9.176  12.492
  Start of MODEL    4
 2479    HD3  LYS  49           HD3      LYS  49   6.021  10.688  12.363
  Start of MODEL    4
 2480    HE2  LYS  49           HE2      LYS  49   5.164   8.334  14.040
  Start of MODEL    4
 2481    HE3  LYS  49           HE3      LYS  49   6.084   9.705  14.658
  Start of MODEL    4
 2482    HZ2  LYS  49           HZ1      LYS  49   3.685   9.894  15.068
  Start of MODEL    4
 2483    HZ1  LYS  49           HZ2      LYS  49   3.396   9.912  13.400
  Start of MODEL    4
 2484    HZ3  LYS  49           HZ3      LYS  49   4.267  11.174  14.124
  Start of MODEL    4
 2485    H    THR  50           H        THR  50   5.851   6.940   8.267
  Start of MODEL    4
 2486    HA   THR  50           HA       THR  50   5.107   9.456   7.260
  Start of MODEL    4
 2487    HB   THR  50           HB       THR  50   6.309   7.154   5.699
  Start of MODEL    4
 2488    HG1  THR  50           HG1      THR  50   7.503   9.094   7.420
  Start of MODEL    4
 2489   HG23  THR  50          HG21      THR  50   5.584   9.027   4.298
  Start of MODEL    4
 2490   HG22  THR  50          HG22      THR  50   7.345   8.927   4.348
  Start of MODEL    4
 2491   HG21  THR  50          HG23      THR  50   6.501  10.148   5.305
  Start of MODEL    4
 2492    H    LEU  51           H        LEU  51   3.968   6.195   6.522
  Start of MODEL    4
 2493    HA   LEU  51           HA       LEU  51   2.287   7.026   4.347
  Start of MODEL    4
 2494    HB2  LEU  51           HB2      LEU  51   2.328   4.514   6.013
  Start of MODEL    4
 2495    HB3  LEU  51           HB3      LEU  51   1.196   4.770   4.700
  Start of MODEL    4
 2496    HG   LEU  51           HG       LEU  51   4.200   4.582   4.477
  Start of MODEL    4
 2497   HD13  LEU  51          HD11      LEU  51   3.103   2.444   4.772
  Start of MODEL    4
 2498   HD12  LEU  51          HD12      LEU  51   3.677   2.607   3.112
  Start of MODEL    4
 2499   HD11  LEU  51          HD13      LEU  51   1.965   2.823   3.478
  Start of MODEL    4
 2500   HD23  LEU  51          HD21      LEU  51   2.136   5.148   2.349
  Start of MODEL    4
 2501   HD22  LEU  51          HD22      LEU  51   3.846   4.821   2.059
  Start of MODEL    4
 2502   HD21  LEU  51          HD23      LEU  51   3.361   6.270   2.941
  Start of MODEL    4
 2503    H    HIS  52           H        HIS  52   1.794   6.273   7.750
  Start of MODEL    4
 2504    HA   HIS  52           HA       HIS  52  -0.933   6.718   7.943
  Start of MODEL    4
 2505    HB2  HIS  52           HB2      HIS  52   0.363   5.833   9.808
  Start of MODEL    4
 2506    HB3  HIS  52           HB3      HIS  52   1.207   7.367   9.989
  Start of MODEL    4
 2507    HD1  HIS  52           HD1      HIS  52   0.083   9.153  11.400
  Start of MODEL    4
 2508    HD2  HIS  52           HD2      HIS  52  -2.387   5.901  10.611
  Start of MODEL    4
 2509    HE1  HIS  52           HE1      HIS  52  -1.943   9.479  12.844
  Start of MODEL    4
 2510    HE2  HIS  52           HE2      HIS  52  -3.538   7.678  12.104
  Start of MODEL    4
 2511    H    GLU  53           H        GLU  53   1.631   9.147   8.563
  Start of MODEL    4
 2512    HA   GLU  53           HA       GLU  53  -0.075  11.275   9.038
  Start of MODEL    4
 2513    HB2  GLU  53           HB2      GLU  53   2.612  11.582   7.692
  Start of MODEL    4
 2514    HB3  GLU  53           HB3      GLU  53   1.812  12.718   8.759
  Start of MODEL    4
 2515    HG2  GLU  53           HG2      GLU  53   2.962  10.055   9.547
  Start of MODEL    4
 2516    HG3  GLU  53           HG3      GLU  53   3.695  11.630   9.833
  Start of MODEL    4
 2517    H    TYR  54           H        TYR  54   1.224  10.113   5.961
  Start of MODEL    4
 2518    HA   TYR  54           HA       TYR  54   0.478  12.421   4.466
  Start of MODEL    4
 2519    HB2  TYR  54           HB2      TYR  54   2.159  10.402   4.002
  Start of MODEL    4
 2520    HB3  TYR  54           HB3      TYR  54   0.768   9.773   3.129
  Start of MODEL    4
 2521    HD1  TYR  54           HD1      TYR  54  -0.069  10.939   1.130
  Start of MODEL    4
 2522    HD2  TYR  54           HD2      TYR  54   3.393  12.297   3.199
  Start of MODEL    4
 2523    HE1  TYR  54           HE1      TYR  54   0.559  12.301  -0.825
  Start of MODEL    4
 2524    HE2  TYR  54           HE2      TYR  54   4.027  13.665   1.257
  Start of MODEL    4
 2525    HH   TYR  54           HH       TYR  54   3.632  13.642  -1.209
  Start of MODEL    4
 2526    H    PHE  55           H        PHE  55  -0.887   9.130   4.524
  Start of MODEL    4
 2527    HA   PHE  55           HA       PHE  55  -3.087   9.845   2.886
  Start of MODEL    4
 2528    HB2  PHE  55           HB2      PHE  55  -2.381   7.374   4.426
  Start of MODEL    4
 2529    HB3  PHE  55           HB3      PHE  55  -3.884   7.501   3.511
  Start of MODEL    4
 2530    HD1  PHE  55           HD1      PHE  55  -0.272   7.152   3.352
  Start of MODEL    4
 2531    HD2  PHE  55           HD2      PHE  55  -3.824   7.675   1.070
  Start of MODEL    4
 2532    HE1  PHE  55           HE1      PHE  55   0.938   6.482   1.321
  Start of MODEL    4
 2533    HE2  PHE  55           HE2      PHE  55  -2.619   7.006  -0.968
  Start of MODEL    4
 2534    HZ   PHE  55           HZ       PHE  55  -0.223   6.457  -0.857
  Start of MODEL    4
 2535    H    GLU  56           H        GLU  56  -2.682   9.808   6.347
  Start of MODEL    4
 2536    HA   GLU  56           HA       GLU  56  -5.349   9.479   7.155
  Start of MODEL    4
 2537    HB2  GLU  56           HB2      GLU  56  -2.846  10.492   8.297
  Start of MODEL    4
 2538    HB3  GLU  56           HB3      GLU  56  -4.296  11.157   9.050
  Start of MODEL    4
 2539    HG2  GLU  56           HG2      GLU  56  -4.178   8.231   8.664
  Start of MODEL    4
 2540    HG3  GLU  56           HG3      GLU  56  -3.087   8.936   9.856
  Start of MODEL    4
 2541    H    GLN  57           H        GLN  57  -3.728  12.175   5.750
  Start of MODEL    4
 2542    HA   GLN  57           HA       GLN  57  -5.493  14.203   6.681
  Start of MODEL    4
 2543    HB2  GLN  57           HB2      GLN  57  -3.584  14.166   4.345
  Start of MODEL    4
 2544    HB3  GLN  57           HB3      GLN  57  -4.426  15.597   4.926
  Start of MODEL    4
 2545    HG2  GLN  57           HG2      GLN  57  -2.521  13.953   6.574
  Start of MODEL    4
 2546    HG3  GLN  57           HG3      GLN  57  -2.085  15.420   5.700
  Start of MODEL    4
 2547   HE21  GLN  57          HE21      GLN  57  -4.631  16.732   6.280
  Start of MODEL    4
 2548   HE22  GLN  57          HE22      GLN  57  -4.564  17.200   7.945
  Start of MODEL    4
 2549    H    PHE  58           H        PHE  58  -5.995  11.731   4.450
  Start of MODEL    4
 2550    HA   PHE  58           HA       PHE  58  -7.734  13.320   2.750
  Start of MODEL    4
 2551    HB2  PHE  58           HB2      PHE  58  -6.956  10.409   2.666
  Start of MODEL    4
 2552    HB3  PHE  58           HB3      PHE  58  -8.114  11.133   1.564
  Start of MODEL    4
 2553    HD1  PHE  58           HD1      PHE  58  -4.579  11.186   2.630
  Start of MODEL    4
 2554    HD2  PHE  58           HD2      PHE  58  -7.436  12.401  -0.277
  Start of MODEL    4
 2555    HE1  PHE  58           HE1      PHE  58  -2.753  11.899   1.146
  Start of MODEL    4
 2556    HE2  PHE  58           HE2      PHE  58  -5.614  13.128  -1.767
  Start of MODEL    4
 2557    HZ   PHE  58           HZ       PHE  58  -3.271  12.871  -1.055
  Start of MODEL    4
 2558    H    GLY  59           H        GLY  59  -8.077  10.955   5.368
  Start of MODEL    4
 2559    HA2  GLY  59           HA2      GLY  59 -10.494  11.710   6.244
  Start of MODEL    4
 2560    HA3  GLY  59           HA3      GLY  59 -10.928  10.752   4.855
  Start of MODEL    4
 2561    H    ASP  60           H        ASP  60  -8.697  10.462   7.489
  Start of MODEL    4
 2562    HA   ASP  60           HA       ASP  60  -8.542   9.122   9.294
  Start of MODEL    4
 2563    HB2  ASP  60           HB2      ASP  60 -11.222   8.375   8.282
  Start of MODEL    4
 2564    HB3  ASP  60           HB3      ASP  60 -10.503   7.457   9.596
  Start of MODEL    4
 2565    H    ILE  61           H        ILE  61  -7.049   7.666   9.370
  Start of MODEL    4
 2566    HA   ILE  61           HA       ILE  61  -7.143   5.368   7.563
  Start of MODEL    4
 2567    HB   ILE  61           HB       ILE  61  -4.960   6.633   9.176
  Start of MODEL    4
 2568   HD11  ILE  61          HD11      ILE  61  -2.855   5.676   7.349
  Start of MODEL    4
 2569   HD13  ILE  61          HD12      ILE  61  -2.986   7.435   7.359
  Start of MODEL    4
 2570   HD12  ILE  61          HD13      ILE  61  -3.103   6.549   5.845
  Start of MODEL    4
 2571    H    GLU  62           H        GLU  62  -7.514   3.395   8.186
  Start of MODEL    4
 2572    HA   GLU  62           HA       GLU  62  -8.162   2.694  10.906
  Start of MODEL    4
 2573    HB2  GLU  62           HB2      GLU  62  -8.030   1.254   8.273
  Start of MODEL    4
 2574    HB3  GLU  62           HB3      GLU  62  -8.197   0.348   9.761
  Start of MODEL    4
 2575    HG2  GLU  62           HG2      GLU  62 -10.088   2.494   8.826
  Start of MODEL    4
 2576    HG3  GLU  62           HG3      GLU  62 -10.331   0.761   8.606
  Start of MODEL    4
 2577    H    GLU  63           H        GLU  63  -5.680   1.900   8.546
  Start of MODEL    4
 2578    HA   GLU  63           HA       GLU  63  -3.690   1.465  10.605
  Start of MODEL    4
 2579    HB2  GLU  63           HB2      GLU  63  -4.746  -0.738  10.543
  Start of MODEL    4
 2580    HB3  GLU  63           HB3      GLU  63  -4.534  -0.813   8.799
  Start of MODEL    4
 2581    HG2  GLU  63           HG2      GLU  63  -2.877  -2.173   9.876
  Start of MODEL    4
 2582    HG3  GLU  63           HG3      GLU  63  -2.094  -0.785   9.126
  Start of MODEL    4
 2583    H    ALA  64           H        ALA  64  -1.615   1.796   9.868
  Start of MODEL    4
 2584    HA   ALA  64           HA       ALA  64  -1.202   1.968   6.977
  Start of MODEL    4
 2585    HB3  ALA  64           HB1      ALA  64  -1.709   4.244   7.623
  Start of MODEL    4
 2586    HB2  ALA  64           HB2      ALA  64   0.007   4.106   7.227
  Start of MODEL    4
 2587    HB1  ALA  64           HB3      ALA  64  -0.508   4.170   8.915
  Start of MODEL    4
 2588    H    VAL  65           H        VAL  65   0.414   0.616   6.584
  Start of MODEL    4
 2589    HA   VAL  65           HA       VAL  65   2.793   0.710   8.301
  Start of MODEL    4
 2590    HB   VAL  65           HB       VAL  65   3.039  -1.765   8.189
  Start of MODEL    4
 2591    H    VAL  66           H        VAL  66   4.731   0.266   7.296
  Start of MODEL    4
 2592    HA   VAL  66           HA       VAL  66   4.674   0.030   4.375
  Start of MODEL    4
 2593    HB   VAL  66           HB       VAL  66   7.034   0.369   6.251
  Start of MODEL    4
 2594    H    ILE  67           H        ILE  67   5.369  -1.823   3.294
  Start of MODEL    4
 2595    HA   ILE  67           HA       ILE  67   5.046  -4.163   4.960
  Start of MODEL    4
 2596    HB   ILE  67           HB       ILE  67   5.126  -3.861   1.965
  Start of MODEL    4
 2597   HD13  ILE  67          HD11      ILE  67   2.681  -5.548   4.392
  Start of MODEL    4
 2598   HD12  ILE  67          HD12      ILE  67   1.665  -4.104   4.424
  Start of MODEL    4
 2599   HD11  ILE  67          HD13      ILE  67   3.275  -4.067   5.144
  Start of MODEL    4
 2600    H    THR  68           H        THR  68   6.558  -5.424   5.588
  Start of MODEL    4
 2601    HA   THR  68           HA       THR  68   9.208  -5.271   4.328
  Start of MODEL    4
 2602    HB   THR  68           HB       THR  68  10.141  -5.738   6.617
  Start of MODEL    4
 2603    HG1  THR  68           HG1      THR  68   7.795  -4.772   7.783
  Start of MODEL    4
 2604   HG22  THR  68          HG21      THR  68   9.921  -3.445   7.463
  Start of MODEL    4
 2605   HG21  THR  68          HG22      THR  68   8.561  -3.170   6.375
  Start of MODEL    4
 2606   HG23  THR  68          HG23      THR  68  10.172  -3.456   5.716
  Start of MODEL    4
 2607    H    ASP  69           H        ASP  69  10.267  -7.292   4.102
  Start of MODEL    4
 2608    HA   ASP  69           HA       ASP  69   8.782  -9.632   4.016
  Start of MODEL    4
 2609    HB2  ASP  69           HB2      ASP  69  10.827  -9.628   2.843
  Start of MODEL    4
 2610    HB3  ASP  69           HB3      ASP  69  11.738  -9.094   4.252
  Start of MODEL    4
 2611    H    ARG  70           H        ARG  70   8.244 -11.177   5.467
  Start of MODEL    4
 2612    HA   ARG  70           HA       ARG  70   8.144 -10.621   8.191
  Start of MODEL    4
 2613    HB2  ARG  70           HB2      ARG  70   8.252 -13.419   7.090
  Start of MODEL    4
 2614    HB3  ARG  70           HB3      ARG  70   7.407 -12.856   8.523
  Start of MODEL    4
 2615    HG2  ARG  70           HG2      ARG  70   6.414 -11.414   6.295
  Start of MODEL    4
 2616    HG3  ARG  70           HG3      ARG  70   6.453 -13.131   5.884
  Start of MODEL    4
 2617    HD2  ARG  70           HD2      ARG  70   5.123 -11.852   8.273
  Start of MODEL    4
 2618    HD3  ARG  70           HD3      ARG  70   4.320 -12.595   6.891
  Start of MODEL    4
 2619    HE   ARG  70           HE       ARG  70   5.793 -14.626   7.862
  Start of MODEL    4
 2620   HH11  ARG  70          HH11      ARG  70   3.555 -12.386   9.354
  Start of MODEL    4
 2621   HH12  ARG  70          HH12      ARG  70   3.098 -13.479  10.620
  Start of MODEL    4
 2622   HH21  ARG  70          HH21      ARG  70   5.198 -16.081   9.508
  Start of MODEL    4
 2623   HH22  ARG  70          HH22      ARG  70   4.033 -15.596  10.704
  Start of MODEL    4
 2624    H    ASN  71           H        ASN  71  10.581 -12.369   6.338
  Start of MODEL    4
 2625    HA   ASN  71           HA       ASN  71  11.819 -13.546   8.617
  Start of MODEL    4
 2626    HB2  ASN  71           HB2      ASN  71  12.650 -13.280   5.732
  Start of MODEL    4
 2627    HB3  ASN  71           HB3      ASN  71  13.555 -14.212   6.923
  Start of MODEL    4
 2628   HD21  ASN  71          HD21      ASN  71  10.804 -14.055   4.866
  Start of MODEL    4
 2629   HD22  ASN  71          HD22      ASN  71  10.241 -15.670   5.141
  Start of MODEL    4
 2630    H    THR  72           H        THR  72  12.967 -11.116   6.267
  Start of MODEL    4
 2631    HA   THR  72           HA       THR  72  15.169 -10.460   8.056
  Start of MODEL    4
 2632    HB   THR  72           HB       THR  72  15.932  -9.037   6.135
  Start of MODEL    4
 2633    HG1  THR  72           HG1      THR  72  13.751 -10.285   4.758
  Start of MODEL    4
 2634   HG23  THR  72          HG21      THR  72  16.707 -11.344   6.389
  Start of MODEL    4
 2635   HG22  THR  72          HG22      THR  72  16.525 -10.917   4.687
  Start of MODEL    4
 2636   HG21  THR  72          HG23      THR  72  15.306 -11.918   5.481
  Start of MODEL    4
 2637    H    GLN  73           H        GLN  73  12.176  -9.184   7.083
  Start of MODEL    4
 2638    HA   GLN  73           HA       GLN  73  10.927  -7.419   7.834
  Start of MODEL    4
 2639    HB2  GLN  73           HB2      GLN  73  13.198  -7.007   9.784
  Start of MODEL    4
 2640    HB3  GLN  73           HB3      GLN  73  11.624  -6.228   9.866
  Start of MODEL    4
 2641    HG2  GLN  73           HG2      GLN  73  10.531  -8.265  10.342
  Start of MODEL    4
 2642    HG3  GLN  73           HG3      GLN  73  11.966  -9.207   9.920
  Start of MODEL    4
 2643   HE21  GLN  73          HE21      GLN  73  11.957 -10.221  11.925
  Start of MODEL    4
 2644   HE22  GLN  73          HE22      GLN  73  12.491  -9.410  13.358
  Start of MODEL    4
 2645    H    LYS  74           H        LYS  74  12.929  -7.258   5.761
  Start of MODEL    4
 2646    HA   LYS  74           HA       LYS  74  13.911  -4.519   5.831
  Start of MODEL    4
 2647    HB2  LYS  74           HB2      LYS  74  14.050  -6.589   3.634
  Start of MODEL    4
 2648    HB3  LYS  74           HB3      LYS  74  14.900  -5.051   3.654
  Start of MODEL    4
 2649    HG2  LYS  74           HG2      LYS  74  15.314  -7.149   5.760
  Start of MODEL    4
 2650    HG3  LYS  74           HG3      LYS  74  16.233  -7.115   4.255
  Start of MODEL    4
 2651    HD2  LYS  74           HD2      LYS  74  16.072  -4.745   6.103
  Start of MODEL    4
 2652    HD3  LYS  74           HD3      LYS  74  17.303  -6.001   6.270
  Start of MODEL    4
 2653    HE2  LYS  74           HE2      LYS  74  16.826  -4.292   3.828
  Start of MODEL    4
 2654    HE3  LYS  74           HE3      LYS  74  18.150  -4.109   4.977
  Start of MODEL    4
 2655    HZ3  LYS  74           HZ1      LYS  74  19.032  -5.311   3.187
  Start of MODEL    4
 2656    HZ2  LYS  74           HZ2      LYS  74  17.678  -6.322   3.067
  Start of MODEL    4
 2657    HZ1  LYS  74           HZ3      LYS  74  18.739  -6.481   4.384
  Start of MODEL    4
 2658    H    SER  75           H        SER  75  12.907  -2.816   4.832
  Start of MODEL    4
 2659    HA   SER  75           HA       SER  75  10.284  -2.962   3.981
  Start of MODEL    4
 2660    HB2  SER  75           HB2      SER  75  10.815  -0.688   2.904
  Start of MODEL    4
 2661    HB3  SER  75           HB3      SER  75  11.110  -0.841   4.632
  Start of MODEL    4
 2662    HG   SER  75           HG       SER  75  12.906   0.112   3.756
  Start of MODEL    4
 2663    H    ARG  76           H        ARG  76   9.291  -3.457   2.143
  Start of MODEL    4
 2664    HA   ARG  76           HA       ARG  76  10.945  -4.486  -0.024
  Start of MODEL    4
 2665    HB2  ARG  76           HB2      ARG  76   7.940  -4.611   0.210
  Start of MODEL    4
 2666    HB3  ARG  76           HB3      ARG  76   8.971  -5.581  -0.835
  Start of MODEL    4
 2667    HG2  ARG  76           HG2      ARG  76  10.020  -6.436   1.350
  Start of MODEL    4
 2668    HG3  ARG  76           HG3      ARG  76   8.584  -5.767   2.127
  Start of MODEL    4
 2669    HD2  ARG  76           HD2      ARG  76   8.122  -8.045   1.689
  Start of MODEL    4
 2670    HD3  ARG  76           HD3      ARG  76   7.214  -7.108   0.502
  Start of MODEL    4
 2671    HE   ARG  76           HE       ARG  76   9.747  -7.845  -0.529
  Start of MODEL    4
 2672   HH11  ARG  76          HH11      ARG  76   6.594  -9.176   0.186
  Start of MODEL    4
 2673   HH12  ARG  76          HH12      ARG  76   6.721 -10.431  -1.006
  Start of MODEL    4
 2674   HH21  ARG  76          HH21      ARG  76   9.918  -9.476  -2.083
  Start of MODEL    4
 2675   HH22  ARG  76          HH22      ARG  76   8.602 -10.595  -2.311
  Start of MODEL    4
 2676    H    GLY  77           H        GLY  77  10.229  -1.585   0.645
  Start of MODEL    4
 2677    HA2  GLY  77           HA2      GLY  77  10.041   0.350  -0.579
  Start of MODEL    4
 2678    HA3  GLY  77           HA3      GLY  77  10.121  -0.650  -2.018
  Start of MODEL    4
 2679    H    TYR  78           H        TYR  78   7.593  -1.416   0.167
  Start of MODEL    4
 2680    HA   TYR  78           HA       TYR  78   5.715   0.466  -0.896
  Start of MODEL    4
 2681    HB2  TYR  78           HB2      TYR  78   4.190  -1.182  -1.903
  Start of MODEL    4
 2682    HB3  TYR  78           HB3      TYR  78   5.722  -1.102  -2.757
  Start of MODEL    4
 2683    HD1  TYR  78           HD1      TYR  78   3.639  -3.154  -0.510
  Start of MODEL    4
 2684    HD2  TYR  78           HD2      TYR  78   7.150  -3.000  -2.903
  Start of MODEL    4
 2685    HE1  TYR  78           HE1      TYR  78   3.839  -5.595  -0.357
  Start of MODEL    4
 2686    HE2  TYR  78           HE2      TYR  78   7.370  -5.440  -2.752
  Start of MODEL    4
 2687    HH   TYR  78           HH       TYR  78   4.886  -7.439  -1.710
  Start of MODEL    4
 2688    H    GLY  79           H        GLY  79   3.425  -0.118  -0.037
  Start of MODEL    4
 2689    HA2  GLY  79           HA2      GLY  79   3.463  -1.623   2.427
  Start of MODEL    4
 2690    HA3  GLY  79           HA3      GLY  79   3.460   0.117   2.661
  Start of MODEL    4
 2691    H    PHE  80           H        PHE  80   1.422  -0.589   3.793
  Start of MODEL    4
 2692    HA   PHE  80           HA       PHE  80  -0.807  -0.450   1.895
  Start of MODEL    4
 2693    HB2  PHE  80           HB2      PHE  80  -0.485  -2.359   4.191
  Start of MODEL    4
 2694    HB3  PHE  80           HB3      PHE  80  -2.082  -1.884   3.629
  Start of MODEL    4
 2695    HD1  PHE  80           HD1      PHE  80   0.965  -3.725   2.844
  Start of MODEL    4
 2696    HD2  PHE  80           HD2      PHE  80  -2.910  -2.623   1.491
  Start of MODEL    4
 2697    HE1  PHE  80           HE1      PHE  80   1.106  -5.428   1.085
  Start of MODEL    4
 2698    HE2  PHE  80           HE2      PHE  80  -2.786  -4.328  -0.276
  Start of MODEL    4
 2699    HZ   PHE  80           HZ       PHE  80  -0.860  -5.813  -0.410
  Start of MODEL    4
 2700    H    VAL  81           H        VAL  81  -2.330   0.904   2.359
  Start of MODEL    4
 2701    HA   VAL  81           HA       VAL  81  -2.639   1.778   5.160
  Start of MODEL    4
 2702    HB   VAL  81           HB       VAL  81  -2.934   3.512   2.703
  Start of MODEL    4
 2703    H    THR  82           H        THR  82  -4.550   1.303   5.982
  Start of MODEL    4
 2704    HA   THR  82           HA       THR  82  -6.732   0.658   4.128
  Start of MODEL    4
 2705    HB   THR  82           HB       THR  82  -6.602   0.012   7.084
  Start of MODEL    4
 2706    HG1  THR  82           HG1      THR  82  -5.363  -1.201   4.936
  Start of MODEL    4
 2707   HG21  THR  82          HG21      THR  82  -8.275  -1.069   4.817
  Start of MODEL    4
 2708   HG23  THR  82          HG22      THR  82  -8.831  -0.020   6.123
  Start of MODEL    4
 2709   HG22  THR  82          HG23      THR  82  -8.304  -1.666   6.478
  Start of MODEL    4
 2710    H    MET  83           H        MET  83  -7.960   2.419   3.812
  Start of MODEL    4
 2711    HA   MET  83           HA       MET  83  -7.998   4.532   5.781
  Start of MODEL    4
 2712    HB2  MET  83           HB2      MET  83  -9.330   4.306   3.072
  Start of MODEL    4
 2713    HB3  MET  83           HB3      MET  83  -9.402   5.731   4.102
  Start of MODEL    4
 2714    HG2  MET  83           HG2      MET  83  -6.861   4.540   3.015
  Start of MODEL    4
 2715    HG3  MET  83           HG3      MET  83  -7.729   5.887   2.284
  Start of MODEL    4
 2716    HE3  MET  83           HE1      MET  83  -7.824   8.319   3.271
  Start of MODEL    4
 2717    HE2  MET  83           HE2      MET  83  -7.312   8.726   4.912
  Start of MODEL    4
 2718    HE1  MET  83           HE3      MET  83  -8.691   7.656   4.659
  Start of MODEL    4
 2719    H    LYS  84           H        LYS  84  -9.914   5.420   6.614
  Start of MODEL    4
 2720    HA   LYS  84           HA       LYS  84 -11.623   3.396   7.668
  Start of MODEL    4
 2721    HB2  LYS  84           HB2      LYS  84 -10.715   5.537   8.781
  Start of MODEL    4
 2722    HB3  LYS  84           HB3      LYS  84 -12.016   6.368   7.939
  Start of MODEL    4
 2723    HG2  LYS  84           HG2      LYS  84 -13.674   5.271   9.165
  Start of MODEL    4
 2724    HG3  LYS  84           HG3      LYS  84 -12.567   4.001   9.697
  Start of MODEL    4
 2725    HD2  LYS  84           HD2      LYS  84 -12.430   6.904  10.513
  Start of MODEL    4
 2726    HD3  LYS  84           HD3      LYS  84 -13.069   5.593  11.505
  Start of MODEL    4
 2727    HE2  LYS  84           HE2      LYS  84 -10.881   4.510  11.499
  Start of MODEL    4
 2728    HE3  LYS  84           HE3      LYS  84 -10.245   5.792  10.468
  Start of MODEL    4
 2729    HZ2  LYS  84           HZ1      LYS  84  -9.695   6.085  12.828
  Start of MODEL    4
 2730    HZ1  LYS  84           HZ2      LYS  84 -11.345   6.211  13.194
  Start of MODEL    4
 2731    HZ3  LYS  84           HZ3      LYS  84 -10.600   7.379  12.216
  Start of MODEL    4
 2732    H    ASP  85           H        ASP  85 -11.718   5.358   4.897
  Start of MODEL    4
 2733    HA   ASP  85           HA       ASP  85 -14.439   4.538   4.344
  Start of MODEL    4
 2734    HB2  ASP  85           HB2      ASP  85 -14.829   6.711   5.356
  Start of MODEL    4
 2735    HB3  ASP  85           HB3      ASP  85 -13.600   7.448   4.329
  Start of MODEL    4
 2736    H    ARG  86           H        ARG  86 -14.975   4.637   2.130
  Start of MODEL    4
 2737    HA   ARG  86           HA       ARG  86 -12.888   3.990   0.365
  Start of MODEL    4
 2738    HB2  ARG  86           HB2      ARG  86 -14.964   3.022  -0.060
  Start of MODEL    4
 2739    HB3  ARG  86           HB3      ARG  86 -15.821   4.543   0.105
  Start of MODEL    4
 2740    HG2  ARG  86           HG2      ARG  86 -14.825   5.288  -2.032
  Start of MODEL    4
 2741    HG3  ARG  86           HG3      ARG  86 -14.088   3.688  -2.202
  Start of MODEL    4
 2742    HD2  ARG  86           HD2      ARG  86 -16.187   2.627  -2.349
  Start of MODEL    4
 2743    HD3  ARG  86           HD3      ARG  86 -17.039   4.058  -1.773
  Start of MODEL    4
 2744    HE   ARG  86           HE       ARG  86 -15.625   4.350  -4.291
  Start of MODEL    4
 2745   HH11  ARG  86          HH11      ARG  86 -18.636   3.750  -2.613
  Start of MODEL    4
 2746   HH12  ARG  86          HH12      ARG  86 -19.635   4.098  -3.990
  Start of MODEL    4
 2747   HH21  ARG  86          HH21      ARG  86 -16.934   4.769  -6.141
  Start of MODEL    4
 2748   HH22  ARG  86          HH22      ARG  86 -18.669   4.684  -5.993
  Start of MODEL    4
 2749    H    ALA  87           H        ALA  87 -14.747   6.984   0.821
  Start of MODEL    4
 2750    HA   ALA  87           HA       ALA  87 -13.815   8.222  -1.567
  Start of MODEL    4
 2751    HB2  ALA  87           HB1      ALA  87 -14.782  10.268  -0.690
  Start of MODEL    4
 2752    HB1  ALA  87           HB2      ALA  87 -14.939   9.536   0.909
  Start of MODEL    4
 2753    HB3  ALA  87           HB3      ALA  87 -15.886   8.913  -0.445
  Start of MODEL    4
 2754    H    SER  88           H        SER  88 -12.706   8.322   1.806
  Start of MODEL    4
 2755    HA   SER  88           HA       SER  88 -10.714  10.279   1.490
  Start of MODEL    4
 2756    HB2  SER  88           HB2      SER  88  -9.701   8.836   3.427
  Start of MODEL    4
 2757    HB3  SER  88           HB3      SER  88 -11.136   9.814   3.681
  Start of MODEL    4
 2758    HG   SER  88           HG       SER  88 -11.520   7.784   4.486
  Start of MODEL    4
 2759    H    ALA  89           H        ALA  89 -10.685   6.767   1.199
  Start of MODEL    4
 2760    HA   ALA  89           HA       ALA  89  -7.983   6.441   0.499
  Start of MODEL    4
 2761    HB3  ALA  89           HB1      ALA  89  -9.410   4.576   1.157
  Start of MODEL    4
 2762    HB2  ALA  89           HB2      ALA  89  -8.672   4.274  -0.418
  Start of MODEL    4
 2763    HB1  ALA  89           HB3      ALA  89 -10.363   4.772  -0.314
  Start of MODEL    4
 2764    H    GLU  90           H        GLU  90 -10.846   7.074  -1.466
  Start of MODEL    4
 2765    HA   GLU  90           HA       GLU  90  -9.539   6.717  -3.960
  Start of MODEL    4
 2766    HB2  GLU  90           HB2      GLU  90 -12.151   7.977  -3.209
  Start of MODEL    4
 2767    HB3  GLU  90           HB3      GLU  90 -11.573   7.926  -4.872
  Start of MODEL    4
 2768    HG2  GLU  90           HG2      GLU  90 -11.210   5.423  -4.373
  Start of MODEL    4
 2769    HG3  GLU  90           HG3      GLU  90 -12.359   5.735  -3.076
  Start of MODEL    4
 2770    H    ARG  91           H        ARG  91 -10.269   9.585  -2.006
  Start of MODEL    4
 2771    HA   ARG  91           HA       ARG  91  -9.478  11.389  -3.949
  Start of MODEL    4
 2772    HB2  ARG  91           HB2      ARG  91  -9.208  11.728  -0.956
  Start of MODEL    4
 2773    HB3  ARG  91           HB3      ARG  91  -9.200  13.026  -2.146
  Start of MODEL    4
 2774    HG2  ARG  91           HG2      ARG  91 -11.508  12.255  -2.815
  Start of MODEL    4
 2775    HG3  ARG  91           HG3      ARG  91 -11.466  11.225  -1.380
  Start of MODEL    4
 2776    HD2  ARG  91           HD2      ARG  91 -11.044  13.251  -0.019
  Start of MODEL    4
 2777    HD3  ARG  91           HD3      ARG  91 -11.290  14.230  -1.463
  Start of MODEL    4
 2778    HE   ARG  91           HE       ARG  91 -13.490  12.479  -1.055
  Start of MODEL    4
 2779   HH11  ARG  91          HH11      ARG  91 -12.102  15.469   0.124
  Start of MODEL    4
 2780   HH12  ARG  91          HH12      ARG  91 -13.611  16.079   0.737
  Start of MODEL    4
 2781   HH21  ARG  91          HH21      ARG  91 -15.493  13.278  -0.257
  Start of MODEL    4
 2782   HH22  ARG  91          HH22      ARG  91 -15.545  14.854   0.490
  Start of MODEL    4
 2783    H    ALA  92           H        ALA  92  -7.690   9.611  -1.527
  Start of MODEL    4
 2784    HA   ALA  92           HA       ALA  92  -5.116  10.590  -2.087
  Start of MODEL    4
 2785    HB1  ALA  92           HB1      ALA  92  -5.913   7.843  -1.138
  Start of MODEL    4
 2786    HB3  ALA  92           HB2      ALA  92  -5.641   9.254  -0.111
  Start of MODEL    4
 2787    HB2  ALA  92           HB3      ALA  92  -4.305   8.550  -1.028
  Start of MODEL    4
 2788    H    CYS  93           H        CYS  93  -7.048   8.049  -3.653
  Start of MODEL    4
 2789    HA   CYS  93           HA       CYS  93  -4.827   7.145  -5.253
  Start of MODEL    4
 2790    HB2  CYS  93           HB2      CYS  93  -7.777   6.523  -5.471
  Start of MODEL    4
 2791    HB3  CYS  93           HB3      CYS  93  -6.493   5.691  -6.339
  Start of MODEL    4
 2792    HG   CYS  93           HG       CYS  93  -7.036   5.639  -2.960
  Start of MODEL    4
 2793    H    LYS  94           H        LYS  94  -6.972   9.757  -5.469
  Start of MODEL    4
 2794    HA   LYS  94           HA       LYS  94  -7.263   9.813  -8.302
  Start of MODEL    4
 2795    HB2  LYS  94           HB2      LYS  94  -8.771  11.019  -6.708
  Start of MODEL    4
 2796    HB3  LYS  94           HB3      LYS  94  -7.466  12.162  -6.420
  Start of MODEL    4
 2797    HG2  LYS  94           HG2      LYS  94  -9.110  12.989  -8.050
  Start of MODEL    4
 2798    HG3  LYS  94           HG3      LYS  94  -7.491  12.843  -8.737
  Start of MODEL    4
 2799    HD2  LYS  94           HD2      LYS  94  -8.168  10.608  -9.648
  Start of MODEL    4
 2800    HD3  LYS  94           HD3      LYS  94  -9.810  10.945  -9.103
  Start of MODEL    4
 2801    HE2  LYS  94           HE2      LYS  94  -9.585  11.457 -11.456
  Start of MODEL    4
 2802    HE3  LYS  94           HE3      LYS  94  -9.864  12.935 -10.538
  Start of MODEL    4
 2803    HZ2  LYS  94           HZ1      LYS  94  -8.100  13.024 -12.310
  Start of MODEL    4
 2804    HZ1  LYS  94           HZ2      LYS  94  -7.146  12.038 -11.322
  Start of MODEL    4
 2805    HZ3  LYS  94           HZ3      LYS  94  -7.631  13.572 -10.780
  Start of MODEL    4
 2806    H    ASP  95           H        ASP  95  -4.851  10.952  -6.070
  Start of MODEL    4
 2807    HA   ASP  95           HA       ASP  95  -3.244  11.874  -8.353
  Start of MODEL    4
 2808    HB2  ASP  95           HB2      ASP  95  -3.339  13.397  -6.378
  Start of MODEL    4
 2809    HB3  ASP  95           HB3      ASP  95  -2.641  12.118  -5.388
  Start of MODEL    4
 2810    HA   PRO  96           HA       PRO  96  -2.127   7.509  -7.773
  Start of MODEL    4
 2811    HB2  PRO  96           HB2      PRO  96  -1.234   7.086 -10.296
  Start of MODEL    4
 2812    HB3  PRO  96           HB3      PRO  96  -2.951   7.110  -9.880
  Start of MODEL    4
 2813    HG2  PRO  96           HG2      PRO  96  -1.263   9.266 -11.081
  Start of MODEL    4
 2814    HG3  PRO  96           HG3      PRO  96  -2.902   8.752 -11.522
  Start of MODEL    4
 2815    HD2  PRO  96           HD2      PRO  96  -2.415  10.936  -9.996
  Start of MODEL    4
 2816    HD3  PRO  96           HD3      PRO  96  -3.872   9.940  -9.804
  Start of MODEL    4
 2817    H    ASN  97           H        ASN  97  -0.158  10.202  -8.518
  Start of MODEL    4
 2818    HA   ASN  97           HA       ASN  97   2.279   8.611  -8.045
  Start of MODEL    4
 2819    HB2  ASN  97           HB2      ASN  97   1.818  10.722 -10.144
  Start of MODEL    4
 2820    HB3  ASN  97           HB3      ASN  97   3.432  10.333  -9.578
  Start of MODEL    4
 2821   HD21  ASN  97          HD21      ASN  97   1.164   7.741  -9.739
  Start of MODEL    4
 2822   HD22  ASN  97          HD22      ASN  97   1.787   7.012 -11.178
  Start of MODEL    4
 2823    HA   PRO  98           HA       PRO  98   2.005  12.442  -5.283
  Start of MODEL    4
 2824    HB2  PRO  98           HB2      PRO  98   2.075  10.662  -2.988
  Start of MODEL    4
 2825    HB3  PRO  98           HB3      PRO  98   0.863  11.872  -3.420
  Start of MODEL    4
 2826    HG2  PRO  98           HG2      PRO  98   0.384   9.196  -3.492
  Start of MODEL    4
 2827    HG3  PRO  98           HG3      PRO  98  -0.441  10.363  -4.541
  Start of MODEL    4
 2828    HD2  PRO  98           HD2      PRO  98   1.853   8.544  -5.166
  Start of MODEL    4
 2829    HD3  PRO  98           HD3      PRO  98   0.445   8.966  -6.165
  Start of MODEL    4
 2830    H    ILE  99           H        ILE  99   3.770  13.366  -4.352
  Start of MODEL    4
 2831    HA   ILE  99           HA       ILE  99   6.230  11.845  -4.420
  Start of MODEL    4
 2832    HB   ILE  99           HB       ILE  99   5.786  14.726  -3.618
  Start of MODEL    4
 2833   HD11  ILE  99          HD11      ILE  99   6.437  12.291  -6.398
  Start of MODEL    4
 2834   HD13  ILE  99          HD12      ILE  99   7.935  13.217  -6.327
  Start of MODEL    4
 2835   HD12  ILE  99          HD13      ILE  99   6.757  13.546  -7.595
  Start of MODEL    4
 2836    H    ILE 100           H        ILE 100   6.709  10.562  -2.785
  Start of MODEL    4
 2837    HA   ILE 100           HA       ILE 100   6.204  11.513  -0.039
  Start of MODEL    4
 2838    HB   ILE 100           HB       ILE 100   6.122   8.658  -1.046
  Start of MODEL    4
 2839   HD12  ILE 100          HD11      ILE 100   2.378   8.690  -0.589
  Start of MODEL    4
 2840   HD11  ILE 100          HD12      ILE 100   3.531   8.112   0.616
  Start of MODEL    4
 2841   HD13  ILE 100          HD13      ILE 100   3.720   7.656  -1.078
  Start of MODEL    4
 2842    H    ASP 101           H        ASP 101   8.019  11.920   0.991
  Start of MODEL    4
 2843    HA   ASP 101           HA       ASP 101  10.166  11.870   1.726
  Start of MODEL    4
 2844    HB2  ASP 101           HB2      ASP 101   9.449   9.483   2.237
  Start of MODEL    4
 2845    HB3  ASP 101           HB3      ASP 101  10.269   9.002   0.755
  Start of MODEL    4
 2846    H    GLY 102           H        GLY 102   9.641  12.792  -0.901
  Start of MODEL    4
 2847    HA2  GLY 102           HA2      GLY 102  10.974  13.703  -2.558
  Start of MODEL    4
 2848    HA3  GLY 102           HA3      GLY 102  12.326  12.783  -1.924
  Start of MODEL    4
 2849    H    ARG 103           H        ARG 103   9.908  10.594  -2.397
  Start of MODEL    4
 2850    HA   ARG 103           HA       ARG 103  10.854   9.995  -5.122
  Start of MODEL    4
 2851    HB2  ARG 103           HB2      ARG 103  11.595   8.381  -3.399
  Start of MODEL    4
 2852    HB3  ARG 103           HB3      ARG 103   9.913   8.080  -2.972
  Start of MODEL    4
 2853    HG2  ARG 103           HG2      ARG 103  10.557   6.293  -4.353
  Start of MODEL    4
 2854    HG3  ARG 103           HG3      ARG 103   9.573   7.349  -5.368
  Start of MODEL    4
 2855    HD2  ARG 103           HD2      ARG 103  11.710   8.370  -6.211
  Start of MODEL    4
 2856    HD3  ARG 103           HD3      ARG 103  12.583   7.108  -5.346
  Start of MODEL    4
 2857    HE   ARG 103           HE       ARG 103  10.563   6.096  -7.129
  Start of MODEL    4
 2858   HH11  ARG 103          HH11      ARG 103  13.914   7.107  -6.865
  Start of MODEL    4
 2859   HH12  ARG 103          HH12      ARG 103  14.407   6.293  -8.318
  Start of MODEL    4
 2860   HH21  ARG 103          HH21      ARG 103  11.208   5.023  -9.017
  Start of MODEL    4
 2861   HH22  ARG 103          HH22      ARG 103  12.864   5.094  -9.547
  Start of MODEL    4
 2862    H    LYS 104           H        LYS 104   9.349   9.698  -6.689
  Start of MODEL    4
 2863    HA   LYS 104           HA       LYS 104   6.593  10.237  -6.178
  Start of MODEL    4
 2864    HB2  LYS 104           HB2      LYS 104   7.560  10.805  -8.332
  Start of MODEL    4
 2865    HB3  LYS 104           HB3      LYS 104   8.007   9.129  -8.612
  Start of MODEL    4
 2866    HG2  LYS 104           HG2      LYS 104   5.630   8.520  -8.691
  Start of MODEL    4
 2867    HG3  LYS 104           HG3      LYS 104   5.200  10.216  -8.453
  Start of MODEL    4
 2868    HD2  LYS 104           HD2      LYS 104   6.895   9.229 -10.737
  Start of MODEL    4
 2869    HD3  LYS 104           HD3      LYS 104   5.143   9.411 -10.833
  Start of MODEL    4
 2870    HE2  LYS 104           HE2      LYS 104   7.050  11.639 -10.130
  Start of MODEL    4
 2871    HE3  LYS 104           HE3      LYS 104   6.427  11.344 -11.751
  Start of MODEL    4
 2872    HZ1  LYS 104           HZ1      LYS 104   4.692  11.854  -9.397
  Start of MODEL    4
 2873    HZ3  LYS 104           HZ2      LYS 104   4.226  11.809 -11.024
  Start of MODEL    4
 2874    HZ2  LYS 104           HZ3      LYS 104   5.209  13.068 -10.460
  Start of MODEL    4
 2875    H    ALA 105           H        ALA 105   5.160   8.871  -5.355
  Start of MODEL    4
 2876    HA   ALA 105           HA       ALA 105   5.751   5.999  -5.442
  Start of MODEL    4
 2877    HB1  ALA 105           HB1      ALA 105   5.617   7.023  -3.211
  Start of MODEL    4
 2878    HB3  ALA 105           HB2      ALA 105   4.374   5.796  -3.459
  Start of MODEL    4
 2879    HB2  ALA 105           HB3      ALA 105   3.956   7.506  -3.548
  Start of MODEL    4
 2880    H    ASN 106           H        ASN 106   3.921   4.550  -5.556
  Start of MODEL    4
 2881    HA   ASN 106           HA       ASN 106   1.939   5.517  -7.486
  Start of MODEL    4
 2882    HB2  ASN 106           HB2      ASN 106   3.134   2.788  -6.970
  Start of MODEL    4
 2883    HB3  ASN 106           HB3      ASN 106   1.672   2.995  -7.926
  Start of MODEL    4
 2884   HD21  ASN 106          HD21      ASN 106   2.733   2.101  -9.698
  Start of MODEL    4
 2885   HD22  ASN 106          HD22      ASN 106   3.856   3.017 -10.634
  Start of MODEL    4
 2886    H    VAL 107           H        VAL 107  -0.179   5.303  -7.081
  Start of MODEL    4
 2887    HA   VAL 107           HA       VAL 107  -0.957   4.040  -4.541
  Start of MODEL    4
 2888    HB   VAL 107           HB       VAL 107  -1.895   6.789  -5.371
  Start of MODEL    4
 2889    H    ASN 108           H        ASN 108  -2.627   2.740  -4.724
  Start of MODEL    4
 2890    HA   ASN 108           HA       ASN 108  -4.853   3.325  -6.425
  Start of MODEL    4
 2891    HB2  ASN 108           HB2      ASN 108  -4.759   1.268  -7.759
  Start of MODEL    4
 2892    HB3  ASN 108           HB3      ASN 108  -3.352   2.279  -8.080
  Start of MODEL    4
 2893   HD21  ASN 108          HD21      ASN 108  -4.500  -0.689  -6.681
  Start of MODEL    4
 2894   HD22  ASN 108          HD22      ASN 108  -2.949  -1.424  -6.474
  Start of MODEL    4
 2895    H    LEU 109           H        LEU 109  -6.696   2.197  -5.783
  Start of MODEL    4
 2896    HA   LEU 109           HA       LEU 109  -6.839   0.988  -3.294
  Start of MODEL    4
 2897    HB2  LEU 109           HB2      LEU 109  -8.595   0.478  -5.708
  Start of MODEL    4
 2898    HB3  LEU 109           HB3      LEU 109  -8.998   0.034  -4.061
  Start of MODEL    4
 2899    HG   LEU 109           HG       LEU 109  -8.632   2.861  -5.068
  Start of MODEL    4
 2900   HD12  LEU 109          HD11      LEU 109 -11.033   3.073  -4.763
  Start of MODEL    4
 2901   HD11  LEU 109          HD12      LEU 109 -11.138   1.381  -4.274
  Start of MODEL    4
 2902   HD13  LEU 109          HD13      LEU 109 -10.664   1.794  -5.923
  Start of MODEL    4
 2903   HD21  LEU 109          HD21      LEU 109  -7.980   2.631  -2.731
  Start of MODEL    4
 2904   HD23  LEU 109          HD22      LEU 109  -9.508   1.826  -2.371
  Start of MODEL    4
 2905   HD22  LEU 109          HD23      LEU 109  -9.499   3.516  -2.875
  Start of MODEL    4
 2906    H    ALA 110           H        ALA 110  -6.344  -0.989  -2.528
  Start of MODEL    4
 2907    HA   ALA 110           HA       ALA 110  -4.455  -2.482  -3.891
  Start of MODEL    4
 2908    HB2  ALA 110           HB1      ALA 110  -6.098  -3.354  -1.520
  Start of MODEL    4
 2909    HB1  ALA 110           HB2      ALA 110  -4.642  -2.357  -1.450
  Start of MODEL    4
 2910    HB3  ALA 110           HB3      ALA 110  -4.547  -4.026  -2.024
  Start of MODEL    4
 2911    H    TYR 111           H        TYR 111  -7.940  -3.019  -3.689
  Start of MODEL    4
 2912    HA   TYR 111           HA       TYR 111  -7.837  -5.712  -4.567
  Start of MODEL    4
 2913    HB2  TYR 111           HB2      TYR 111 -10.162  -5.692  -4.611
  Start of MODEL    4
 2914    HB3  TYR 111           HB3      TYR 111  -9.787  -4.466  -3.410
  Start of MODEL    4
 2915    HD1  TYR 111           HD1      TYR 111  -9.391  -2.017  -4.705
  Start of MODEL    4
 2916    HD2  TYR 111           HD2      TYR 111 -11.964  -5.179  -5.907
  Start of MODEL    4
 2917    HE1  TYR 111           HE1      TYR 111 -10.791  -0.405  -5.927
  Start of MODEL    4
 2918    HE2  TYR 111           HE2      TYR 111 -13.372  -3.583  -7.131
  Start of MODEL    4
 2919    HH   TYR 111           HH       TYR 111 -13.883  -1.201  -7.151
  Start of MODEL    4
 2920    H    LEU 112           H        LEU 112  -7.524  -2.743  -6.238
  Start of MODEL    4
 2921    HA   LEU 112           HA       LEU 112  -8.367  -3.608  -8.810
  Start of MODEL    4
 2922    HB2  LEU 112           HB2      LEU 112  -6.625  -1.325  -7.912
  Start of MODEL    4
 2923    HB3  LEU 112           HB3      LEU 112  -7.037  -1.603  -9.594
  Start of MODEL    4
 2924    HG   LEU 112           HG       LEU 112  -8.979  -0.998  -7.362
  Start of MODEL    4
 2925   HD13  LEU 112          HD11      LEU 112  -7.679   0.936  -8.084
  Start of MODEL    4
 2926   HD12  LEU 112          HD12      LEU 112  -9.361   1.080  -8.588
  Start of MODEL    4
 2927   HD11  LEU 112          HD13      LEU 112  -8.124   0.622  -9.758
  Start of MODEL    4
 2928   HD21  LEU 112          HD21      LEU 112  -9.902  -2.569  -8.965
  Start of MODEL    4
 2929   HD23  LEU 112          HD22      LEU 112  -9.453  -1.501 -10.294
  Start of MODEL    4
 2930   HD22  LEU 112          HD23      LEU 112 -10.673  -0.988  -9.126
  Start of MODEL    4
 2931    H    GLY 113           H        GLY 113  -5.717  -4.582  -7.024
  Start of MODEL    4
 2932    HA2  GLY 113           HA2      GLY 113  -4.368  -5.501  -9.443
  Start of MODEL    4
 2933    HA3  GLY 113           HA3      GLY 113  -3.424  -4.560  -8.290
  Start of MODEL    4
 2934    H    ALA 114           H        ALA 114  -5.888  -6.391  -6.895
  Start of MODEL    4
 2935    HA   ALA 114           HA       ALA 114  -3.991  -8.060  -5.507
  Start of MODEL    4
 2936    HB1  ALA 114           HB1      ALA 114  -7.005  -8.007  -5.353
  Start of MODEL    4
 2937    HB3  ALA 114           HB2      ALA 114  -5.906  -7.085  -4.330
  Start of MODEL    4
 2938    HB2  ALA 114           HB3      ALA 114  -5.918  -8.846  -4.246
  Start of MODEL    4
 2939    H    LYS 115           H        LYS 115  -3.932 -10.329  -5.568
  Start of MODEL    4
 2940    HA   LYS 115           HA       LYS 115  -4.485 -11.438  -8.159
  Start of MODEL    4
 2941    HB2  LYS 115           HB2      LYS 115  -3.404 -12.806  -5.686
  Start of MODEL    4
 2942    HB3  LYS 115           HB3      LYS 115  -3.400 -13.460  -7.318
  Start of MODEL    4
 2943    HG2  LYS 115           HG2      LYS 115  -1.917 -10.995  -6.436
  Start of MODEL    4
 2944    HG3  LYS 115           HG3      LYS 115  -1.212 -12.601  -6.623
  Start of MODEL    4
 2945    HD2  LYS 115           HD2      LYS 115  -1.854 -12.570  -9.004
  Start of MODEL    4
 2946    HD3  LYS 115           HD3      LYS 115  -2.472 -10.930  -8.794
  Start of MODEL    4
 2947    HE2  LYS 115           HE2      LYS 115  -0.239 -10.890  -9.750
  Start of MODEL    4
 2948    HE3  LYS 115           HE3      LYS 115  -0.246 -10.171  -8.140
  Start of MODEL    4
 2949    HZ1  LYS 115           HZ1      LYS 115   0.666 -12.917  -8.830
  Start of MODEL    4
 2950    HZ3  LYS 115           HZ2      LYS 115   0.613 -12.274  -7.260
  Start of MODEL    4
 2951    HZ2  LYS 115           HZ3      LYS 115   1.655 -11.605  -8.413
  Start of MODEL    4
 2952    HA   PRO 116           HA       PRO 116  -8.388 -13.323  -7.002
  Start of MODEL    4
 2953    HB2  PRO 116           HB2      PRO 116  -8.202 -14.799  -9.498
  Start of MODEL    4
 2954    HB3  PRO 116           HB3      PRO 116  -9.315 -13.500  -9.065
  Start of MODEL    4
 2955    HG2  PRO 116           HG2      PRO 116  -7.345 -13.220 -10.926
  Start of MODEL    4
 2956    HG3  PRO 116           HG3      PRO 116  -7.976 -11.876  -9.957
  Start of MODEL    4
 2957    HD2  PRO 116           HD2      PRO 116  -5.458 -13.459  -9.589
  Start of MODEL    4
 2958    HD3  PRO 116           HD3      PRO 116  -5.736 -11.713  -9.400
  Start of MODEL    4
 2959    H    ARG 117           H        ARG 117  -9.220 -15.639  -6.958
  Start of MODEL    4
 2960    HA   ARG 117           HA       ARG 117  -9.035 -17.778  -6.191
  Start of MODEL    4
 2961    HB2  ARG 117           HB2      ARG 117  -6.413 -17.696  -7.694
  Start of MODEL    4
 2962    HB3  ARG 117           HB3      ARG 117  -7.128 -19.151  -7.022
  Start of MODEL    4
 2963    HG2  ARG 117           HG2      ARG 117  -8.372 -17.429  -9.155
  Start of MODEL    4
 2964    HG3  ARG 117           HG3      ARG 117  -7.490 -18.931  -9.435
  Start of MODEL    4
 2965    HD2  ARG 117           HD2      ARG 117  -9.207 -19.972  -7.806
  Start of MODEL    4
 2966    HD3  ARG 117           HD3      ARG 117 -10.156 -18.518  -8.125
  Start of MODEL    4
 2967    HE   ARG 117           HE       ARG 117  -9.234 -19.838 -10.509
  Start of MODEL    4
 2968   HH11  ARG 117          HH11      ARG 117 -11.819 -19.708  -8.126
  Start of MODEL    4
 2969   HH12  ARG 117          HH12      ARG 117 -12.950 -20.531  -9.154
  Start of MODEL    4
 2970   HH21  ARG 117          HH21      ARG 117 -10.717 -20.923 -11.824
  Start of MODEL    4
 2971   HH22  ARG 117          HH22      ARG 117 -12.348 -21.169 -11.270
  Start of MODEL    4
 2972    H    THR 118           H        THR 118  -7.894 -15.501  -4.624
  Start of MODEL    4
 2973    HA   THR 118           HA       THR 118  -5.555 -16.554  -3.332
  Start of MODEL    4
 2974    HB   THR 118           HB       THR 118  -6.461 -14.516  -1.721
  Start of MODEL    4
 2975    HG1  THR 118           HG1      THR 118  -6.815 -13.286  -4.142
  Start of MODEL    4
 2976   HG21  THR 118          HG21      THR 118  -4.753 -14.307  -4.205
  Start of MODEL    4
 2977   HG23  THR 118          HG22      THR 118  -4.189 -14.799  -2.608
  Start of MODEL    4
 2978   HG22  THR 118          HG23      THR 118  -4.777 -13.156  -2.869
  Start of MODEL    4
 2979    H    ASN 119           H        ASN 119  -5.385 -17.199  -1.163
  Start of MODEL    4
 2980    HA   ASN 119           HA       ASN 119  -7.780 -18.540  -0.185
  Start of MODEL    4
 2981    HB2  ASN 119           HB2      ASN 119  -6.267 -19.790   1.254
  Start of MODEL    4
 2982    HB3  ASN 119           HB3      ASN 119  -5.656 -19.809  -0.399
  Start of MODEL    4
 2983   HD21  ASN 119          HD21      ASN 119  -5.060 -18.861   2.846
  Start of MODEL    4
 2984   HD22  ASN 119          HD22      ASN 119  -3.482 -18.203   2.589
  Start of MODEL    4
 2985    H    VAL 120           H        VAL 120  -7.995 -18.613   2.267
  Start of MODEL    4
 2986    HA   VAL 120           HA       VAL 120  -8.202 -15.870   3.188
  Start of MODEL    4
 2987    HB   VAL 120           HB       VAL 120  -9.030 -18.422   4.588
  Start of MODEL    4
 2988    H    GLN 121           H        GLN 121  -7.127 -15.008   4.949
  Start of MODEL    4
 2989    HA   GLN 121           HA       GLN 121  -4.917 -16.609   6.031
  Start of MODEL    4
 2990    HB2  GLN 121           HB2      GLN 121  -4.249 -14.506   4.940
  Start of MODEL    4
 2991    HB3  GLN 121           HB3      GLN 121  -5.304 -13.604   6.016
  Start of MODEL    4
 2992    HG2  GLN 121           HG2      GLN 121  -3.962 -14.253   7.927
  Start of MODEL    4
 2993    HG3  GLN 121           HG3      GLN 121  -2.932 -15.239   6.888
  Start of MODEL    4
 2994   HE21  GLN 121          HE21      GLN 121  -1.443 -14.253   5.564
  Start of MODEL    4
 2995   HE22  GLN 121          HE22      GLN 121  -0.996 -12.591   5.733
  Start of MODEL    4
 2996    H5'   DG   1           H5'       DG   1  16.857  -7.680  -4.408
  Start of MODEL    4
 2997    H4'   DG   1           H4'       DG   1  14.589  -6.619  -4.972
  Start of MODEL    4
 2998    H3'   DG   1           H3'       DG   1  15.874  -4.890  -6.589
  Start of MODEL    4
 2999    H2'   DG   1           H2'       DG   1  17.228  -3.761  -4.978
  Start of MODEL    4
 3000    H1'   DG   1           H1'       DG   1  14.966  -3.846  -2.941
  Start of MODEL    4
 3001    H8    DG   1           H8        DG   1  18.706  -4.720  -3.458
  Start of MODEL    4
 3002    H1    DG   1           H1        DG   1  17.186  -2.045   2.176
  Start of MODEL    4
 3003    H22   DG   1           H21       DG   1  13.928  -2.170   1.013
  Start of MODEL    4
 3004    H21   DG   1           H22       DG   1  15.019  -1.713   2.302
  Start of MODEL    4
 3005   HO5'   DG   1           H5T       DG   1  17.621  -5.298  -5.381
  Start of MODEL    4
 3006   H5''   DG   1          5H''       DG   1  16.364  -7.538  -6.103
  Start of MODEL    4
 3007   H2''   DG   1          2H''       DG   1  15.786  -2.764  -4.899
  Start of MODEL    4
 3008    H5'   DG   2           H5'       DG   2  14.458  -3.257  -9.714
  Start of MODEL    4
 3009    H4'   DG   2           H4'       DG   2  12.398  -2.333  -9.754
  Start of MODEL    4
 3010    H3'   DG   2           H3'       DG   2  14.052  -0.817 -11.197
  Start of MODEL    4
 3011    H2'   DG   2           H2'       DG   2  14.716   0.668  -9.387
  Start of MODEL    4
 3012    H1'   DG   2           H1'       DG   2  11.743   0.843  -8.673
  Start of MODEL    4
 3013    H8    DG   2           H8        DG   2  15.015   2.159  -7.788
  Start of MODEL    4
 3014    H1    DG   2           H1        DG   2  11.319   1.273  -2.612
  Start of MODEL    4
 3015    H22   DG   2           H21       DG   2   9.362  -0.629  -4.773
  Start of MODEL    4
 3016    H21   DG   2           H22       DG   2   9.576   0.008  -3.160
  Start of MODEL    4
 3017   H5''   DG   2          5H''       DG   2  15.257  -1.742  -9.247
  Start of MODEL    4
 3018   H2''   DG   2          2H''       DG   2  13.472   1.594 -10.218
  Start of MODEL    4
 3019    H5'   DT   3           H5'       DT   3  10.478  -3.161  -9.968
  Start of MODEL    4
 3020    H4'   DT   3           H4'       DT   3   8.289  -4.131  -9.817
  Start of MODEL    4
 3021    H3'   DT   3           H3'       DT   3   7.733  -3.660 -12.390
  Start of MODEL    4
 3022    H2'   DT   3           H2'       DT   3   7.743  -1.225 -12.197
  Start of MODEL    4
 3023    H1'   DT   3           H1'       DT   3   6.040  -1.680  -9.683
  Start of MODEL    4
 3024    H3    DT   3           H3        DT   3   5.715   2.932 -10.562
  Start of MODEL    4
 3025    H72   DT   3           H71       DT   3   9.785   1.596  -7.350
  Start of MODEL    4
 3026    H71   DT   3           H72       DT   3   9.169   3.256  -7.505
  Start of MODEL    4
 3027    H73   DT   3           H73       DT   3  10.331   2.625  -8.694
  Start of MODEL    4
 3028    H6    DT   3           H6        DT   3   8.882  -0.145  -8.766
  Start of MODEL    4
 3029   H5''   DT   3          5H''       DT   3  10.027  -3.894 -11.520
  Start of MODEL    4
 3030   H2''   DT   3          2H''       DT   3   6.028  -1.627 -12.135
  Start of MODEL    4
 3031    H5'   DG   4           H5'       DG   4   7.331  -5.512  -8.923
  Start of MODEL    4
 3032    H4'   DG   4           H4'       DG   4   6.293  -5.190  -6.726
  Start of MODEL    4
 3033    H3'   DG   4           H3'       DG   4   3.951  -6.444  -7.913
  Start of MODEL    4
 3034    H2'   DG   4           H2'       DG   4   2.706  -4.484  -8.120
  Start of MODEL    4
 3035    H1'   DG   4           H1'       DG   4   4.735  -2.979  -6.404
  Start of MODEL    4
 3036    H8    DG   4           H8        DG   4   4.078  -0.561  -6.600
  Start of MODEL    4
 3037    H1    DG   4           H1        DG   4   1.977  -1.295 -12.618
  Start of MODEL    4
 3038    H22   DG   4           H21       DG   4   2.881  -4.613 -12.208
  Start of MODEL    4
 3039    H21   DG   4           H22       DG   4   2.203  -3.384 -13.254
  Start of MODEL    4
 3040   H5''   DG   4          5H''       DG   4   6.567  -6.980  -8.281
  Start of MODEL    4
 3041   H2''   DG   4          2H''       DG   4   2.791  -4.356  -6.368
  Start of MODEL    4
 3042    H5'   DT   5           H5'       DT   5   3.410  -9.266  -2.933
  Start of MODEL    4
 3043    H4'   DT   5           H4'       DT   5   2.392  -8.013  -1.331
  Start of MODEL    4
 3044    H3'   DT   5           H3'       DT   5   0.869 -10.094  -2.101
  Start of MODEL    4
 3045    H2'   DT   5           H2'       DT   5  -0.505  -8.898  -3.681
  Start of MODEL    4
 3046    H1'   DT   5           H1'       DT   5  -0.648  -6.645  -1.618
  Start of MODEL    4
 3047    H3    DT   5           H3        DT   5  -3.365  -4.287  -4.280
  Start of MODEL    4
 3048    H71   DT   5           H71       DT   5  -0.638  -5.049  -7.952
  Start of MODEL    4
 3049    H72   DT   5           H72       DT   5   0.675  -4.190  -7.114
  Start of MODEL    4
 3050    H73   DT   5           H73       DT   5   0.743  -5.958  -7.296
  Start of MODEL    4
 3051    H6    DT   5           H6        DT   5   0.737  -6.598  -4.990
  Start of MODEL    4
 3052   H5''   DT   5          5H''       DT   5   2.032  -9.173  -4.048
  Start of MODEL    4
 3053   H2''   DT   5          2H''       DT   5  -1.494  -8.833  -2.229
  Start of MODEL    4
 3054    H5'   DG   6           H5'       DG   6   2.681  -7.705   2.182
  Start of MODEL    4
 3055    H4'   DG   6           H4'       DG   6   3.086  -8.382   4.577
  Start of MODEL    4
 3056    H3'   DG   6           H3'       DG   6   1.341 -10.446   4.235
  Start of MODEL    4
 3057    H2'   DG   6           H2'       DG   6  -0.676  -9.193   4.036
  Start of MODEL    4
 3058    H1'   DG   6           H1'       DG   6   0.361  -7.179   6.079
  Start of MODEL    4
 3059    H8    DG   6           H8        DG   6  -1.319  -7.591   2.621
  Start of MODEL    4
 3060    H1    DG   6           H1        DG   6  -3.452  -2.717   6.220
  Start of MODEL    4
 3061    H22   DG   6           H21       DG   6  -0.935  -3.656   8.414
  Start of MODEL    4
 3062    H21   DG   6           H22       DG   6  -2.257  -2.564   8.063
  Start of MODEL    4
 3063   H5''   DG   6          5H''       DG   6   3.107  -9.396   2.506
  Start of MODEL    4
 3064   H2''   DG   6          2H''       DG   6  -0.612  -9.339   5.784
  Start of MODEL    4
 3065    H5'   DC   7           H5'       DC   7   3.039 -12.349   5.718
  Start of MODEL    4
 3066    H4'   DC   7           H4'       DC   7   2.505 -14.249   7.005
  Start of MODEL    4
 3067    H3'   DC   7           H3'       DC   7   3.892 -14.642   4.751
  Start of MODEL    4
 3068   HO3'   DC   7           H3T       DC   7   2.937 -16.422   6.715
  Start of MODEL    4
 3069    H2'   DC   7           H2'       DC   7   2.099 -15.194   3.274
  Start of MODEL    4
 3070    H1'   DC   7           H1'       DC   7   0.755 -16.847   5.452
  Start of MODEL    4
 3071    H42   DC   7           H41       DC   7  -3.845 -14.606   1.219
  Start of MODEL    4
 3072    H41   DC   7           H42       DC   7  -4.392 -16.147   1.837
  Start of MODEL    4
 3073    H5    DC   7           H5        DC   7  -1.736 -13.595   1.889
  Start of MODEL    4
 3074    H6    DC   7           H6        DC   7   0.254 -13.871   3.263
  Start of MODEL    4
 3075   H5''   DC   7          5H''       DC   7   1.963 -12.846   4.397
  Start of MODEL    4
 3076   H2''   DC   7          2H''       DC   7   2.522 -16.799   3.857
  Start of MODEL    5
 3077    H1   GLY  25           HT1      GLY  25 -10.568  -8.509  -9.709
  Start of MODEL    5
 3078    H2   GLY  25           HT2      GLY  25 -11.051  -9.437 -11.049
  Start of MODEL    5
 3079    H3   GLY  25           HT3      GLY  25  -9.758  -8.349 -11.189
  Start of MODEL    5
 3080    HA3  GLY  25           HA2      GLY  25  -8.357  -9.638  -9.844
  Start of MODEL    5
 3081    HA2  GLY  25           HA3      GLY  25  -9.094 -10.724 -11.012
  Start of MODEL    5
 3082    H    ALA  26           H        ALA  26  -9.266 -12.619  -9.989
  Start of MODEL    5
 3083    HA   ALA  26           HA       ALA  26  -9.403 -14.177  -8.352
  Start of MODEL    5
 3084    HB3  ALA  26           HB1      ALA  26  -8.128 -12.663  -6.942
  Start of MODEL    5
 3085    HB2  ALA  26           HB2      ALA  26  -9.326 -13.558  -6.003
  Start of MODEL    5
 3086    HB1  ALA  26           HB3      ALA  26  -9.620 -11.872  -6.431
  Start of MODEL    5
 3087    H    MET  27           H        MET  27 -11.745 -11.557  -7.792
  Start of MODEL    5
 3088    HA   MET  27           HA       MET  27 -14.009 -11.568  -7.508
  Start of MODEL    5
 3089    HB2  MET  27           HB2      MET  27 -13.751 -14.546  -7.874
  Start of MODEL    5
 3090    HB3  MET  27           HB3      MET  27 -15.269 -13.785  -7.430
  Start of MODEL    5
 3091    HG2  MET  27           HG2      MET  27 -15.172 -12.454  -9.499
  Start of MODEL    5
 3092    HG3  MET  27           HG3      MET  27 -13.686 -13.297  -9.941
  Start of MODEL    5
 3093    HE1  MET  27           HE1      MET  27 -14.897 -13.937 -12.281
  Start of MODEL    5
 3094    HE3  MET  27           HE2      MET  27 -16.368 -13.127 -11.743
  Start of MODEL    5
 3095    HE2  MET  27           HE3      MET  27 -16.445 -14.777 -12.364
  Start of MODEL    5
 3096    H    GLY  28           H        GLY  28 -15.615 -12.205  -5.799
  Start of MODEL    5
 3097    HA2  GLY  28           HA2      GLY  28 -15.759 -13.398  -3.590
  Start of MODEL    5
 3098    HA3  GLY  28           HA3      GLY  28 -14.159 -12.731  -3.283
  Start of MODEL    5
 3099    H    SER  29           H        SER  29 -15.285 -11.837  -1.348
  Start of MODEL    5
 3100    HA   SER  29           HA       SER  29 -16.050  -9.115  -1.871
  Start of MODEL    5
 3101    HB2  SER  29           HB2      SER  29 -18.214 -10.269  -2.130
  Start of MODEL    5
 3102    HB3  SER  29           HB3      SER  29 -18.026 -10.967  -0.521
  Start of MODEL    5
 3103    HG   SER  29           HG       SER  29 -19.232  -9.193  -0.187
  Start of MODEL    5
 3104    H    ARG  30           H        ARG  30 -15.193  -7.886  -0.362
  Start of MODEL    5
 3105    HA   ARG  30           HA       ARG  30 -15.170  -8.648   2.424
  Start of MODEL    5
 3106    HB2  ARG  30           HB2      ARG  30 -12.669  -8.491   0.796
  Start of MODEL    5
 3107    HB3  ARG  30           HB3      ARG  30 -12.636  -7.900   2.451
  Start of MODEL    5
 3108    HG2  ARG  30           HG2      ARG  30 -13.546 -10.667   1.681
  Start of MODEL    5
 3109    HG3  ARG  30           HG3      ARG  30 -11.903 -10.268   2.183
  Start of MODEL    5
 3110    HD2  ARG  30           HD2      ARG  30 -12.615  -9.639   4.353
  Start of MODEL    5
 3111    HD3  ARG  30           HD3      ARG  30 -14.309  -9.625   3.871
  Start of MODEL    5
 3112    HE   ARG  30           HE       ARG  30 -14.283 -12.009   3.871
  Start of MODEL    5
 3113   HH11  ARG  30          HH11      ARG  30 -11.352 -10.558   5.127
  Start of MODEL    5
 3114   HH12  ARG  30          HH12      ARG  30 -10.911 -11.962   6.063
  Start of MODEL    5
 3115   HH21  ARG  30          HH21      ARG  30 -13.714 -13.841   5.093
  Start of MODEL    5
 3116   HH22  ARG  30          HH22      ARG  30 -12.239 -13.846   6.016
  Start of MODEL    5
 3117    H    ASP  31           H        ASP  31 -15.023  -6.919   3.800
  Start of MODEL    5
 3118    HA   ASP  31           HA       ASP  31 -16.058  -4.481   2.830
  Start of MODEL    5
 3119    HB2  ASP  31           HB2      ASP  31 -16.397  -5.438   5.123
  Start of MODEL    5
 3120    HB3  ASP  31           HB3      ASP  31 -14.736  -4.998   5.505
  Start of MODEL    5
 3121    H    THR  32           H        THR  32 -12.949  -5.631   2.749
  Start of MODEL    5
 3122    HA   THR  32           HA       THR  32 -11.617  -3.058   3.100
  Start of MODEL    5
 3123    HB   THR  32           HB       THR  32  -9.768  -5.059   2.382
  Start of MODEL    5
 3124    HG1  THR  32           HG1      THR  32 -11.529  -5.985   4.436
  Start of MODEL    5
 3125   HG21  THR  32          HG21      THR  32 -10.541  -4.022   5.105
  Start of MODEL    5
 3126   HG23  THR  32          HG22      THR  32  -9.409  -3.246   3.993
  Start of MODEL    5
 3127   HG22  THR  32          HG23      THR  32  -9.024  -4.821   4.691
  Start of MODEL    5
 3128    H    MET  33           H        MET  33 -13.140  -4.622   0.652
  Start of MODEL    5
 3129    HA   MET  33           HA       MET  33 -11.426  -4.772  -1.484
  Start of MODEL    5
 3130    HB2  MET  33           HB2      MET  33 -13.930  -5.354  -1.276
  Start of MODEL    5
 3131    HB3  MET  33           HB3      MET  33 -14.210  -3.711  -1.808
  Start of MODEL    5
 3132    HG2  MET  33           HG2      MET  33 -13.022  -4.138  -3.867
  Start of MODEL    5
 3133    HG3  MET  33           HG3      MET  33 -12.634  -5.772  -3.327
  Start of MODEL    5
 3134    HE2  MET  33           HE1      MET  33 -15.194  -6.572  -6.128
  Start of MODEL    5
 3135    HE1  MET  33           HE2      MET  33 -13.627  -6.972  -5.420
  Start of MODEL    5
 3136    HE3  MET  33           HE3      MET  33 -13.898  -5.376  -6.124
  Start of MODEL    5
 3137    H    PHE  34           H        PHE  34 -13.307  -1.868  -0.502
  Start of MODEL    5
 3138    HA   PHE  34           HA       PHE  34 -11.840  -0.367  -2.560
  Start of MODEL    5
 3139    HB2  PHE  34           HB2      PHE  34 -14.509   0.065  -1.228
  Start of MODEL    5
 3140    HB3  PHE  34           HB3      PHE  34 -13.699   1.351  -2.112
  Start of MODEL    5
 3141    HD1  PHE  34           HD1      PHE  34 -15.041  -2.085  -2.473
  Start of MODEL    5
 3142    HD2  PHE  34           HD2      PHE  34 -13.905   1.524  -4.411
  Start of MODEL    5
 3143    HE1  PHE  34           HE1      PHE  34 -16.033  -2.903  -4.571
  Start of MODEL    5
 3144    HE2  PHE  34           HE2      PHE  34 -14.888   0.716  -6.513
  Start of MODEL    5
 3145    HZ   PHE  34           HZ       PHE  34 -15.954  -1.507  -6.593
  Start of MODEL    5
 3146    H    THR  35           H        THR  35 -11.581  -0.998   0.621
  Start of MODEL    5
 3147    HA   THR  35           HA       THR  35 -10.947   1.772   1.374
  Start of MODEL    5
 3148    HB   THR  35           HB       THR  35 -10.980   0.765   3.747
  Start of MODEL    5
 3149    HG1  THR  35           HG1      THR  35 -12.661  -1.123   3.508
  Start of MODEL    5
 3150   HG21  THR  35          HG21      THR  35 -13.532   0.868   2.130
  Start of MODEL    5
 3151   HG23  THR  35          HG22      THR  35 -12.733   2.244   2.885
  Start of MODEL    5
 3152   HG22  THR  35          HG23      THR  35 -13.422   0.969   3.886
  Start of MODEL    5
 3153    H    LYS  36           H        LYS  36  -9.572  -1.270   0.698
  Start of MODEL    5
 3154    HA   LYS  36           HA       LYS  36  -7.149  -0.776   2.208
  Start of MODEL    5
 3155    HB2  LYS  36           HB2      LYS  36  -8.041  -3.036   2.135
  Start of MODEL    5
 3156    HB3  LYS  36           HB3      LYS  36  -7.977  -3.039   0.383
  Start of MODEL    5
 3157    HG2  LYS  36           HG2      LYS  36  -5.540  -2.921   0.468
  Start of MODEL    5
 3158    HG3  LYS  36           HG3      LYS  36  -5.616  -2.903   2.236
  Start of MODEL    5
 3159    HD2  LYS  36           HD2      LYS  36  -6.610  -5.094   2.267
  Start of MODEL    5
 3160    HD3  LYS  36           HD3      LYS  36  -6.721  -5.111   0.506
  Start of MODEL    5
 3161    HE2  LYS  36           HE2      LYS  36  -4.348  -5.174   0.285
  Start of MODEL    5
 3162    HE3  LYS  36           HE3      LYS  36  -4.122  -4.903   2.013
  Start of MODEL    5
 3163    HZ1  LYS  36           HZ1      LYS  36  -5.427  -7.290   0.843
  Start of MODEL    5
 3164    HZ3  LYS  36           HZ2      LYS  36  -5.043  -7.044   2.477
  Start of MODEL    5
 3165    HZ2  LYS  36           HZ3      LYS  36  -3.810  -7.220   1.331
  Start of MODEL    5
 3166    H    ILE  37           H        ILE  37  -5.683   0.524   1.417
  Start of MODEL    5
 3167    HA   ILE  37           HA       ILE  37  -5.459   0.953  -1.477
  Start of MODEL    5
 3168    HB   ILE  37           HB       ILE  37  -4.375   2.547   0.855
  Start of MODEL    5
 3169   HD13  ILE  37          HD11      ILE  37  -5.560   4.845   1.131
  Start of MODEL    5
 3170   HD12  ILE  37          HD12      ILE  37  -6.952   5.192   0.105
  Start of MODEL    5
 3171   HD11  ILE  37          HD13      ILE  37  -5.329   5.187  -0.582
  Start of MODEL    5
 3172    H    PHE  38           H        PHE  38  -3.690   0.335  -2.588
  Start of MODEL    5
 3173    HA   PHE  38           HA       PHE  38  -1.424  -0.777  -1.087
  Start of MODEL    5
 3174    HB2  PHE  38           HB2      PHE  38  -2.322  -2.279  -2.776
  Start of MODEL    5
 3175    HB3  PHE  38           HB3      PHE  38  -2.186  -1.032  -4.009
  Start of MODEL    5
 3176    HD1  PHE  38           HD1      PHE  38  -0.368  -1.078  -5.405
  Start of MODEL    5
 3177    HD2  PHE  38           HD2      PHE  38  -0.048  -2.848  -1.549
  Start of MODEL    5
 3178    HE1  PHE  38           HE1      PHE  38   1.899  -1.855  -5.955
  Start of MODEL    5
 3179    HE2  PHE  38           HE2      PHE  38   2.222  -3.624  -2.090
  Start of MODEL    5
 3180    HZ   PHE  38           HZ       PHE  38   3.189  -3.162  -4.295
  Start of MODEL    5
 3181    H    VAL  39           H        VAL  39   0.361   0.407  -0.872
  Start of MODEL    5
 3182    HA   VAL  39           HA       VAL  39   0.695   2.732  -2.644
  Start of MODEL    5
 3183    HB   VAL  39           HB       VAL  39   2.146   2.295  -0.038
  Start of MODEL    5
 3184    H    GLY  40           H        GLY  40   2.384   2.806  -3.989
  Start of MODEL    5
 3185    HA2  GLY  40           HA2      GLY  40   4.415   0.666  -3.761
  Start of MODEL    5
 3186    HA3  GLY  40           HA3      GLY  40   3.589   0.963  -5.283
  Start of MODEL    5
 3187    H    GLY  41           H        GLY  41   6.413   1.068  -4.849
  Start of MODEL    5
 3188    HA2  GLY  41           HA2      GLY  41   8.018   2.386  -5.917
  Start of MODEL    5
 3189    HA3  GLY  41           HA3      GLY  41   6.846   3.688  -6.022
  Start of MODEL    5
 3190    H    LEU  42           H        LEU  42   6.917   2.480  -2.928
  Start of MODEL    5
 3191    HA   LEU  42           HA       LEU  42   7.904   4.899  -1.839
  Start of MODEL    5
 3192    HB2  LEU  42           HB2      LEU  42   7.320   2.218  -0.591
  Start of MODEL    5
 3193    HB3  LEU  42           HB3      LEU  42   7.757   3.641   0.331
  Start of MODEL    5
 3194    HG   LEU  42           HG       LEU  42   5.307   3.386  -1.413
  Start of MODEL    5
 3195   HD13  LEU  42          HD11      LEU  42   5.197   1.955   0.560
  Start of MODEL    5
 3196   HD12  LEU  42          HD12      LEU  42   4.079   3.313   0.688
  Start of MODEL    5
 3197   HD11  LEU  42          HD13      LEU  42   5.597   3.332   1.587
  Start of MODEL    5
 3198   HD23  LEU  42          HD21      LEU  42   6.208   5.557   0.475
  Start of MODEL    5
 3199   HD22  LEU  42          HD22      LEU  42   4.630   5.484  -0.309
  Start of MODEL    5
 3200   HD21  LEU  42          HD23      LEU  42   6.091   5.673  -1.279
  Start of MODEL    5
 3201    HA   PRO  43           HA       PRO  43  12.311   3.979  -1.723
  Start of MODEL    5
 3202    HB2  PRO  43           HB2      PRO  43  12.757   5.854   0.303
  Start of MODEL    5
 3203    HB3  PRO  43           HB3      PRO  43  12.881   6.164  -1.430
  Start of MODEL    5
 3204    HG2  PRO  43           HG2      PRO  43  10.682   6.806   0.460
  Start of MODEL    5
 3205    HG3  PRO  43           HG3      PRO  43  11.207   7.676  -0.992
  Start of MODEL    5
 3206    HD2  PRO  43           HD2      PRO  43   8.964   6.148  -0.900
  Start of MODEL    5
 3207    HD3  PRO  43           HD3      PRO  43   9.917   6.373  -2.381
  Start of MODEL    5
 3208    H    TYR  44           H        TYR  44  13.539   2.767  -0.291
  Start of MODEL    5
 3209    HA   TYR  44           HA       TYR  44  12.057   1.084   1.382
  Start of MODEL    5
 3210    HB2  TYR  44           HB2      TYR  44  15.044   1.455   1.173
  Start of MODEL    5
 3211    HB3  TYR  44           HB3      TYR  44  14.273   0.165   2.087
  Start of MODEL    5
 3212    HD1  TYR  44           HD1      TYR  44  12.200  -0.866   0.423
  Start of MODEL    5
 3213    HD2  TYR  44           HD2      TYR  44  16.020   0.609  -0.739
  Start of MODEL    5
 3214    HE1  TYR  44           HE1      TYR  44  12.112  -2.262  -1.599
  Start of MODEL    5
 3215    HE2  TYR  44           HE2      TYR  44  15.946  -0.787  -2.765
  Start of MODEL    5
 3216    HH   TYR  44           HH       TYR  44  13.162  -2.238  -3.905
  Start of MODEL    5
 3217    H    HIS  45           H        HIS  45  13.815   4.001   2.111
  Start of MODEL    5
 3218    HA   HIS  45           HA       HIS  45  13.867   3.469   4.932
  Start of MODEL    5
 3219    HB2  HIS  45           HB2      HIS  45  15.042   5.484   5.212
  Start of MODEL    5
 3220    HB3  HIS  45           HB3      HIS  45  15.594   4.837   3.677
  Start of MODEL    5
 3221    HD1  HIS  45           HD1      HIS  45  14.618   7.880   5.183
  Start of MODEL    5
 3222    HD2  HIS  45           HD2      HIS  45  14.025   6.181   1.436
  Start of MODEL    5
 3223    HE1  HIS  45           HE1      HIS  45  14.070   9.796   3.647
  Start of MODEL    5
 3224    HE2  HIS  45           HE2      HIS  45  13.409   8.692   1.493
  Start of MODEL    5
 3225    H    THR  46           H        THR  46  11.396   4.680   2.891
  Start of MODEL    5
 3226    HA   THR  46           HA       THR  46  10.001   6.395   4.531
  Start of MODEL    5
 3227    HB   THR  46           HB       THR  46   8.825   4.185   2.828
  Start of MODEL    5
 3228    HG1  THR  46           HG1      THR  46  10.095   6.594   2.240
  Start of MODEL    5
 3229   HG21  THR  46          HG21      THR  46   7.656   6.835   3.704
  Start of MODEL    5
 3230   HG23  THR  46          HG22      THR  46   7.185   5.251   4.321
  Start of MODEL    5
 3231   HG22  THR  46          HG23      THR  46   6.883   5.668   2.632
  Start of MODEL    5
 3232    H    SER  47           H        SER  47   8.641   6.189   6.308
  Start of MODEL    5
 3233    HA   SER  47           HA       SER  47   8.732   3.559   7.599
  Start of MODEL    5
 3234    HB2  SER  47           HB2      SER  47   8.530   4.800   9.725
  Start of MODEL    5
 3235    HB3  SER  47           HB3      SER  47   9.944   5.318   8.806
  Start of MODEL    5
 3236    HG   SER  47           HG       SER  47   8.578   7.080   8.025
  Start of MODEL    5
 3237    H    ASP  48           H        ASP  48   6.919   2.969   8.919
  Start of MODEL    5
 3238    HA   ASP  48           HA       ASP  48   4.415   3.090   7.787
  Start of MODEL    5
 3239    HB2  ASP  48           HB2      ASP  48   4.902   2.863  10.763
  Start of MODEL    5
 3240    HB3  ASP  48           HB3      ASP  48   3.520   2.243   9.868
  Start of MODEL    5
 3241    H    LYS  49           H        LYS  49   5.871   5.316  10.074
  Start of MODEL    5
 3242    HA   LYS  49           HA       LYS  49   3.514   6.766  10.677
  Start of MODEL    5
 3243    HB2  LYS  49           HB2      LYS  49   5.635   6.854  12.010
  Start of MODEL    5
 3244    HB3  LYS  49           HB3      LYS  49   6.345   7.819  10.722
  Start of MODEL    5
 3245    HG2  LYS  49           HG2      LYS  49   4.463   9.459  11.063
  Start of MODEL    5
 3246    HG3  LYS  49           HG3      LYS  49   4.040   8.548  12.511
  Start of MODEL    5
 3247    HD2  LYS  49           HD2      LYS  49   5.408  10.300  13.273
  Start of MODEL    5
 3248    HD3  LYS  49           HD3      LYS  49   6.448   8.878  13.242
  Start of MODEL    5
 3249    HE2  LYS  49           HE2      LYS  49   7.658  10.743  12.339
  Start of MODEL    5
 3250    HE3  LYS  49           HE3      LYS  49   7.303   9.610  11.035
  Start of MODEL    5
 3251    HZ2  LYS  49           HZ1      LYS  49   6.905  12.125  10.691
  Start of MODEL    5
 3252    HZ1  LYS  49           HZ2      LYS  49   5.473  11.855  11.556
  Start of MODEL    5
 3253    HZ3  LYS  49           HZ3      LYS  49   5.754  11.025  10.104
  Start of MODEL    5
 3254    H    THR  50           H        THR  50   5.944   7.059   8.144
  Start of MODEL    5
 3255    HA   THR  50           HA       THR  50   5.110   9.568   7.152
  Start of MODEL    5
 3256    HB   THR  50           HB       THR  50   6.378   7.334   5.540
  Start of MODEL    5
 3257    HG1  THR  50           HG1      THR  50   7.830   9.399   6.812
  Start of MODEL    5
 3258   HG23  THR  50          HG21      THR  50   5.545   9.228   4.209
  Start of MODEL    5
 3259   HG22  THR  50          HG22      THR  50   7.307   9.150   4.196
  Start of MODEL    5
 3260   HG21  THR  50          HG23      THR  50   6.485  10.337   5.209
  Start of MODEL    5
 3261    H    LEU  51           H        LEU  51   4.082   6.256   6.405
  Start of MODEL    5
 3262    HA   LEU  51           HA       LEU  51   2.348   7.080   4.260
  Start of MODEL    5
 3263    HB2  LEU  51           HB2      LEU  51   2.427   4.544   5.890
  Start of MODEL    5
 3264    HB3  LEU  51           HB3      LEU  51   1.271   4.822   4.600
  Start of MODEL    5
 3265    HG   LEU  51           HG       LEU  51   4.262   4.570   4.359
  Start of MODEL    5
 3266   HD12  LEU  51          HD11      LEU  51   3.685   2.725   2.865
  Start of MODEL    5
 3267   HD11  LEU  51          HD12      LEU  51   1.970   3.022   3.158
  Start of MODEL    5
 3268   HD13  LEU  51          HD13      LEU  51   3.012   2.481   4.475
  Start of MODEL    5
 3269   HD21  LEU  51          HD21      LEU  51   3.518   6.410   2.934
  Start of MODEL    5
 3270   HD23  LEU  51          HD22      LEU  51   2.277   5.369   2.232
  Start of MODEL    5
 3271   HD22  LEU  51          HD23      LEU  51   3.983   5.008   1.970
  Start of MODEL    5
 3272    H    HIS  52           H        HIS  52   1.888   6.285   7.662
  Start of MODEL    5
 3273    HA   HIS  52           HA       HIS  52  -0.819   6.779   7.922
  Start of MODEL    5
 3274    HB2  HIS  52           HB2      HIS  52   0.821   5.977   9.702
  Start of MODEL    5
 3275    HB3  HIS  52           HB3      HIS  52   1.246   7.664   9.948
  Start of MODEL    5
 3276    HD1  HIS  52           HD1      HIS  52  -0.901   9.239  10.717
  Start of MODEL    5
 3277    HD2  HIS  52           HD2      HIS  52  -1.247   5.115  11.198
  Start of MODEL    5
 3278    HE1  HIS  52           HE1      HIS  52  -2.731   8.894  12.402
  Start of MODEL    5
 3279    HE2  HIS  52           HE2      HIS  52  -2.742   6.416  12.852
  Start of MODEL    5
 3280    H    GLU  53           H        GLU  53   1.797   9.156   8.464
  Start of MODEL    5
 3281    HA   GLU  53           HA       GLU  53   0.177  11.310   8.959
  Start of MODEL    5
 3282    HB2  GLU  53           HB2      GLU  53   2.100  12.634   8.873
  Start of MODEL    5
 3283    HB3  GLU  53           HB3      GLU  53   2.668  11.035   9.328
  Start of MODEL    5
 3284    HG2  GLU  53           HG2      GLU  53   3.315  10.613   7.019
  Start of MODEL    5
 3285    HG3  GLU  53           HG3      GLU  53   2.857  12.263   6.604
  Start of MODEL    5
 3286    H    TYR  54           H        TYR  54   1.482  10.257   5.879
  Start of MODEL    5
 3287    HA   TYR  54           HA       TYR  54   0.689  12.584   4.461
  Start of MODEL    5
 3288    HB2  TYR  54           HB2      TYR  54   2.388  10.648   3.860
  Start of MODEL    5
 3289    HB3  TYR  54           HB3      TYR  54   0.980   9.966   3.052
  Start of MODEL    5
 3290    HD1  TYR  54           HD1      TYR  54  -0.071  11.175   1.184
  Start of MODEL    5
 3291    HD2  TYR  54           HD2      TYR  54   3.545  12.558   2.946
  Start of MODEL    5
 3292    HE1  TYR  54           HE1      TYR  54   0.324  12.602  -0.774
  Start of MODEL    5
 3293    HE2  TYR  54           HE2      TYR  54   3.955  13.993   0.986
  Start of MODEL    5
 3294    HH   TYR  54           HH       TYR  54   1.587  14.694  -1.301
  Start of MODEL    5
 3295    H    PHE  55           H        PHE  55  -0.698   9.301   4.534
  Start of MODEL    5
 3296    HA   PHE  55           HA       PHE  55  -2.939  10.046   2.957
  Start of MODEL    5
 3297    HB2  PHE  55           HB2      PHE  55  -2.307   7.553   4.516
  Start of MODEL    5
 3298    HB3  PHE  55           HB3      PHE  55  -3.778   7.746   3.563
  Start of MODEL    5
 3299    HD1  PHE  55           HD1      PHE  55  -0.410   6.715   3.516
  Start of MODEL    5
 3300    HD2  PHE  55           HD2      PHE  55  -3.425   8.454   1.070
  Start of MODEL    5
 3301    HE1  PHE  55           HE1      PHE  55   0.808   5.994   1.504
  Start of MODEL    5
 3302    HE2  PHE  55           HE2      PHE  55  -2.213   7.730  -0.945
  Start of MODEL    5
 3303    HZ   PHE  55           HZ       PHE  55  -0.089   6.586  -0.756
  Start of MODEL    5
 3304    H    GLU  56           H        GLU  56  -2.418  10.065   6.416
  Start of MODEL    5
 3305    HA   GLU  56           HA       GLU  56  -5.112   9.703   7.171
  Start of MODEL    5
 3306    HB2  GLU  56           HB2      GLU  56  -4.514  10.454   9.360
  Start of MODEL    5
 3307    HB3  GLU  56           HB3      GLU  56  -3.177   9.497   8.737
  Start of MODEL    5
 3308    HG2  GLU  56           HG2      GLU  56  -1.921  11.498   8.246
  Start of MODEL    5
 3309    HG3  GLU  56           HG3      GLU  56  -3.281  12.505   8.740
  Start of MODEL    5
 3310    H    GLN  57           H        GLN  57  -3.453  12.392   5.850
  Start of MODEL    5
 3311    HA   GLN  57           HA       GLN  57  -5.163  14.434   6.847
  Start of MODEL    5
 3312    HB2  GLN  57           HB2      GLN  57  -3.435  14.478   4.369
  Start of MODEL    5
 3313    HB3  GLN  57           HB3      GLN  57  -4.096  15.875   5.204
  Start of MODEL    5
 3314    HG2  GLN  57           HG2      GLN  57  -2.095  13.942   6.357
  Start of MODEL    5
 3315    HG3  GLN  57           HG3      GLN  57  -1.706  15.516   5.671
  Start of MODEL    5
 3316   HE21  GLN  57          HE21      GLN  57  -0.819  16.273   7.554
  Start of MODEL    5
 3317   HE22  GLN  57          HE22      GLN  57  -1.750  16.649   8.964
  Start of MODEL    5
 3318    H    PHE  58           H        PHE  58  -5.719  11.967   4.643
  Start of MODEL    5
 3319    HA   PHE  58           HA       PHE  58  -7.568  13.487   2.983
  Start of MODEL    5
 3320    HB2  PHE  58           HB2      PHE  58  -6.798  10.563   2.947
  Start of MODEL    5
 3321    HB3  PHE  58           HB3      PHE  58  -7.960  11.290   1.853
  Start of MODEL    5
 3322    HD1  PHE  58           HD1      PHE  58  -4.463  11.744   3.009
  Start of MODEL    5
 3323    HD2  PHE  58           HD2      PHE  58  -7.226  12.021  -0.212
  Start of MODEL    5
 3324    HE1  PHE  58           HE1      PHE  58  -2.625  12.344   1.491
  Start of MODEL    5
 3325    HE2  PHE  58           HE2      PHE  58  -5.390  12.631  -1.737
  Start of MODEL    5
 3326    HZ   PHE  58           HZ       PHE  58  -3.140  12.769  -0.954
  Start of MODEL    5
 3327    H    GLY  59           H        GLY  59  -7.826  12.395   6.015
  Start of MODEL    5
 3328    HA2  GLY  59           HA2      GLY  59 -10.368  12.434   6.586
  Start of MODEL    5
 3329    HA3  GLY  59           HA3      GLY  59 -10.359  10.946   5.655
  Start of MODEL    5
 3330    H    ASP  60           H        ASP  60 -10.348   9.202   6.865
  Start of MODEL    5
 3331    HA   ASP  60           HA       ASP  60  -8.817   9.228   9.383
  Start of MODEL    5
 3332    HB2  ASP  60           HB2      ASP  60 -11.535   8.019   8.854
  Start of MODEL    5
 3333    HB3  ASP  60           HB3      ASP  60 -10.563   7.627  10.267
  Start of MODEL    5
 3334    H    ILE  61           H        ILE  61  -7.314   7.648   9.523
  Start of MODEL    5
 3335    HA   ILE  61           HA       ILE  61  -7.469   5.419   7.646
  Start of MODEL    5
 3336    HB   ILE  61           HB       ILE  61  -5.235   6.666   9.209
  Start of MODEL    5
 3337   HD11  ILE  61          HD11      ILE  61  -3.173   6.046   7.018
  Start of MODEL    5
 3338   HD13  ILE  61          HD12      ILE  61  -3.484   7.658   7.662
  Start of MODEL    5
 3339   HD12  ILE  61          HD13      ILE  61  -3.613   7.360   5.929
  Start of MODEL    5
 3340    H    GLU  62           H        GLU  62  -7.644   3.362   8.236
  Start of MODEL    5
 3341    HA   GLU  62           HA       GLU  62  -8.156   2.674  11.008
  Start of MODEL    5
 3342    HB2  GLU  62           HB2      GLU  62  -8.687   1.526   8.369
  Start of MODEL    5
 3343    HB3  GLU  62           HB3      GLU  62  -8.161   0.329   9.543
  Start of MODEL    5
 3344    HG2  GLU  62           HG2      GLU  62 -10.455   2.245   9.906
  Start of MODEL    5
 3345    HG3  GLU  62           HG3      GLU  62 -10.599   0.550   9.439
  Start of MODEL    5
 3346    H    GLU  63           H        GLU  63  -5.848   1.855   8.422
  Start of MODEL    5
 3347    HA   GLU  63           HA       GLU  63  -3.838   1.129  10.424
  Start of MODEL    5
 3348    HB2  GLU  63           HB2      GLU  63  -4.956  -0.981   9.828
  Start of MODEL    5
 3349    HB3  GLU  63           HB3      GLU  63  -4.716  -0.641   8.119
  Start of MODEL    5
 3350    HG2  GLU  63           HG2      GLU  63  -2.997  -2.087   8.482
  Start of MODEL    5
 3351    HG3  GLU  63           HG3      GLU  63  -2.181  -0.566   8.847
  Start of MODEL    5
 3352    H    ALA  64           H        ALA  64  -1.811   1.907   9.771
  Start of MODEL    5
 3353    HA   ALA  64           HA       ALA  64  -1.376   2.218   6.887
  Start of MODEL    5
 3354    HB1  ALA  64           HB1      ALA  64  -0.630   4.317   8.928
  Start of MODEL    5
 3355    HB3  ALA  64           HB2      ALA  64  -1.950   4.441   7.763
  Start of MODEL    5
 3356    HB2  ALA  64           HB3      ALA  64  -0.280   4.369   7.201
  Start of MODEL    5
 3357    H    VAL  65           H        VAL  65   0.253   0.913   6.424
  Start of MODEL    5
 3358    HA   VAL  65           HA       VAL  65   2.610   0.891   8.171
  Start of MODEL    5
 3359    HB   VAL  65           HB       VAL  65   2.794  -1.587   7.958
  Start of MODEL    5
 3360    H    VAL  66           H        VAL  66   4.551   0.418   7.183
  Start of MODEL    5
 3361    HA   VAL  66           HA       VAL  66   4.510   0.173   4.257
  Start of MODEL    5
 3362    HB   VAL  66           HB       VAL  66   6.895   0.523   6.104
  Start of MODEL    5
 3363    H    ILE  67           H        ILE  67   5.276  -1.738   3.251
  Start of MODEL    5
 3364    HA   ILE  67           HA       ILE  67   4.742  -3.981   5.003
  Start of MODEL    5
 3365    HB   ILE  67           HB       ILE  67   4.985  -3.794   2.008
  Start of MODEL    5
 3366   HD12  ILE  67          HD11      ILE  67   1.414  -3.905   4.302
  Start of MODEL    5
 3367   HD11  ILE  67          HD12      ILE  67   2.981  -3.745   5.094
  Start of MODEL    5
 3368   HD13  ILE  67          HD13      ILE  67   2.472  -5.306   4.447
  Start of MODEL    5
 3369    H    THR  68           H        THR  68   6.138  -5.354   5.728
  Start of MODEL    5
 3370    HA   THR  68           HA       THR  68   8.857  -5.385   4.607
  Start of MODEL    5
 3371    HB   THR  68           HB       THR  68   9.638  -5.850   6.958
  Start of MODEL    5
 3372    HG1  THR  68           HG1      THR  68   7.568  -4.708   8.240
  Start of MODEL    5
 3373   HG22  THR  68          HG21      THR  68   9.425  -3.504   7.752
  Start of MODEL    5
 3374   HG21  THR  68          HG22      THR  68   8.247  -3.210   6.473
  Start of MODEL    5
 3375   HG23  THR  68          HG23      THR  68   9.914  -3.620   6.064
  Start of MODEL    5
 3376    H    ASP  69           H        ASP  69   9.799  -7.458   4.449
  Start of MODEL    5
 3377    HA   ASP  69           HA       ASP  69   8.138  -9.653   4.174
  Start of MODEL    5
 3378    HB2  ASP  69           HB2      ASP  69  10.288  -9.577   3.112
  Start of MODEL    5
 3379    HB3  ASP  69           HB3      ASP  69  11.108  -9.510   4.670
  Start of MODEL    5
 3380    H    ARG  70           H        ARG  70   7.473 -11.301   5.461
  Start of MODEL    5
 3381    HA   ARG  70           HA       ARG  70   7.295 -10.870   8.172
  Start of MODEL    5
 3382    HB2  ARG  70           HB2      ARG  70   6.166 -12.902   8.393
  Start of MODEL    5
 3383    HB3  ARG  70           HB3      ARG  70   5.777 -12.293   6.793
  Start of MODEL    5
 3384    HG2  ARG  70           HG2      ARG  70   7.860 -14.375   7.359
  Start of MODEL    5
 3385    HG3  ARG  70           HG3      ARG  70   6.196 -14.727   6.896
  Start of MODEL    5
 3386    HD2  ARG  70           HD2      ARG  70   6.646 -13.291   4.847
  Start of MODEL    5
 3387    HD3  ARG  70           HD3      ARG  70   8.347 -13.383   5.296
  Start of MODEL    5
 3388    HE   ARG  70           HE       ARG  70   6.983 -15.932   5.106
  Start of MODEL    5
 3389   HH11  ARG  70          HH11      ARG  70   9.038 -13.599   3.462
  Start of MODEL    5
 3390   HH12  ARG  70          HH12      ARG  70   9.530 -14.742   2.240
  Start of MODEL    5
 3391   HH21  ARG  70          HH21      ARG  70   7.651 -17.393   3.529
  Start of MODEL    5
 3392   HH22  ARG  70          HH22      ARG  70   8.748 -16.880   2.281
  Start of MODEL    5
 3393    H    ASN  71           H        ASN  71   9.874 -12.545   6.499
  Start of MODEL    5
 3394    HA   ASN  71           HA       ASN  71  10.788 -13.626   9.058
  Start of MODEL    5
 3395    HB2  ASN  71           HB2      ASN  71  11.614 -14.218   6.228
  Start of MODEL    5
 3396    HB3  ASN  71           HB3      ASN  71  12.543 -14.783   7.614
  Start of MODEL    5
 3397   HD21  ASN  71          HD21      ASN  71  11.563 -16.253   9.072
  Start of MODEL    5
 3398   HD22  ASN  71          HD22      ASN  71  10.225 -17.234   8.572
  Start of MODEL    5
 3399    H    THR  72           H        THR  72  12.110 -11.673   6.371
  Start of MODEL    5
 3400    HA   THR  72           HA       THR  72  14.468 -11.074   7.970
  Start of MODEL    5
 3401    HB   THR  72           HB       THR  72  15.156  -9.766   5.923
  Start of MODEL    5
 3402    HG1  THR  72           HG1      THR  72  12.891 -11.013   4.715
  Start of MODEL    5
 3403   HG23  THR  72          HG21      THR  72  15.874 -12.087   6.252
  Start of MODEL    5
 3404   HG22  THR  72          HG22      THR  72  15.572 -11.756   4.548
  Start of MODEL    5
 3405   HG21  THR  72          HG23      THR  72  14.388 -12.658   5.492
  Start of MODEL    5
 3406    H    GLN  73           H        GLN  73  11.478  -9.720   7.275
  Start of MODEL    5
 3407    HA   GLN  73           HA       GLN  73  10.363  -7.860   8.040
  Start of MODEL    5
 3408    HB2  GLN  73           HB2      GLN  73  12.777  -7.563   9.839
  Start of MODEL    5
 3409    HB3  GLN  73           HB3      GLN  73  11.230  -6.754  10.053
  Start of MODEL    5
 3410    HG2  GLN  73           HG2      GLN  73  10.132  -8.824  10.509
  Start of MODEL    5
 3411    HG3  GLN  73           HG3      GLN  73  11.569  -9.741  10.062
  Start of MODEL    5
 3412   HE21  GLN  73          HE21      GLN  73  13.360  -7.866  11.407
  Start of MODEL    5
 3413   HE22  GLN  73          HE22      GLN  73  13.188  -8.176  13.097
  Start of MODEL    5
 3414    H    LYS  74           H        LYS  74  12.199  -7.701   5.803
  Start of MODEL    5
 3415    HA   LYS  74           HA       LYS  74  13.329  -5.011   5.982
  Start of MODEL    5
 3416    HB2  LYS  74           HB2      LYS  74  13.517  -7.158   3.860
  Start of MODEL    5
 3417    HB3  LYS  74           HB3      LYS  74  14.210  -5.550   3.677
  Start of MODEL    5
 3418    HG2  LYS  74           HG2      LYS  74  14.924  -7.445   5.906
  Start of MODEL    5
 3419    HG3  LYS  74           HG3      LYS  74  15.827  -7.295   4.396
  Start of MODEL    5
 3420    HD2  LYS  74           HD2      LYS  74  16.454  -5.073   4.875
  Start of MODEL    5
 3421    HD3  LYS  74           HD3      LYS  74  15.265  -4.936   6.172
  Start of MODEL    5
 3422    HE2  LYS  74           HE2      LYS  74  17.649  -6.778   6.218
  Start of MODEL    5
 3423    HE3  LYS  74           HE3      LYS  74  17.596  -5.187   6.981
  Start of MODEL    5
 3424    HZ3  LYS  74           HZ1      LYS  74  15.729  -5.960   8.334
  Start of MODEL    5
 3425    HZ2  LYS  74           HZ2      LYS  74  17.111  -6.905   8.588
  Start of MODEL    5
 3426    HZ1  LYS  74           HZ3      LYS  74  15.846  -7.499   7.633
  Start of MODEL    5
 3427    H    SER  75           H        SER  75  12.425  -3.259   5.060
  Start of MODEL    5
 3428    HA   SER  75           HA       SER  75   9.805  -3.229   4.169
  Start of MODEL    5
 3429    HB2  SER  75           HB2      SER  75  11.881  -1.177   3.392
  Start of MODEL    5
 3430    HB3  SER  75           HB3      SER  75  10.160  -0.925   3.698
  Start of MODEL    5
 3431    HG   SER  75           HG       SER  75  10.692  -0.554   5.692
  Start of MODEL    5
 3432    H    ARG  76           H        ARG  76   8.856  -3.538   2.269
  Start of MODEL    5
 3433    HA   ARG  76           HA       ARG  76  10.515  -4.725   0.183
  Start of MODEL    5
 3434    HB2  ARG  76           HB2      ARG  76   7.519  -4.646   0.540
  Start of MODEL    5
 3435    HB3  ARG  76           HB3      ARG  76   8.362  -5.522  -0.728
  Start of MODEL    5
 3436    HG2  ARG  76           HG2      ARG  76   9.467  -6.900   1.000
  Start of MODEL    5
 3437    HG3  ARG  76           HG3      ARG  76   8.534  -6.044   2.232
  Start of MODEL    5
 3438    HD2  ARG  76           HD2      ARG  76   6.482  -6.870   1.378
  Start of MODEL    5
 3439    HD3  ARG  76           HD3      ARG  76   7.257  -7.486  -0.077
  Start of MODEL    5
 3440    HE   ARG  76           HE       ARG  76   8.172  -8.663   2.402
  Start of MODEL    5
 3441   HH11  ARG  76          HH11      ARG  76   5.962  -8.829  -0.301
  Start of MODEL    5
 3442   HH12  ARG  76          HH12      ARG  76   5.662 -10.530  -0.128
  Start of MODEL    5
 3443   HH21  ARG  76          HH21      ARG  76   7.788 -10.932   2.632
  Start of MODEL    5
 3444   HH22  ARG  76          HH22      ARG  76   6.701 -11.726   1.529
  Start of MODEL    5
 3445    H    GLY  77           H        GLY  77  10.048  -1.732   0.693
  Start of MODEL    5
 3446    HA2  GLY  77           HA2      GLY  77   9.971   0.157  -0.633
  Start of MODEL    5
 3447    HA3  GLY  77           HA3      GLY  77   9.979  -0.918  -2.019
  Start of MODEL    5
 3448    H    TYR  78           H        TYR  78   7.428  -1.597   0.074
  Start of MODEL    5
 3449    HA   TYR  78           HA       TYR  78   5.616   0.359  -1.008
  Start of MODEL    5
 3450    HB2  TYR  78           HB2      TYR  78   4.042  -1.296  -1.953
  Start of MODEL    5
 3451    HB3  TYR  78           HB3      TYR  78   5.565  -1.242  -2.820
  Start of MODEL    5
 3452    HD1  TYR  78           HD1      TYR  78   3.601  -3.242  -0.376
  Start of MODEL    5
 3453    HD2  TYR  78           HD2      TYR  78   6.865  -3.173  -3.107
  Start of MODEL    5
 3454    HE1  TYR  78           HE1      TYR  78   3.784  -5.690  -0.219
  Start of MODEL    5
 3455    HE2  TYR  78           HE2      TYR  78   7.060  -5.611  -2.949
  Start of MODEL    5
 3456    HH   TYR  78           HH       TYR  78   4.685  -7.564  -1.719
  Start of MODEL    5
 3457    H    GLY  79           H        GLY  79   3.323  -0.083  -0.121
  Start of MODEL    5
 3458    HA2  GLY  79           HA2      GLY  79   3.352  -1.491   2.419
  Start of MODEL    5
 3459    HA3  GLY  79           HA3      GLY  79   3.305   0.261   2.537
  Start of MODEL    5
 3460    H    PHE  80           H        PHE  80   1.286  -0.591   3.717
  Start of MODEL    5
 3461    HA   PHE  80           HA       PHE  80  -0.935  -0.415   1.825
  Start of MODEL    5
 3462    HB2  PHE  80           HB2      PHE  80  -0.583  -2.505   3.950
  Start of MODEL    5
 3463    HB3  PHE  80           HB3      PHE  80  -2.187  -2.025   3.401
  Start of MODEL    5
 3464    HD1  PHE  80           HD1      PHE  80   0.784  -3.913   2.662
  Start of MODEL    5
 3465    HD2  PHE  80           HD2      PHE  80  -2.802  -2.352   1.001
  Start of MODEL    5
 3466    HE1  PHE  80           HE1      PHE  80   1.006  -5.452   0.761
  Start of MODEL    5
 3467    HE2  PHE  80           HE2      PHE  80  -2.592  -3.885  -0.912
  Start of MODEL    5
 3468    HZ   PHE  80           HZ       PHE  80  -0.747  -5.440  -1.042
  Start of MODEL    5
 3469    H    VAL  81           H        VAL  81  -2.541   0.771   2.366
  Start of MODEL    5
 3470    HA   VAL  81           HA       VAL  81  -2.814   1.697   5.153
  Start of MODEL    5
 3471    HB   VAL  81           HB       VAL  81  -3.084   3.428   2.684
  Start of MODEL    5
 3472    H    THR  82           H        THR  82  -4.739   1.296   5.973
  Start of MODEL    5
 3473    HA   THR  82           HA       THR  82  -6.935   0.637   4.130
  Start of MODEL    5
 3474    HB   THR  82           HB       THR  82  -6.821   0.052   7.097
  Start of MODEL    5
 3475    HG1  THR  82           HG1      THR  82  -5.463  -1.108   5.041
  Start of MODEL    5
 3476   HG23  THR  82          HG21      THR  82  -9.045  -0.012   6.045
  Start of MODEL    5
 3477   HG22  THR  82          HG22      THR  82  -8.524  -1.624   6.544
  Start of MODEL    5
 3478   HG21  THR  82          HG23      THR  82  -8.443  -1.154   4.843
  Start of MODEL    5
 3479    H    MET  83           H        MET  83  -8.158   2.400   3.778
  Start of MODEL    5
 3480    HA   MET  83           HA       MET  83  -8.287   4.505   5.746
  Start of MODEL    5
 3481    HB2  MET  83           HB2      MET  83  -9.700   4.269   3.086
  Start of MODEL    5
 3482    HB3  MET  83           HB3      MET  83  -9.597   5.719   4.077
  Start of MODEL    5
 3483    HG2  MET  83           HG2      MET  83  -7.279   4.302   2.782
  Start of MODEL    5
 3484    HG3  MET  83           HG3      MET  83  -8.041   5.779   2.199
  Start of MODEL    5
 3485    HE1  MET  83           HE1      MET  83  -8.543   7.501   4.780
  Start of MODEL    5
 3486    HE3  MET  83           HE2      MET  83  -7.795   8.120   3.306
  Start of MODEL    5
 3487    HE2  MET  83           HE3      MET  83  -7.030   8.403   4.872
  Start of MODEL    5
 3488    H    LYS  84           H        LYS  84  -9.986   5.078   6.921
  Start of MODEL    5
 3489    HA   LYS  84           HA       LYS  84 -11.858   3.081   7.649
  Start of MODEL    5
 3490    HB2  LYS  84           HB2      LYS  84 -10.832   4.867   9.113
  Start of MODEL    5
 3491    HB3  LYS  84           HB3      LYS  84 -11.953   6.002   8.377
  Start of MODEL    5
 3492    HG2  LYS  84           HG2      LYS  84 -13.812   4.946   9.329
  Start of MODEL    5
 3493    HG3  LYS  84           HG3      LYS  84 -12.886   3.502   9.741
  Start of MODEL    5
 3494    HD2  LYS  84           HD2      LYS  84 -12.460   6.239  10.929
  Start of MODEL    5
 3495    HD3  LYS  84           HD3      LYS  84 -13.359   4.932  11.702
  Start of MODEL    5
 3496    HE2  LYS  84           HE2      LYS  84 -11.327   3.546  11.674
  Start of MODEL    5
 3497    HE3  LYS  84           HE3      LYS  84 -10.447   4.875  10.923
  Start of MODEL    5
 3498    HZ3  LYS  84           HZ1      LYS  84 -10.745   6.202  12.859
  Start of MODEL    5
 3499    HZ2  LYS  84           HZ2      LYS  84 -10.130   4.700  13.356
  Start of MODEL    5
 3500    HZ1  LYS  84           HZ3      LYS  84 -11.774   5.057  13.567
  Start of MODEL    5
 3501    H    ASP  85           H        ASP  85 -11.847   5.382   5.179
  Start of MODEL    5
 3502    HA   ASP  85           HA       ASP  85 -14.672   4.896   4.655
  Start of MODEL    5
 3503    HB2  ASP  85           HB2      ASP  85 -14.994   6.979   5.590
  Start of MODEL    5
 3504    HB3  ASP  85           HB3      ASP  85 -13.389   7.545   5.145
  Start of MODEL    5
 3505    H    ARG  86           H        ARG  86 -15.215   4.905   2.471
  Start of MODEL    5
 3506    HA   ARG  86           HA       ARG  86 -13.185   4.145   0.692
  Start of MODEL    5
 3507    HB2  ARG  86           HB2      ARG  86 -15.502   3.350   0.590
  Start of MODEL    5
 3508    HB3  ARG  86           HB3      ARG  86 -16.039   4.965   0.154
  Start of MODEL    5
 3509    HG2  ARG  86           HG2      ARG  86 -14.704   4.820  -1.914
  Start of MODEL    5
 3510    HG3  ARG  86           HG3      ARG  86 -14.273   3.161  -1.486
  Start of MODEL    5
 3511    HD2  ARG  86           HD2      ARG  86 -17.036   4.242  -2.014
  Start of MODEL    5
 3512    HD3  ARG  86           HD3      ARG  86 -16.123   3.134  -3.037
  Start of MODEL    5
 3513    HE   ARG  86           HE       ARG  86 -16.382   1.960  -0.513
  Start of MODEL    5
 3514   HH11  ARG  86          HH11      ARG  86 -18.456   2.949  -3.156
  Start of MODEL    5
 3515   HH12  ARG  86          HH12      ARG  86 -19.626   1.694  -2.864
  Start of MODEL    5
 3516   HH21  ARG  86          HH21      ARG  86 -17.974   0.320  -0.125
  Start of MODEL    5
 3517   HH22  ARG  86          HH22      ARG  86 -19.370   0.241  -1.154
  Start of MODEL    5
 3518    H    ALA  87           H        ALA  87 -14.980   7.184   1.001
  Start of MODEL    5
 3519    HA   ALA  87           HA       ALA  87 -14.112   8.316  -1.429
  Start of MODEL    5
 3520    HB1  ALA  87           HB1      ALA  87 -14.964   9.713   1.108
  Start of MODEL    5
 3521    HB3  ALA  87           HB2      ALA  87 -16.033   9.180  -0.190
  Start of MODEL    5
 3522    HB2  ALA  87           HB3      ALA  87 -14.848  10.451  -0.491
  Start of MODEL    5
 3523    H    SER  88           H        SER  88 -12.817   8.411   1.845
  Start of MODEL    5
 3524    HA   SER  88           HA       SER  88 -10.736  10.254   1.392
  Start of MODEL    5
 3525    HB2  SER  88           HB2      SER  88 -10.738   7.936   3.347
  Start of MODEL    5
 3526    HB3  SER  88           HB3      SER  88  -9.805   9.427   3.473
  Start of MODEL    5
 3527    HG   SER  88           HG       SER  88 -12.651   9.317   3.450
  Start of MODEL    5
 3528    H    ALA  89           H        ALA  89 -10.892   6.736   1.173
  Start of MODEL    5
 3529    HA   ALA  89           HA       ALA  89  -8.202   6.246   0.525
  Start of MODEL    5
 3530    HB2  ALA  89           HB1      ALA  89 -10.623   4.648  -0.317
  Start of MODEL    5
 3531    HB1  ALA  89           HB2      ALA  89  -9.802   4.506   1.239
  Start of MODEL    5
 3532    HB3  ALA  89           HB3      ALA  89  -8.956   4.074  -0.248
  Start of MODEL    5
 3533    H    GLU  90           H        GLU  90 -11.003   6.956  -1.490
  Start of MODEL    5
 3534    HA   GLU  90           HA       GLU  90  -9.704   6.438  -3.949
  Start of MODEL    5
 3535    HB2  GLU  90           HB2      GLU  90 -12.185   6.433  -3.529
  Start of MODEL    5
 3536    HB3  GLU  90           HB3      GLU  90 -12.110   8.190  -3.567
  Start of MODEL    5
 3537    HG2  GLU  90           HG2      GLU  90 -10.882   6.712  -5.819
  Start of MODEL    5
 3538    HG3  GLU  90           HG3      GLU  90 -12.643   6.737  -5.717
  Start of MODEL    5
 3539    H    ARG  91           H        ARG  91 -10.232   9.417  -2.071
  Start of MODEL    5
 3540    HA   ARG  91           HA       ARG  91  -9.279  11.203  -4.006
  Start of MODEL    5
 3541    HB2  ARG  91           HB2      ARG  91  -8.917  11.465  -1.015
  Start of MODEL    5
 3542    HB3  ARG  91           HB3      ARG  91  -8.881  12.770  -2.189
  Start of MODEL    5
 3543    HG2  ARG  91           HG2      ARG  91 -11.213  11.187  -1.197
  Start of MODEL    5
 3544    HG3  ARG  91           HG3      ARG  91 -10.968  12.934  -1.190
  Start of MODEL    5
 3545    HD2  ARG  91           HD2      ARG  91 -11.384  11.232  -3.644
  Start of MODEL    5
 3546    HD3  ARG  91           HD3      ARG  91 -12.605  12.250  -2.881
  Start of MODEL    5
 3547    HE   ARG  91           HE       ARG  91 -10.767  14.070  -3.374
  Start of MODEL    5
 3548   HH11  ARG  91          HH11      ARG  91 -11.712  11.379  -5.404
  Start of MODEL    5
 3549   HH12  ARG  91          HH12      ARG  91 -11.519  12.271  -6.883
  Start of MODEL    5
 3550   HH21  ARG  91          HH21      ARG  91 -10.526  15.252  -5.313
  Start of MODEL    5
 3551   HH22  ARG  91          HH22      ARG  91 -10.839  14.479  -6.833
  Start of MODEL    5
 3552    H    ALA  92           H        ALA  92  -7.601   9.351  -1.528
  Start of MODEL    5
 3553    HA   ALA  92           HA       ALA  92  -5.004  10.247  -2.024
  Start of MODEL    5
 3554    HB1  ALA  92           HB1      ALA  92  -5.870   7.492  -1.163
  Start of MODEL    5
 3555    HB3  ALA  92           HB2      ALA  92  -5.609   8.872  -0.096
  Start of MODEL    5
 3556    HB2  ALA  92           HB3      ALA  92  -4.256   8.176  -0.989
  Start of MODEL    5
 3557    H    CYS  93           H        CYS  93  -6.912   7.764  -3.624
  Start of MODEL    5
 3558    HA   CYS  93           HA       CYS  93  -4.680   6.833  -5.212
  Start of MODEL    5
 3559    HB2  CYS  93           HB2      CYS  93  -7.609   6.121  -5.413
  Start of MODEL    5
 3560    HB3  CYS  93           HB3      CYS  93  -6.272   5.272  -6.182
  Start of MODEL    5
 3561    HG   CYS  93           HG       CYS  93  -6.923   5.427  -2.824
  Start of MODEL    5
 3562    H    LYS  94           H        LYS  94  -6.930   9.371  -5.503
  Start of MODEL    5
 3563    HA   LYS  94           HA       LYS  94  -7.459   9.146  -8.281
  Start of MODEL    5
 3564    HB2  LYS  94           HB2      LYS  94  -8.859  10.399  -6.558
  Start of MODEL    5
 3565    HB3  LYS  94           HB3      LYS  94  -7.674  11.694  -6.692
  Start of MODEL    5
 3566    HG2  LYS  94           HG2      LYS  94  -9.674  12.035  -8.108
  Start of MODEL    5
 3567    HG3  LYS  94           HG3      LYS  94  -8.167  11.979  -9.028
  Start of MODEL    5
 3568    HD2  LYS  94           HD2      LYS  94  -8.602   9.614  -9.556
  Start of MODEL    5
 3569    HD3  LYS  94           HD3      LYS  94 -10.124   9.707  -8.671
  Start of MODEL    5
 3570    HE2  LYS  94           HE2      LYS  94 -10.977  11.335 -10.242
  Start of MODEL    5
 3571    HE3  LYS  94           HE3      LYS  94  -9.425  11.373 -11.083
  Start of MODEL    5
 3572    HZ1  LYS  94           HZ1      LYS  94 -11.154   8.970 -10.832
  Start of MODEL    5
 3573    HZ3  LYS  94           HZ2      LYS  94  -9.711   9.086 -11.717
  Start of MODEL    5
 3574    HZ2  LYS  94           HZ3      LYS  94 -11.073   9.967 -12.206
  Start of MODEL    5
 3575    H    ASP  95           H        ASP  95  -5.018  10.853  -6.408
  Start of MODEL    5
 3576    HA   ASP  95           HA       ASP  95  -3.696  11.480  -8.969
  Start of MODEL    5
 3577    HB2  ASP  95           HB2      ASP  95  -4.039  13.391  -7.306
  Start of MODEL    5
 3578    HB3  ASP  95           HB3      ASP  95  -2.883  12.568  -6.261
  Start of MODEL    5
 3579    HA   PRO  96           HA       PRO  96  -1.956   7.609  -7.401
  Start of MODEL    5
 3580    HB2  PRO  96           HB2      PRO  96  -1.084   6.678  -9.785
  Start of MODEL    5
 3581    HB3  PRO  96           HB3      PRO  96  -2.779   6.608  -9.284
  Start of MODEL    5
 3582    HG2  PRO  96           HG2      PRO  96  -1.407   8.580 -11.072
  Start of MODEL    5
 3583    HG3  PRO  96           HG3      PRO  96  -2.975   7.777 -11.283
  Start of MODEL    5
 3584    HD2  PRO  96           HD2      PRO  96  -2.749  10.313 -10.367
  Start of MODEL    5
 3585    HD3  PRO  96           HD3      PRO  96  -4.048   9.222  -9.846
  Start of MODEL    5
 3586    H    ASN  97           H        ASN  97  -0.325  10.330  -8.404
  Start of MODEL    5
 3587    HA   ASN  97           HA       ASN  97   2.276   8.977  -8.085
  Start of MODEL    5
 3588    HB2  ASN  97           HB2      ASN  97   1.589  11.250  -9.953
  Start of MODEL    5
 3589    HB3  ASN  97           HB3      ASN  97   3.228  10.712  -9.623
  Start of MODEL    5
 3590   HD21  ASN  97          HD21      ASN  97   2.570   7.904  -9.517
  Start of MODEL    5
 3591   HD22  ASN  97          HD22      ASN  97   2.258   7.420 -11.147
  Start of MODEL    5
 3592    HA   PRO  98           HA       PRO  98   1.869  12.620  -5.104
  Start of MODEL    5
 3593    HB2  PRO  98           HB2      PRO  98   2.002  10.760  -2.886
  Start of MODEL    5
 3594    HB3  PRO  98           HB3      PRO  98   0.728  11.918  -3.282
  Start of MODEL    5
 3595    HG2  PRO  98           HG2      PRO  98   0.414   9.209  -3.445
  Start of MODEL    5
 3596    HG3  PRO  98           HG3      PRO  98  -0.506  10.369  -4.419
  Start of MODEL    5
 3597    HD2  PRO  98           HD2      PRO  98   1.873   8.719  -5.178
  Start of MODEL    5
 3598    HD3  PRO  98           HD3      PRO  98   0.424   9.113  -6.128
  Start of MODEL    5
 3599    H    ILE  99           H        ILE  99   3.683  13.548  -4.235
  Start of MODEL    5
 3600    HA   ILE  99           HA       ILE  99   6.135  12.010  -4.265
  Start of MODEL    5
 3601    HB   ILE  99           HB       ILE  99   5.723  14.834  -3.255
  Start of MODEL    5
 3602   HD12  ILE  99          HD11      ILE  99   6.577  14.018  -7.352
  Start of MODEL    5
 3603   HD11  ILE  99          HD12      ILE  99   6.212  12.673  -6.270
  Start of MODEL    5
 3604   HD13  ILE  99          HD13      ILE  99   7.763  13.503  -6.151
  Start of MODEL    5
 3605    H    ILE 100           H        ILE 100   6.497  10.642  -2.685
  Start of MODEL    5
 3606    HA   ILE 100           HA       ILE 100   5.823  11.440   0.070
  Start of MODEL    5
 3607    HB   ILE 100           HB       ILE 100   5.670   8.641  -1.080
  Start of MODEL    5
 3608   HD12  ILE 100          HD11      ILE 100   1.926   8.840  -1.012
  Start of MODEL    5
 3609   HD11  ILE 100          HD12      ILE 100   2.918   8.147   0.270
  Start of MODEL    5
 3610   HD13  ILE 100          HD13      ILE 100   3.274   7.776  -1.418
  Start of MODEL    5
 3611    H    ASP 101           H        ASP 101   7.553  11.655   1.259
  Start of MODEL    5
 3612    HA   ASP 101           HA       ASP 101   9.599  11.355   2.208
  Start of MODEL    5
 3613    HB2  ASP 101           HB2      ASP 101   8.623   9.032   2.448
  Start of MODEL    5
 3614    HB3  ASP 101           HB3      ASP 101   9.508   8.586   0.996
  Start of MODEL    5
 3615    H    GLY 102           H        GLY 102   9.428  12.553  -0.302
  Start of MODEL    5
 3616    HA2  GLY 102           HA2      GLY 102  10.947  13.515  -1.728
  Start of MODEL    5
 3617    HA3  GLY 102           HA3      GLY 102  12.193  12.488  -1.035
  Start of MODEL    5
 3618    H    ARG 103           H        ARG 103   9.547  10.690  -2.194
  Start of MODEL    5
 3619    HA   ARG 103           HA       ARG 103  10.764  10.465  -4.856
  Start of MODEL    5
 3620    HB2  ARG 103           HB2      ARG 103  11.517   8.568  -3.341
  Start of MODEL    5
 3621    HB3  ARG 103           HB3      ARG 103   9.837   8.032  -3.323
  Start of MODEL    5
 3622    HG2  ARG 103           HG2      ARG 103   9.910   7.827  -5.786
  Start of MODEL    5
 3623    HG3  ARG 103           HG3      ARG 103  11.609   8.294  -5.751
  Start of MODEL    5
 3624    HD2  ARG 103           HD2      ARG 103  12.001   6.320  -4.249
  Start of MODEL    5
 3625    HD3  ARG 103           HD3      ARG 103  10.348   5.819  -4.606
  Start of MODEL    5
 3626    HE   ARG 103           HE       ARG 103  11.931   6.324  -6.956
  Start of MODEL    5
 3627   HH11  ARG 103          HH11      ARG 103  10.948   3.940  -4.616
  Start of MODEL    5
 3628   HH12  ARG 103          HH12      ARG 103  11.437   2.584  -5.581
  Start of MODEL    5
 3629   HH21  ARG 103          HH21      ARG 103  12.559   4.553  -8.275
  Start of MODEL    5
 3630   HH22  ARG 103          HH22      ARG 103  12.364   2.935  -7.672
  Start of MODEL    5
 3631    H    LYS 104           H        LYS 104   9.352   9.899  -6.520
  Start of MODEL    5
 3632    HA   LYS 104           HA       LYS 104   6.577  10.458  -6.039
  Start of MODEL    5
 3633    HB2  LYS 104           HB2      LYS 104   7.631  11.215  -8.099
  Start of MODEL    5
 3634    HB3  LYS 104           HB3      LYS 104   8.035   9.561  -8.527
  Start of MODEL    5
 3635    HG2  LYS 104           HG2      LYS 104   5.795   9.014  -8.965
  Start of MODEL    5
 3636    HG3  LYS 104           HG3      LYS 104   5.202  10.472  -8.163
  Start of MODEL    5
 3637    HD2  LYS 104           HD2      LYS 104   6.944  10.535 -10.617
  Start of MODEL    5
 3638    HD3  LYS 104           HD3      LYS 104   5.180  10.525 -10.688
  Start of MODEL    5
 3639    HE2  LYS 104           HE2      LYS 104   5.002  12.625  -9.696
  Start of MODEL    5
 3640    HE3  LYS 104           HE3      LYS 104   6.624  12.544  -9.010
  Start of MODEL    5
 3641    HZ2  LYS 104           HZ1      LYS 104   6.210  14.047 -11.034
  Start of MODEL    5
 3642    HZ1  LYS 104           HZ2      LYS 104   6.245  12.610 -11.940
  Start of MODEL    5
 3643    HZ3  LYS 104           HZ3      LYS 104   7.595  13.070 -11.026
  Start of MODEL    5
 3644    H    ALA 105           H        ALA 105   5.103   9.042  -5.479
  Start of MODEL    5
 3645    HA   ALA 105           HA       ALA 105   5.782   6.193  -5.646
  Start of MODEL    5
 3646    HB2  ALA 105           HB1      ALA 105   4.247   5.868  -3.781
  Start of MODEL    5
 3647    HB1  ALA 105           HB2      ALA 105   3.842   7.585  -3.802
  Start of MODEL    5
 3648    HB3  ALA 105           HB3      ALA 105   5.474   7.070  -3.381
  Start of MODEL    5
 3649    H    ASN 106           H        ASN 106   3.997   4.702  -6.016
  Start of MODEL    5
 3650    HA   ASN 106           HA       ASN 106   1.904   5.881  -7.735
  Start of MODEL    5
 3651    HB2  ASN 106           HB2      ASN 106   3.147   3.121  -7.950
  Start of MODEL    5
 3652    HB3  ASN 106           HB3      ASN 106   1.830   3.722  -8.951
  Start of MODEL    5
 3653   HD21  ASN 106          HD21      ASN 106   4.398   2.761  -9.802
  Start of MODEL    5
 3654   HD22  ASN 106          HD22      ASN 106   5.176   4.069 -10.619
  Start of MODEL    5
 3655    H    VAL 107           H        VAL 107  -0.026   5.816  -6.774
  Start of MODEL    5
 3656    HA   VAL 107           HA       VAL 107  -0.522   3.674  -4.803
  Start of MODEL    5
 3657    HB   VAL 107           HB       VAL 107  -1.567   6.511  -4.751
  Start of MODEL    5
 3658    H    ASN 108           H        ASN 108  -2.369   2.536  -4.923
  Start of MODEL    5
 3659    HA   ASN 108           HA       ASN 108  -4.731   3.591  -6.188
  Start of MODEL    5
 3660    HB2  ASN 108           HB2      ASN 108  -4.982   1.656  -7.748
  Start of MODEL    5
 3661    HB3  ASN 108           HB3      ASN 108  -3.649   2.716  -8.173
  Start of MODEL    5
 3662   HD21  ASN 108          HD21      ASN 108  -4.533  -0.433  -6.933
  Start of MODEL    5
 3663   HD22  ASN 108          HD22      ASN 108  -2.972  -1.147  -7.119
  Start of MODEL    5
 3664    H    LEU 109           H        LEU 109  -6.637   2.255  -5.746
  Start of MODEL    5
 3665    HA   LEU 109           HA       LEU 109  -6.694   0.909  -3.327
  Start of MODEL    5
 3666    HB2  LEU 109           HB2      LEU 109  -8.473   0.476  -5.728
  Start of MODEL    5
 3667    HB3  LEU 109           HB3      LEU 109  -8.818  -0.107  -4.112
  Start of MODEL    5
 3668    HG   LEU 109           HG       LEU 109  -8.578   2.800  -4.899
  Start of MODEL    5
 3669   HD13  LEU 109          HD11      LEU 109 -10.589   1.707  -5.798
  Start of MODEL    5
 3670   HD12  LEU 109          HD12      LEU 109 -10.974   2.897  -4.554
  Start of MODEL    5
 3671   HD11  LEU 109          HD13      LEU 109 -11.012   1.176  -4.171
  Start of MODEL    5
 3672   HD23  LEU 109          HD21      LEU 109  -9.377   1.515  -2.293
  Start of MODEL    5
 3673   HD22  LEU 109          HD22      LEU 109  -9.420   3.241  -2.646
  Start of MODEL    5
 3674   HD21  LEU 109          HD23      LEU 109  -7.879   2.386  -2.600
  Start of MODEL    5
 3675    H    ALA 110           H        ALA 110  -6.345  -1.166  -2.653
  Start of MODEL    5
 3676    HA   ALA 110           HA       ALA 110  -4.262  -2.461  -4.032
  Start of MODEL    5
 3677    HB2  ALA 110           HB1      ALA 110  -5.863  -3.463  -1.690
  Start of MODEL    5
 3678    HB1  ALA 110           HB2      ALA 110  -4.460  -2.398  -1.597
  Start of MODEL    5
 3679    HB3  ALA 110           HB3      ALA 110  -4.277  -4.047  -2.200
  Start of MODEL    5
 3680    H    TYR 111           H        TYR 111  -7.704  -3.176  -3.897
  Start of MODEL    5
 3681    HA   TYR 111           HA       TYR 111  -7.458  -5.880  -4.720
  Start of MODEL    5
 3682    HB2  TYR 111           HB2      TYR 111  -9.796  -5.945  -4.840
  Start of MODEL    5
 3683    HB3  TYR 111           HB3      TYR 111  -9.469  -4.756  -3.589
  Start of MODEL    5
 3684    HD1  TYR 111           HD1      TYR 111  -9.251  -2.269  -4.562
  Start of MODEL    5
 3685    HD2  TYR 111           HD2      TYR 111 -11.457  -5.423  -6.368
  Start of MODEL    5
 3686    HE1  TYR 111           HE1      TYR 111 -10.626  -0.619  -5.747
  Start of MODEL    5
 3687    HE2  TYR 111           HE2      TYR 111 -12.843  -3.779  -7.562
  Start of MODEL    5
 3688    HH   TYR 111           HH       TYR 111 -13.518  -1.448  -7.371
  Start of MODEL    5
 3689    H    LEU 112           H        LEU 112  -7.048  -3.004  -6.406
  Start of MODEL    5
 3690    HA   LEU 112           HA       LEU 112  -7.908  -3.863  -8.981
  Start of MODEL    5
 3691    HB2  LEU 112           HB2      LEU 112  -6.056  -1.634  -8.146
  Start of MODEL    5
 3692    HB3  LEU 112           HB3      LEU 112  -6.609  -1.892  -9.789
  Start of MODEL    5
 3693    HG   LEU 112           HG       LEU 112  -8.326  -1.184  -7.411
  Start of MODEL    5
 3694   HD12  LEU 112          HD11      LEU 112  -8.771   0.865  -8.681
  Start of MODEL    5
 3695   HD11  LEU 112          HD12      LEU 112  -7.627   0.340  -9.916
  Start of MODEL    5
 3696   HD13  LEU 112          HD13      LEU 112  -7.061   0.697  -8.284
  Start of MODEL    5
 3697   HD22  LEU 112          HD21      LEU 112 -10.187  -1.157  -8.979
  Start of MODEL    5
 3698   HD21  LEU 112          HD22      LEU 112  -9.455  -2.759  -8.902
  Start of MODEL    5
 3699   HD23  LEU 112          HD23      LEU 112  -9.118  -1.702 -10.270
  Start of MODEL    5
 3700    H    GLY 113           H        GLY 113  -5.309  -4.878  -7.135
  Start of MODEL    5
 3701    HA2  GLY 113           HA2      GLY 113  -4.011  -5.997  -9.469
  Start of MODEL    5
 3702    HA3  GLY 113           HA3      GLY 113  -3.028  -4.864  -8.548
  Start of MODEL    5
 3703    H    ALA 114           H        ALA 114  -5.284  -6.574  -6.676
  Start of MODEL    5
 3704    HA   ALA 114           HA       ALA 114  -3.195  -7.842  -5.206
  Start of MODEL    5
 3705    HB3  ALA 114           HB1      ALA 114  -4.939  -8.581  -3.709
  Start of MODEL    5
 3706    HB2  ALA 114           HB2      ALA 114  -6.178  -8.147  -4.885
  Start of MODEL    5
 3707    HB1  ALA 114           HB3      ALA 114  -5.199  -6.890  -4.130
  Start of MODEL    5
 3708    H    LYS 115           H        LYS 115  -2.768 -10.011  -4.947
  Start of MODEL    5
 3709    HA   LYS 115           HA       LYS 115  -3.461 -11.737  -7.147
  Start of MODEL    5
 3710    HB2  LYS 115           HB2      LYS 115  -1.679 -12.006  -4.738
  Start of MODEL    5
 3711    HB3  LYS 115           HB3      LYS 115  -2.013 -13.374  -5.788
  Start of MODEL    5
 3712    HG2  LYS 115           HG2      LYS 115  -1.015 -12.254  -7.665
  Start of MODEL    5
 3713    HG3  LYS 115           HG3      LYS 115  -0.829 -10.768  -6.725
  Start of MODEL    5
 3714    HD2  LYS 115           HD2      LYS 115   1.033 -11.508  -5.706
  Start of MODEL    5
 3715    HD3  LYS 115           HD3      LYS 115   0.379 -13.129  -5.483
  Start of MODEL    5
 3716    HE2  LYS 115           HE2      LYS 115   2.305 -13.251  -6.913
  Start of MODEL    5
 3717    HE3  LYS 115           HE3      LYS 115   0.867 -13.610  -7.859
  Start of MODEL    5
 3718    HZ2  LYS 115           HZ1      LYS 115   2.460 -11.109  -7.854
  Start of MODEL    5
 3719    HZ1  LYS 115           HZ2      LYS 115   0.931 -11.223  -8.575
  Start of MODEL    5
 3720    HZ3  LYS 115           HZ3      LYS 115   2.208 -12.185  -9.144
  Start of MODEL    5
 3721    HA   PRO 116           HA       PRO 116  -6.920 -13.839  -5.417
  Start of MODEL    5
 3722    HB2  PRO 116           HB2      PRO 116  -5.800 -16.289  -6.646
  Start of MODEL    5
 3723    HB3  PRO 116           HB3      PRO 116  -7.347 -15.487  -6.936
  Start of MODEL    5
 3724    HG2  PRO 116           HG2      PRO 116  -5.394 -15.360  -8.737
  Start of MODEL    5
 3725    HG3  PRO 116           HG3      PRO 116  -6.413 -13.945  -8.405
  Start of MODEL    5
 3726    HD2  PRO 116           HD2      PRO 116  -3.642 -14.551  -7.433
  Start of MODEL    5
 3727    HD3  PRO 116           HD3      PRO 116  -4.309 -13.028  -8.056
  Start of MODEL    5
 3728    H    ARG 117           H        ARG 117  -6.636 -16.849  -5.071
  Start of MODEL    5
 3729    HA   ARG 117           HA       ARG 117  -5.995 -16.545  -2.230
  Start of MODEL    5
 3730    HB2  ARG 117           HB2      ARG 117  -8.265 -17.349  -2.830
  Start of MODEL    5
 3731    HB3  ARG 117           HB3      ARG 117  -7.548 -18.724  -3.653
  Start of MODEL    5
 3732    HG2  ARG 117           HG2      ARG 117  -8.304 -19.481  -1.538
  Start of MODEL    5
 3733    HG3  ARG 117           HG3      ARG 117  -6.544 -19.407  -1.462
  Start of MODEL    5
 3734    HD2  ARG 117           HD2      ARG 117  -7.301 -18.479   0.564
  Start of MODEL    5
 3735    HD3  ARG 117           HD3      ARG 117  -6.829 -17.104  -0.434
  Start of MODEL    5
 3736    HE   ARG 117           HE       ARG 117  -9.610 -17.739  -0.687
  Start of MODEL    5
 3737   HH11  ARG 117          HH11      ARG 117  -7.250 -16.081   1.288
  Start of MODEL    5
 3738   HH12  ARG 117          HH12      ARG 117  -8.410 -15.001   1.995
  Start of MODEL    5
 3739   HH21  ARG 117          HH21      ARG 117 -11.163 -16.318   0.234
  Start of MODEL    5
 3740   HH22  ARG 117          HH22      ARG 117 -10.643 -15.137   1.393
  Start of MODEL    5
 3741    H    THR 118           H        THR 118  -3.747 -16.704  -2.488
  Start of MODEL    5
 3742    HA   THR 118           HA       THR 118  -2.812 -19.423  -2.450
  Start of MODEL    5
 3743    HB   THR 118           HB       THR 118  -2.617 -19.098  -4.812
  Start of MODEL    5
 3744    HG1  THR 118           HG1      THR 118  -0.749 -19.974  -3.600
  Start of MODEL    5
 3745   HG23  THR 118          HG21      THR 118  -2.757 -16.654  -4.889
  Start of MODEL    5
 3746   HG22  THR 118          HG22      THR 118  -1.385 -17.242  -5.824
  Start of MODEL    5
 3747   HG21  THR 118          HG23      THR 118  -1.126 -16.537  -4.231
  Start of MODEL    5
 3748    H    ASN 119           H        ASN 119  -1.796 -16.007  -2.541
  Start of MODEL    5
 3749    HA   ASN 119           HA       ASN 119   0.060 -16.587  -0.337
  Start of MODEL    5
 3750    HB2  ASN 119           HB2      ASN 119   1.095 -14.402  -0.857
  Start of MODEL    5
 3751    HB3  ASN 119           HB3      ASN 119   1.132 -15.491  -2.237
  Start of MODEL    5
 3752   HD21  ASN 119          HD21      ASN 119  -0.113 -12.554  -0.934
  Start of MODEL    5
 3753   HD22  ASN 119          HD22      ASN 119  -0.874 -11.990  -2.382
  Start of MODEL    5
 3754    H    VAL 120           H        VAL 120  -2.999 -15.681  -0.795
  Start of MODEL    5
 3755    HA   VAL 120           HA       VAL 120  -3.021 -13.989   1.616
  Start of MODEL    5
 3756    HB   VAL 120           HB       VAL 120  -5.225 -14.154  -0.452
  Start of MODEL    5
 3757    H    GLN 121           H        GLN 121  -2.883 -15.890   2.870
  Start of MODEL    5
 3758    HA   GLN 121           HA       GLN 121  -3.589 -17.683   4.049
  Start of MODEL    5
 3759    HB2  GLN 121           HB2      GLN 121  -5.431 -16.102   4.633
  Start of MODEL    5
 3760    HB3  GLN 121           HB3      GLN 121  -6.375 -16.771   3.308
  Start of MODEL    5
 3761    HG2  GLN 121           HG2      GLN 121  -6.229 -18.993   4.412
  Start of MODEL    5
 3762    HG3  GLN 121           HG3      GLN 121  -5.432 -18.209   5.776
  Start of MODEL    5
 3763   HE21  GLN 121          HE21      GLN 121  -6.611 -16.836   7.100
  Start of MODEL    5
 3764   HE22  GLN 121          HE22      GLN 121  -8.342 -16.855   7.126
  Start of MODEL    5
 3765    H5'   DG   1           H5'       DG   1  21.288  -4.732  -3.479
  Start of MODEL    5
 3766    H4'   DG   1           H4'       DG   1  19.278  -5.264  -5.001
  Start of MODEL    5
 3767    H3'   DG   1           H3'       DG   1  19.165  -2.619  -5.574
  Start of MODEL    5
 3768    H2'   DG   1           H2'       DG   1  18.626  -1.792  -3.398
  Start of MODEL    5
 3769    H1'   DG   1           H1'       DG   1  16.832  -4.228  -2.970
  Start of MODEL    5
 3770    H8    DG   1           H8        DG   1  19.754  -2.354  -1.216
  Start of MODEL    5
 3771    H1    DG   1           H1        DG   1  14.604  -3.675   2.387
  Start of MODEL    5
 3772    H22   DG   1           H21       DG   1  13.362  -5.135  -0.516
  Start of MODEL    5
 3773    H21   DG   1           H22       DG   1  13.095  -4.756   1.168
  Start of MODEL    5
 3774   HO5'   DG   1           H5T       DG   1  20.519  -2.555  -3.065
  Start of MODEL    5
 3775   H5''   DG   1          5H''       DG   1  21.331  -4.267  -5.189
  Start of MODEL    5
 3776   H2''   DG   1          2H''       DG   1  17.004  -2.088  -4.018
  Start of MODEL    5
 3777    H5'   DG   2           H5'       DG   2  15.327  -3.843  -9.552
  Start of MODEL    5
 3778    H4'   DG   2           H4'       DG   2  13.246  -3.174  -9.054
  Start of MODEL    5
 3779    H3'   DG   2           H3'       DG   2  14.241  -1.423 -10.824
  Start of MODEL    5
 3780    H2'   DG   2           H2'       DG   2  15.068   0.148  -9.154
  Start of MODEL    5
 3781    H1'   DG   2           H1'       DG   2  12.337  -0.259  -7.816
  Start of MODEL    5
 3782    H8    DG   2           H8        DG   2  15.958   0.939  -7.323
  Start of MODEL    5
 3783    H1    DG   2           H1        DG   2  11.986   1.819  -2.353
  Start of MODEL    5
 3784    H22   DG   2           H21       DG   2   9.735  -0.022  -4.251
  Start of MODEL    5
 3785    H21   DG   2           H22       DG   2  10.045   0.847  -2.765
  Start of MODEL    5
 3786   H5''   DG   2          5H''       DG   2  16.009  -2.212  -9.402
  Start of MODEL    5
 3787   H2''   DG   2          2H''       DG   2  13.540   0.861  -9.656
  Start of MODEL    5
 3788    H5'   DT   3           H5'       DT   3  11.168  -2.929  -8.827
  Start of MODEL    5
 3789    H4'   DT   3           H4'       DT   3   9.198  -4.599  -8.512
  Start of MODEL    5
 3790    H3'   DT   3           H3'       DT   3   9.640  -5.401 -11.074
  Start of MODEL    5
 3791    H2'   DT   3           H2'       DT   3   8.993  -3.376 -12.182
  Start of MODEL    5
 3792    H1'   DT   3           H1'       DT   3   6.830  -2.958 -10.060
  Start of MODEL    5
 3793    H3    DT   3           H3        DT   3   6.363   0.565 -13.184
  Start of MODEL    5
 3794    H71   DT   3           H71       DT   3   9.738   2.718 -10.876
  Start of MODEL    5
 3795    H73   DT   3           H72       DT   3  10.460   1.429  -9.881
  Start of MODEL    5
 3796    H72   DT   3           H73       DT   3   9.051   2.337  -9.279
  Start of MODEL    5
 3797    H6    DT   3           H6        DT   3   9.212  -0.676  -9.566
  Start of MODEL    5
 3798   H5''   DT   3          5H''       DT   3  11.402  -4.678  -8.938
  Start of MODEL    5
 3799   H2''   DT   3          2H''       DT   3   7.415  -4.146 -12.043
  Start of MODEL    5
 3800    H5'   DG   4           H5'       DG   4   4.623  -7.082  -9.700
  Start of MODEL    5
 3801    H4'   DG   4           H4'       DG   4   5.991  -5.718  -8.381
  Start of MODEL    5
 3802    H3'   DG   4           H3'       DG   4   3.245  -5.656  -7.905
  Start of MODEL    5
 3803    H2'   DG   4           H2'       DG   4   2.894  -3.392  -8.545
  Start of MODEL    5
 3804    H1'   DG   4           H1'       DG   4   5.750  -2.851  -7.560
  Start of MODEL    5
 3805    H8    DG   4           H8        DG   4   6.217  -0.406  -7.839
  Start of MODEL    5
 3806    H1    DG   4           H1        DG   4   2.295   0.100 -12.898
  Start of MODEL    5
 3807    H22   DG   4           H21       DG   4   1.658  -3.270 -12.338
  Start of MODEL    5
 3808    H21   DG   4           H22       DG   4   1.335  -1.852 -13.311
  Start of MODEL    5
 3809   H5''   DG   4          5H''       DG   4   3.697  -5.705 -10.321
  Start of MODEL    5
 3810   H2''   DG   4          2H''       DG   4   3.421  -3.134  -6.883
  Start of MODEL    5
 3811    H5'   DT   5           H5'       DT   5   4.057  -8.550  -3.737
  Start of MODEL    5
 3812    H4'   DT   5           H4'       DT   5   2.857  -7.685  -2.037
  Start of MODEL    5
 3813    H3'   DT   5           H3'       DT   5   1.507  -9.766  -3.042
  Start of MODEL    5
 3814    H2'   DT   5           H2'       DT   5   0.163  -8.494  -4.598
  Start of MODEL    5
 3815    H1'   DT   5           H1'       DT   5  -0.297  -6.513  -2.299
  Start of MODEL    5
 3816    H3    DT   5           H3        DT   5  -3.054  -4.067  -4.830
  Start of MODEL    5
 3817    H71   DT   5           H71       DT   5  -0.214  -4.409  -8.497
  Start of MODEL    5
 3818    H72   DT   5           H72       DT   5   1.018  -3.526  -7.567
  Start of MODEL    5
 3819    H73   DT   5           H73       DT   5   1.209  -5.270  -7.867
  Start of MODEL    5
 3820    H6    DT   5           H6        DT   5   1.194  -6.069  -5.619
  Start of MODEL    5
 3821   H5''   DT   5          5H''       DT   5   2.667  -8.620  -4.837
  Start of MODEL    5
 3822   H2''   DT   5          2H''       DT   5  -0.916  -8.714  -3.238
  Start of MODEL    5
 3823    H5'   DG   6           H5'       DG   6   2.818  -7.291   1.280
  Start of MODEL    5
 3824    H4'   DG   6           H4'       DG   6   3.586  -8.159   3.578
  Start of MODEL    5
 3825    H3'   DG   6           H3'       DG   6   2.023 -10.340   3.151
  Start of MODEL    5
 3826    H2'   DG   6           H2'       DG   6  -0.120  -9.298   3.215
  Start of MODEL    5
 3827    H1'   DG   6           H1'       DG   6   0.863  -7.359   5.362
  Start of MODEL    5
 3828    H8    DG   6           H8        DG   6  -0.981  -7.664   1.976
  Start of MODEL    5
 3829    H1    DG   6           H1        DG   6  -3.299  -3.249   6.032
  Start of MODEL    5
 3830    H22   DG   6           H21       DG   6  -0.640  -4.184   8.052
  Start of MODEL    5
 3831    H21   DG   6           H22       DG   6  -2.040  -3.159   7.839
  Start of MODEL    5
 3832   H5''   DG   6          5H''       DG   6   3.607  -8.872   1.415
  Start of MODEL    5
 3833   H2''   DG   6          2H''       DG   6   0.106  -9.584   4.936
  Start of MODEL    5
 3834    H5'   DC   7           H5'       DC   7   2.212 -12.504   3.386
  Start of MODEL    5
 3835    H4'   DC   7           H4'       DC   7   2.439 -14.611   4.847
  Start of MODEL    5
 3836    H3'   DC   7           H3'       DC   7   0.869 -14.169   2.695
  Start of MODEL    5
 3837   HO3'   DC   7           H3T       DC   7   0.867 -16.435   4.419
  Start of MODEL    5
 3838    H2'   DC   7           H2'       DC   7  -1.102 -13.441   3.809
  Start of MODEL    5
 3839    H1'   DC   7           H1'       DC   7  -0.648 -15.509   6.003
  Start of MODEL    5
 3840    H42   DC   7           H41       DC   7  -4.218 -10.505   8.504
  Start of MODEL    5
 3841    H41   DC   7           H42       DC   7  -5.051 -11.989   8.911
  Start of MODEL    5
 3842    H5    DC   7           H5        DC   7  -2.193 -10.458   7.164
  Start of MODEL    5
 3843    H6    DC   7           H6        DC   7  -0.590 -11.823   5.933
  Start of MODEL    5
 3844   H5''   DC   7          5H''       DC   7   1.172 -11.901   4.693
  Start of MODEL    5
 3845   H2''   DC   7          2H''       DC   7  -1.411 -15.168   3.755
  Start of MODEL    6
 3846    H1   GLY  25           HT1      GLY  25 -14.906  -8.069 -12.187
  Start of MODEL    6
 3847    H2   GLY  25           HT2      GLY  25 -14.080  -9.533 -12.401
  Start of MODEL    6
 3848    H3   GLY  25           HT3      GLY  25 -13.257  -8.064 -12.582
  Start of MODEL    6
 3849    HA3  GLY  25           HA2      GLY  25 -14.461  -9.019 -10.046
  Start of MODEL    6
 3850    HA2  GLY  25           HA3      GLY  25 -13.495  -7.563 -10.263
  Start of MODEL    6
 3851    H    ALA  26           H        ALA  26 -12.355  -8.832  -8.436
  Start of MODEL    6
 3852    HA   ALA  26           HA       ALA  26 -10.340 -10.607  -9.654
  Start of MODEL    6
 3853    HB1  ALA  26           HB1      ALA  26  -9.954  -8.589  -7.450
  Start of MODEL    6
 3854    HB3  ALA  26           HB2      ALA  26  -9.358  -8.467  -9.105
  Start of MODEL    6
 3855    HB2  ALA  26           HB3      ALA  26  -8.728  -9.712  -8.028
  Start of MODEL    6
 3856    H    MET  27           H        MET  27 -10.840  -9.773  -6.247
  Start of MODEL    6
 3857    HA   MET  27           HA       MET  27 -10.979 -12.616  -5.630
  Start of MODEL    6
 3858    HB2  MET  27           HB2      MET  27 -11.275 -10.744  -3.393
  Start of MODEL    6
 3859    HB3  MET  27           HB3      MET  27 -10.171 -12.094  -3.584
  Start of MODEL    6
 3860    HG2  MET  27           HG2      MET  27  -8.822 -10.197  -3.381
  Start of MODEL    6
 3861    HG3  MET  27           HG3      MET  27  -8.808 -10.606  -5.096
  Start of MODEL    6
 3862    HE1  MET  27           HE1      MET  27 -10.347  -8.232  -2.355
  Start of MODEL    6
 3863    HE3  MET  27           HE2      MET  27 -11.784  -8.862  -3.160
  Start of MODEL    6
 3864    HE2  MET  27           HE3      MET  27 -11.348  -7.161  -3.338
  Start of MODEL    6
 3865    H    GLY  28           H        GLY  28 -12.987  -9.783  -5.715
  Start of MODEL    6
 3866    HA2  GLY  28           HA2      GLY  28 -15.416 -10.271  -5.958
  Start of MODEL    6
 3867    HA3  GLY  28           HA3      GLY  28 -15.215 -11.347  -4.579
  Start of MODEL    6
 3868    H    SER  29           H        SER  29 -15.825 -10.543  -2.701
  Start of MODEL    6
 3869    HA   SER  29           HA       SER  29 -15.595  -7.639  -2.276
  Start of MODEL    6
 3870    HB2  SER  29           HB2      SER  29 -17.961  -8.330  -2.634
  Start of MODEL    6
 3871    HB3  SER  29           HB3      SER  29 -17.826  -9.433  -1.266
  Start of MODEL    6
 3872    HG   SER  29           HG       SER  29 -18.595  -7.690  -0.296
  Start of MODEL    6
 3873    H    ARG  30           H        ARG  30 -15.008  -6.977  -0.202
  Start of MODEL    6
 3874    HA   ARG  30           HA       ARG  30 -14.602  -8.824   1.934
  Start of MODEL    6
 3875    HB2  ARG  30           HB2      ARG  30 -12.398  -8.328   0.084
  Start of MODEL    6
 3876    HB3  ARG  30           HB3      ARG  30 -11.992  -7.914   1.744
  Start of MODEL    6
 3877    HG2  ARG  30           HG2      ARG  30 -13.083 -10.574   0.841
  Start of MODEL    6
 3878    HG3  ARG  30           HG3      ARG  30 -11.384 -10.227   1.164
  Start of MODEL    6
 3879    HD2  ARG  30           HD2      ARG  30 -11.926  -9.705   3.489
  Start of MODEL    6
 3880    HD3  ARG  30           HD3      ARG  30 -13.631 -10.012   3.173
  Start of MODEL    6
 3881    HE   ARG  30           HE       ARG  30 -12.052 -12.276   2.501
  Start of MODEL    6
 3882   HH11  ARG  30          HH11      ARG  30 -13.332 -10.517   5.254
  Start of MODEL    6
 3883   HH12  ARG  30          HH12      ARG  30 -13.389 -11.930   6.273
  Start of MODEL    6
 3884   HH21  ARG  30          HH21      ARG  30 -12.131 -14.116   3.830
  Start of MODEL    6
 3885   HH22  ARG  30          HH22      ARG  30 -12.752 -13.985   5.455
  Start of MODEL    6
 3886    H    ASP  31           H        ASP  31 -13.378  -7.771   3.735
  Start of MODEL    6
 3887    HA   ASP  31           HA       ASP  31 -14.591  -5.352   4.469
  Start of MODEL    6
 3888    HB2  ASP  31           HB2      ASP  31 -12.068  -6.458   5.698
  Start of MODEL    6
 3889    HB3  ASP  31           HB3      ASP  31 -13.357  -5.554   6.487
  Start of MODEL    6
 3890    H    THR  32           H        THR  32 -12.183  -5.761   2.305
  Start of MODEL    6
 3891    HA   THR  32           HA       THR  32 -10.844  -3.224   2.951
  Start of MODEL    6
 3892    HB   THR  32           HB       THR  32  -8.766  -4.321   1.880
  Start of MODEL    6
 3893    HG1  THR  32           HG1      THR  32  -9.677  -6.748   2.890
  Start of MODEL    6
 3894   HG22  THR  32          HG21      THR  32  -8.031  -5.203   4.026
  Start of MODEL    6
 3895   HG21  THR  32          HG22      THR  32  -9.704  -5.283   4.583
  Start of MODEL    6
 3896   HG23  THR  32          HG23      THR  32  -8.953  -3.719   4.263
  Start of MODEL    6
 3897    H    MET  33           H        MET  33 -12.850  -4.575   0.819
  Start of MODEL    6
 3898    HA   MET  33           HA       MET  33 -11.749  -4.589  -1.667
  Start of MODEL    6
 3899    HB2  MET  33           HB2      MET  33 -14.077  -5.211  -1.017
  Start of MODEL    6
 3900    HB3  MET  33           HB3      MET  33 -14.492  -3.512  -1.066
  Start of MODEL    6
 3901    HG2  MET  33           HG2      MET  33 -13.869  -3.439  -3.433
  Start of MODEL    6
 3902    HG3  MET  33           HG3      MET  33 -13.502  -5.162  -3.376
  Start of MODEL    6
 3903    HE1  MET  33           HE1      MET  33 -15.086  -5.663  -5.385
  Start of MODEL    6
 3904    HE3  MET  33           HE2      MET  33 -15.457  -3.942  -5.518
  Start of MODEL    6
 3905    HE2  MET  33           HE3      MET  33 -16.765  -5.125  -5.482
  Start of MODEL    6
 3906    H    PHE  34           H        PHE  34 -13.410  -1.680  -0.311
  Start of MODEL    6
 3907    HA   PHE  34           HA       PHE  34 -12.018  -0.137  -2.393
  Start of MODEL    6
 3908    HB2  PHE  34           HB2      PHE  34 -14.581   0.356  -0.894
  Start of MODEL    6
 3909    HB3  PHE  34           HB3      PHE  34 -13.751   1.649  -1.751
  Start of MODEL    6
 3910    HD1  PHE  34           HD1      PHE  34 -15.786  -1.336  -2.062
  Start of MODEL    6
 3911    HD2  PHE  34           HD2      PHE  34 -13.548   1.587  -4.195
  Start of MODEL    6
 3912    HE1  PHE  34           HE1      PHE  34 -16.907  -2.008  -4.142
  Start of MODEL    6
 3913    HE2  PHE  34           HE2      PHE  34 -14.669   0.923  -6.286
  Start of MODEL    6
 3914    HZ   PHE  34           HZ       PHE  34 -16.349  -0.876  -6.260
  Start of MODEL    6
 3915    H    THR  35           H        THR  35 -11.594  -0.907   0.738
  Start of MODEL    6
 3916    HA   THR  35           HA       THR  35 -10.936   1.813   1.626
  Start of MODEL    6
 3917    HB   THR  35           HB       THR  35 -10.754   0.621   3.899
  Start of MODEL    6
 3918    HG1  THR  35           HG1      THR  35 -11.879  -1.358   3.999
  Start of MODEL    6
 3919   HG22  THR  35          HG21      THR  35 -13.201   0.682   4.220
  Start of MODEL    6
 3920   HG21  THR  35          HG22      THR  35 -13.410   0.784   2.470
  Start of MODEL    6
 3921   HG23  THR  35          HG23      THR  35 -12.607   2.092   3.342
  Start of MODEL    6
 3922    H    LYS  36           H        LYS  36  -9.480  -1.140   0.635
  Start of MODEL    6
 3923    HA   LYS  36           HA       LYS  36  -7.011  -0.615   2.064
  Start of MODEL    6
 3924    HB2  LYS  36           HB2      LYS  36  -7.820  -2.888   2.021
  Start of MODEL    6
 3925    HB3  LYS  36           HB3      LYS  36  -7.943  -2.856   0.270
  Start of MODEL    6
 3926    HG2  LYS  36           HG2      LYS  36  -5.512  -2.695   0.102
  Start of MODEL    6
 3927    HG3  LYS  36           HG3      LYS  36  -5.398  -2.744   1.867
  Start of MODEL    6
 3928    HD2  LYS  36           HD2      LYS  36  -6.419  -4.947   1.902
  Start of MODEL    6
 3929    HD3  LYS  36           HD3      LYS  36  -6.644  -4.901   0.154
  Start of MODEL    6
 3930    HE2  LYS  36           HE2      LYS  36  -4.251  -4.875  -0.185
  Start of MODEL    6
 3931    HE3  LYS  36           HE3      LYS  36  -3.981  -4.803   1.556
  Start of MODEL    6
 3932    HZ3  LYS  36           HZ1      LYS  36  -5.030  -6.971   1.762
  Start of MODEL    6
 3933    HZ2  LYS  36           HZ2      LYS  36  -3.685  -7.031   0.739
  Start of MODEL    6
 3934    HZ1  LYS  36           HZ3      LYS  36  -5.245  -7.050   0.088
  Start of MODEL    6
 3935    H    ILE  37           H        ILE  37  -5.652   0.747   1.206
  Start of MODEL    6
 3936    HA   ILE  37           HA       ILE  37  -5.481   1.050  -1.704
  Start of MODEL    6
 3937    HB   ILE  37           HB       ILE  37  -4.340   2.754   0.519
  Start of MODEL    6
 3938   HD12  ILE  37          HD11      ILE  37  -7.068   5.271  -0.073
  Start of MODEL    6
 3939   HD11  ILE  37          HD12      ILE  37  -5.494   5.333  -0.867
  Start of MODEL    6
 3940   HD13  ILE  37          HD13      ILE  37  -5.597   4.984   0.859
  Start of MODEL    6
 3941    H    PHE  38           H        PHE  38  -3.709   0.424  -2.806
  Start of MODEL    6
 3942    HA   PHE  38           HA       PHE  38  -1.505  -0.779  -1.318
  Start of MODEL    6
 3943    HB2  PHE  38           HB2      PHE  38  -2.368  -2.128  -3.134
  Start of MODEL    6
 3944    HB3  PHE  38           HB3      PHE  38  -2.196  -0.791  -4.262
  Start of MODEL    6
 3945    HD1  PHE  38           HD1      PHE  38  -0.295  -0.607  -5.550
  Start of MODEL    6
 3946    HD2  PHE  38           HD2      PHE  38  -0.189  -2.964  -2.010
  Start of MODEL    6
 3947    HE1  PHE  38           HE1      PHE  38   1.967  -1.374  -6.135
  Start of MODEL    6
 3948    HE2  PHE  38           HE2      PHE  38   2.074  -3.733  -2.587
  Start of MODEL    6
 3949    HZ   PHE  38           HZ       PHE  38   3.155  -2.941  -4.652
  Start of MODEL    6
 3950    H    VAL  39           H        VAL  39   0.299   0.361  -0.939
  Start of MODEL    6
 3951    HA   VAL  39           HA       VAL  39   0.754   2.774  -2.546
  Start of MODEL    6
 3952    HB   VAL  39           HB       VAL  39   2.125   2.105   0.055
  Start of MODEL    6
 3953    H    GLY  40           H        GLY  40   2.351   2.727  -3.955
  Start of MODEL    6
 3954    HA2  GLY  40           HA2      GLY  40   4.348   0.560  -3.720
  Start of MODEL    6
 3955    HA3  GLY  40           HA3      GLY  40   3.503   0.847  -5.236
  Start of MODEL    6
 3956    H    GLY  41           H        GLY  41   6.350   0.908  -4.766
  Start of MODEL    6
 3957    HA2  GLY  41           HA2      GLY  41   8.043   2.144  -5.748
  Start of MODEL    6
 3958    HA3  GLY  41           HA3      GLY  41   6.871   3.401  -6.112
  Start of MODEL    6
 3959    H    LEU  42           H        LEU  42   7.179   2.232  -2.874
  Start of MODEL    6
 3960    HA   LEU  42           HA       LEU  42   7.909   4.853  -1.930
  Start of MODEL    6
 3961    HB2  LEU  42           HB2      LEU  42   7.425   2.237  -0.492
  Start of MODEL    6
 3962    HB3  LEU  42           HB3      LEU  42   7.832   3.734   0.323
  Start of MODEL    6
 3963    HG   LEU  42           HG       LEU  42   5.367   3.317  -1.367
  Start of MODEL    6
 3964   HD12  LEU  42          HD11      LEU  42   4.177   3.297   0.772
  Start of MODEL    6
 3965   HD11  LEU  42          HD12      LEU  42   5.719   3.357   1.627
  Start of MODEL    6
 3966   HD13  LEU  42          HD13      LEU  42   5.308   1.949   0.646
  Start of MODEL    6
 3967   HD21  LEU  42          HD21      LEU  42   6.151   5.638  -1.290
  Start of MODEL    6
 3968   HD23  LEU  42          HD22      LEU  42   6.173   5.568   0.473
  Start of MODEL    6
 3969   HD22  LEU  42          HD23      LEU  42   4.645   5.431  -0.395
  Start of MODEL    6
 3970    HA   PRO  43           HA       PRO  43  12.288   4.096  -1.574
  Start of MODEL    6
 3971    HB2  PRO  43           HB2      PRO  43  12.785   5.994   0.333
  Start of MODEL    6
 3972    HB3  PRO  43           HB3      PRO  43  12.629   6.363  -1.388
  Start of MODEL    6
 3973    HG2  PRO  43           HG2      PRO  43  10.626   6.665   0.804
  Start of MODEL    6
 3974    HG3  PRO  43           HG3      PRO  43  10.961   7.738  -0.566
  Start of MODEL    6
 3975    HD2  PRO  43           HD2      PRO  43   8.847   6.046  -0.519
  Start of MODEL    6
 3976    HD3  PRO  43           HD3      PRO  43   9.689   6.491  -2.019
  Start of MODEL    6
 3977    H    TYR  44           H        TYR  44  13.606   3.023  -0.081
  Start of MODEL    6
 3978    HA   TYR  44           HA       TYR  44  12.219   1.397   1.759
  Start of MODEL    6
 3979    HB2  TYR  44           HB2      TYR  44  15.186   1.838   1.409
  Start of MODEL    6
 3980    HB3  TYR  44           HB3      TYR  44  14.480   0.585   2.417
  Start of MODEL    6
 3981    HD1  TYR  44           HD1      TYR  44  12.428  -0.651   0.907
  Start of MODEL    6
 3982    HD2  TYR  44           HD2      TYR  44  16.102   0.961  -0.503
  Start of MODEL    6
 3983    HE1  TYR  44           HE1      TYR  44  12.352  -2.187  -1.017
  Start of MODEL    6
 3984    HE2  TYR  44           HE2      TYR  44  16.038  -0.561  -2.432
  Start of MODEL    6
 3985    HH   TYR  44           HH       TYR  44  13.267  -2.357  -3.270
  Start of MODEL    6
 3986    H    HIS  45           H        HIS  45  13.575   4.515   2.121
  Start of MODEL    6
 3987    HA   HIS  45           HA       HIS  45  13.990   4.445   4.945
  Start of MODEL    6
 3988    HB2  HIS  45           HB2      HIS  45  13.254   6.974   3.485
  Start of MODEL    6
 3989    HB3  HIS  45           HB3      HIS  45  14.315   6.772   4.872
  Start of MODEL    6
 3990    HD1  HIS  45           HD1      HIS  45  16.771   6.509   4.411
  Start of MODEL    6
 3991    HD2  HIS  45           HD2      HIS  45  14.415   6.190   1.003
  Start of MODEL    6
 3992    HE1  HIS  45           HE1      HIS  45  18.379   6.517   2.480
  Start of MODEL    6
 3993    HE2  HIS  45           HE2      HIS  45  16.931   6.378   0.413
  Start of MODEL    6
 3994    H    THR  46           H        THR  46  11.147   4.826   2.973
  Start of MODEL    6
 3995    HA   THR  46           HA       THR  46   9.488   6.266   4.607
  Start of MODEL    6
 3996    HB   THR  46           HB       THR  46   8.745   3.897   2.879
  Start of MODEL    6
 3997    HG1  THR  46           HG1      THR  46   9.698   6.322   2.272
  Start of MODEL    6
 3998   HG23  THR  46          HG21      THR  46   6.921   4.457   4.387
  Start of MODEL    6
 3999   HG22  THR  46          HG22      THR  46   6.523   4.976   2.749
  Start of MODEL    6
 4000   HG21  THR  46          HG23      THR  46   7.045   6.159   3.949
  Start of MODEL    6
 4001    H    SER  47           H        SER  47   8.474   5.944   6.471
  Start of MODEL    6
 4002    HA   SER  47           HA       SER  47   8.555   3.252   7.653
  Start of MODEL    6
 4003    HB2  SER  47           HB2      SER  47   8.432   4.369   9.837
  Start of MODEL    6
 4004    HB3  SER  47           HB3      SER  47   9.814   4.963   8.916
  Start of MODEL    6
 4005    HG   SER  47           HG       SER  47   8.491   6.767   8.310
  Start of MODEL    6
 4006    H    ASP  48           H        ASP  48   6.703   2.704   9.033
  Start of MODEL    6
 4007    HA   ASP  48           HA       ASP  48   4.231   2.939   7.834
  Start of MODEL    6
 4008    HB2  ASP  48           HB2      ASP  48   4.619   2.596  10.809
  Start of MODEL    6
 4009    HB3  ASP  48           HB3      ASP  48   3.328   1.937   9.805
  Start of MODEL    6
 4010    H    LYS  49           H        LYS  49   5.692   4.961  10.294
  Start of MODEL    6
 4011    HA   LYS  49           HA       LYS  49   3.511   6.619  10.868
  Start of MODEL    6
 4012    HB2  LYS  49           HB2      LYS  49   5.484   6.611  12.258
  Start of MODEL    6
 4013    HB3  LYS  49           HB3      LYS  49   6.484   7.151  10.918
  Start of MODEL    6
 4014    HG2  LYS  49           HG2      LYS  49   5.337   9.294  10.899
  Start of MODEL    6
 4015    HG3  LYS  49           HG3      LYS  49   4.284   8.751  12.207
  Start of MODEL    6
 4016    HD2  LYS  49           HD2      LYS  49   7.225   8.606  12.621
  Start of MODEL    6
 4017    HD3  LYS  49           HD3      LYS  49   6.452  10.191  12.670
  Start of MODEL    6
 4018    HE2  LYS  49           HE2      LYS  49   6.625   9.182  14.898
  Start of MODEL    6
 4019    HE3  LYS  49           HE3      LYS  49   4.951   9.448  14.415
  Start of MODEL    6
 4020    HZ1  LYS  49           HZ1      LYS  49   6.344   6.828  14.205
  Start of MODEL    6
 4021    HZ3  LYS  49           HZ2      LYS  49   4.686   7.132  13.970
  Start of MODEL    6
 4022    HZ2  LYS  49           HZ3      LYS  49   5.366   7.287  15.512
  Start of MODEL    6
 4023    H    THR  50           H        THR  50   6.008   6.818   8.375
  Start of MODEL    6
 4024    HA   THR  50           HA       THR  50   5.390   9.365   7.379
  Start of MODEL    6
 4025    HB   THR  50           HB       THR  50   6.434   7.040   5.741
  Start of MODEL    6
 4026    HG1  THR  50           HG1      THR  50   8.022   8.890   7.207
  Start of MODEL    6
 4027   HG23  THR  50          HG21      THR  50   5.879   9.036   4.440
  Start of MODEL    6
 4028   HG22  THR  50          HG22      THR  50   7.624   8.793   4.497
  Start of MODEL    6
 4029   HG21  THR  50          HG23      THR  50   6.874  10.022   5.515
  Start of MODEL    6
 4030    H    LEU  51           H        LEU  51   4.078   6.184   6.598
  Start of MODEL    6
 4031    HA   LEU  51           HA       LEU  51   2.481   7.121   4.400
  Start of MODEL    6
 4032    HB2  LEU  51           HB2      LEU  51   2.363   4.582   6.024
  Start of MODEL    6
 4033    HB3  LEU  51           HB3      LEU  51   1.278   4.919   4.687
  Start of MODEL    6
 4034    HG   LEU  51           HG       LEU  51   4.270   4.593   4.542
  Start of MODEL    6
 4035   HD11  LEU  51          HD11      LEU  51   1.998   2.944   3.443
  Start of MODEL    6
 4036   HD13  LEU  51          HD12      LEU  51   3.067   2.499   4.772
  Start of MODEL    6
 4037   HD12  LEU  51          HD13      LEU  51   3.712   2.661   3.140
  Start of MODEL    6
 4038   HD21  LEU  51          HD21      LEU  51   3.603   6.322   2.995
  Start of MODEL    6
 4039   HD23  LEU  51          HD22      LEU  51   2.289   5.315   2.386
  Start of MODEL    6
 4040   HD22  LEU  51          HD23      LEU  51   3.965   4.842   2.103
  Start of MODEL    6
 4041    H    HIS  52           H        HIS  52   1.886   6.324   7.772
  Start of MODEL    6
 4042    HA   HIS  52           HA       HIS  52  -0.840   6.807   7.887
  Start of MODEL    6
 4043    HB2  HIS  52           HB2      HIS  52   0.504   5.852   9.739
  Start of MODEL    6
 4044    HB3  HIS  52           HB3      HIS  52   1.185   7.445  10.043
  Start of MODEL    6
 4045    HD1  HIS  52           HD1      HIS  52  -0.257   9.115  11.387
  Start of MODEL    6
 4046    HD2  HIS  52           HD2      HIS  52  -2.204   5.543  10.479
  Start of MODEL    6
 4047    HE1  HIS  52           HE1      HIS  52  -2.375   9.118  12.750
  Start of MODEL    6
 4048    HE2  HIS  52           HE2      HIS  52  -3.614   7.028  12.064
  Start of MODEL    6
 4049    H    GLU  53           H        GLU  53   1.754   9.140   8.694
  Start of MODEL    6
 4050    HA   GLU  53           HA       GLU  53   0.086  11.310   9.116
  Start of MODEL    6
 4051    HB2  GLU  53           HB2      GLU  53   2.923  11.345   8.099
  Start of MODEL    6
 4052    HB3  GLU  53           HB3      GLU  53   2.089  12.678   8.873
  Start of MODEL    6
 4053    HG2  GLU  53           HG2      GLU  53   2.853  10.051  10.116
  Start of MODEL    6
 4054    HG3  GLU  53           HG3      GLU  53   3.556  11.630  10.451
  Start of MODEL    6
 4055    H    TYR  54           H        TYR  54   1.600  10.265   6.084
  Start of MODEL    6
 4056    HA   TYR  54           HA       TYR  54   0.890  12.642   4.675
  Start of MODEL    6
 4057    HB2  TYR  54           HB2      TYR  54   2.734  11.041   4.030
  Start of MODEL    6
 4058    HB3  TYR  54           HB3      TYR  54   1.484   9.956   3.430
  Start of MODEL    6
 4059    HD1  TYR  54           HD1      TYR  54   0.393  10.370   1.327
  Start of MODEL    6
 4060    HD2  TYR  54           HD2      TYR  54   3.092  13.237   2.949
  Start of MODEL    6
 4061    HE1  TYR  54           HE1      TYR  54   0.402  11.572  -0.821
  Start of MODEL    6
 4062    HE2  TYR  54           HE2      TYR  54   3.104  14.440   0.807
  Start of MODEL    6
 4063    HH   TYR  54           HH       TYR  54   2.687  13.931  -1.590
  Start of MODEL    6
 4064    H    PHE  55           H        PHE  55  -0.477   9.333   4.535
  Start of MODEL    6
 4065    HA   PHE  55           HA       PHE  55  -2.549  10.107   2.779
  Start of MODEL    6
 4066    HB2  PHE  55           HB2      PHE  55  -2.048   7.628   4.379
  Start of MODEL    6
 4067    HB3  PHE  55           HB3      PHE  55  -3.534   7.833   3.454
  Start of MODEL    6
 4068    HD1  PHE  55           HD1      PHE  55   0.025   7.186   3.321
  Start of MODEL    6
 4069    HD2  PHE  55           HD2      PHE  55  -3.441   8.044   1.002
  Start of MODEL    6
 4070    HE1  PHE  55           HE1      PHE  55   1.199   6.437   1.294
  Start of MODEL    6
 4071    HE2  PHE  55           HE2      PHE  55  -2.274   7.300  -1.024
  Start of MODEL    6
 4072    HZ   PHE  55           HZ       PHE  55   0.028   6.480  -0.893
  Start of MODEL    6
 4073    H    GLU  56           H        GLU  56  -2.364  10.160   6.260
  Start of MODEL    6
 4074    HA   GLU  56           HA       GLU  56  -5.124   9.928   6.779
  Start of MODEL    6
 4075    HB2  GLU  56           HB2      GLU  56  -4.677  10.761   8.979
  Start of MODEL    6
 4076    HB3  GLU  56           HB3      GLU  56  -3.340   9.716   8.509
  Start of MODEL    6
 4077    HG2  GLU  56           HG2      GLU  56  -1.865  11.355   8.762
  Start of MODEL    6
 4078    HG3  GLU  56           HG3      GLU  56  -2.835  12.475   7.805
  Start of MODEL    6
 4079    H    GLN  57           H        GLN  57  -3.295  12.477   5.446
  Start of MODEL    6
 4080    HA   GLN  57           HA       GLN  57  -4.872  14.685   6.219
  Start of MODEL    6
 4081    HB2  GLN  57           HB2      GLN  57  -3.167  14.306   3.754
  Start of MODEL    6
 4082    HB3  GLN  57           HB3      GLN  57  -3.805  15.847   4.314
  Start of MODEL    6
 4083    HG2  GLN  57           HG2      GLN  57  -2.523  15.500   6.436
  Start of MODEL    6
 4084    HG3  GLN  57           HG3      GLN  57  -1.785  14.091   5.680
  Start of MODEL    6
 4085   HE21  GLN  57          HE21      GLN  57  -1.981  17.559   5.697
  Start of MODEL    6
 4086   HE22  GLN  57          HE22      GLN  57  -0.581  17.849   4.718
  Start of MODEL    6
 4087    H    PHE  58           H        PHE  58  -5.657  12.090   4.209
  Start of MODEL    6
 4088    HA   PHE  58           HA       PHE  58  -7.527  13.630   2.587
  Start of MODEL    6
 4089    HB2  PHE  58           HB2      PHE  58  -6.871  10.677   2.658
  Start of MODEL    6
 4090    HB3  PHE  58           HB3      PHE  58  -8.095  11.377   1.608
  Start of MODEL    6
 4091    HD1  PHE  58           HD1      PHE  58  -4.483  11.535   2.433
  Start of MODEL    6
 4092    HD2  PHE  58           HD2      PHE  58  -7.513  12.222  -0.462
  Start of MODEL    6
 4093    HE1  PHE  58           HE1      PHE  58  -2.754  12.026   0.755
  Start of MODEL    6
 4094    HE2  PHE  58           HE2      PHE  58  -5.794  12.721  -2.151
  Start of MODEL    6
 4095    HZ   PHE  58           HZ       PHE  58  -3.407  12.622  -1.547
  Start of MODEL    6
 4096    H    GLY  59           H        GLY  59  -7.494  12.027   5.581
  Start of MODEL    6
 4097    HA2  GLY  59           HA2      GLY  59  -9.963  12.769   6.448
  Start of MODEL    6
 4098    HA3  GLY  59           HA3      GLY  59 -10.275  11.270   5.589
  Start of MODEL    6
 4099    H    ASP  60           H        ASP  60 -10.007   9.422   6.625
  Start of MODEL    6
 4100    HA   ASP  60           HA       ASP  60  -8.409   9.400   9.086
  Start of MODEL    6
 4101    HB2  ASP  60           HB2      ASP  60 -11.239   8.457   8.745
  Start of MODEL    6
 4102    HB3  ASP  60           HB3      ASP  60 -10.192   7.741   9.966
  Start of MODEL    6
 4103    H    ILE  61           H        ILE  61  -7.142   7.698   9.379
  Start of MODEL    6
 4104    HA   ILE  61           HA       ILE  61  -7.293   5.521   7.421
  Start of MODEL    6
 4105    HB   ILE  61           HB       ILE  61  -4.997   6.693   8.971
  Start of MODEL    6
 4106   HD11  ILE  61          HD11      ILE  61  -2.972   6.185   6.792
  Start of MODEL    6
 4107   HD13  ILE  61          HD12      ILE  61  -3.305   7.796   7.426
  Start of MODEL    6
 4108   HD12  ILE  61          HD13      ILE  61  -3.423   7.489   5.695
  Start of MODEL    6
 4109    H    GLU  62           H        GLU  62  -7.612   3.500   8.076
  Start of MODEL    6
 4110    HA   GLU  62           HA       GLU  62  -8.290   2.983  10.836
  Start of MODEL    6
 4111    HB2  GLU  62           HB2      GLU  62  -9.293   2.037   8.551
  Start of MODEL    6
 4112    HB3  GLU  62           HB3      GLU  62  -8.049   0.822   8.792
  Start of MODEL    6
 4113    HG2  GLU  62           HG2      GLU  62 -10.206   0.121   9.676
  Start of MODEL    6
 4114    HG3  GLU  62           HG3      GLU  62  -8.979   0.234  10.938
  Start of MODEL    6
 4115    H    GLU  63           H        GLU  63  -5.842   2.041   8.478
  Start of MODEL    6
 4116    HA   GLU  63           HA       GLU  63  -3.847   1.681  10.523
  Start of MODEL    6
 4117    HB2  GLU  63           HB2      GLU  63  -4.871  -0.517  10.621
  Start of MODEL    6
 4118    HB3  GLU  63           HB3      GLU  63  -4.767  -0.681   8.875
  Start of MODEL    6
 4119    HG2  GLU  63           HG2      GLU  63  -2.327  -0.697   9.017
  Start of MODEL    6
 4120    HG3  GLU  63           HG3      GLU  63  -2.431  -0.524  10.770
  Start of MODEL    6
 4121    H    ALA  64           H        ALA  64  -1.791   1.992   9.719
  Start of MODEL    6
 4122    HA   ALA  64           HA       ALA  64  -1.437   2.011   6.813
  Start of MODEL    6
 4123    HB1  ALA  64           HB1      ALA  64  -0.655   4.302   8.619
  Start of MODEL    6
 4124    HB3  ALA  64           HB2      ALA  64  -1.913   4.328   7.384
  Start of MODEL    6
 4125    HB2  ALA  64           HB3      ALA  64  -0.223   4.149   6.918
  Start of MODEL    6
 4126    H    VAL  65           H        VAL  65   0.196   0.704   6.392
  Start of MODEL    6
 4127    HA   VAL  65           HA       VAL  65   2.511   0.684   8.201
  Start of MODEL    6
 4128    HB   VAL  65           HB       VAL  65   2.657  -1.775   8.111
  Start of MODEL    6
 4129    H    VAL  66           H        VAL  66   4.466   0.027   7.292
  Start of MODEL    6
 4130    HA   VAL  66           HA       VAL  66   4.531  -0.081   4.343
  Start of MODEL    6
 4131    HB   VAL  66           HB       VAL  66   6.835   0.178   6.298
  Start of MODEL    6
 4132    H    ILE  67           H        ILE  67   5.307  -1.925   3.278
  Start of MODEL    6
 4133    HA   ILE  67           HA       ILE  67   4.891  -4.284   4.931
  Start of MODEL    6
 4134    HB   ILE  67           HB       ILE  67   4.844  -3.913   1.942
  Start of MODEL    6
 4135   HD13  ILE  67          HD11      ILE  67   2.697  -5.650   4.530
  Start of MODEL    6
 4136   HD12  ILE  67          HD12      ILE  67   1.460  -4.396   4.475
  Start of MODEL    6
 4137   HD11  ILE  67          HD13      ILE  67   3.038  -4.047   5.179
  Start of MODEL    6
 4138    H    THR  68           H        THR  68   6.381  -5.601   5.468
  Start of MODEL    6
 4139    HA   THR  68           HA       THR  68   9.018  -5.450   4.172
  Start of MODEL    6
 4140    HB   THR  68           HB       THR  68   9.996  -5.993   6.385
  Start of MODEL    6
 4141    HG1  THR  68           HG1      THR  68   8.368  -6.977   7.493
  Start of MODEL    6
 4142   HG23  THR  68          HG21      THR  68   9.775  -3.623   5.685
  Start of MODEL    6
 4143   HG22  THR  68          HG22      THR  68   9.701  -3.825   7.436
  Start of MODEL    6
 4144   HG21  THR  68          HG23      THR  68   8.220  -3.545   6.517
  Start of MODEL    6
 4145    H    ASP  69           H        ASP  69  10.139  -7.492   3.958
  Start of MODEL    6
 4146    HA   ASP  69           HA       ASP  69   8.720  -9.837   3.707
  Start of MODEL    6
 4147    HB2  ASP  69           HB2      ASP  69  10.906  -9.734   2.778
  Start of MODEL    6
 4148    HB3  ASP  69           HB3      ASP  69  11.624  -9.280   4.320
  Start of MODEL    6
 4149    H    ARG  70           H        ARG  70   7.827 -11.190   5.104
  Start of MODEL    6
 4150    HA   ARG  70           HA       ARG  70   7.507 -10.527   7.777
  Start of MODEL    6
 4151    HB2  ARG  70           HB2      ARG  70   5.992 -11.959   6.371
  Start of MODEL    6
 4152    HB3  ARG  70           HB3      ARG  70   7.119 -13.283   6.615
  Start of MODEL    6
 4153    HG2  ARG  70           HG2      ARG  70   5.254 -13.462   8.142
  Start of MODEL    6
 4154    HG3  ARG  70           HG3      ARG  70   6.753 -13.158   9.027
  Start of MODEL    6
 4155    HD2  ARG  70           HD2      ARG  70   6.187 -10.851   9.321
  Start of MODEL    6
 4156    HD3  ARG  70           HD3      ARG  70   4.791 -11.003   8.253
  Start of MODEL    6
 4157    HE   ARG  70           HE       ARG  70   4.564 -12.813  10.411
  Start of MODEL    6
 4158   HH11  ARG  70          HH11      ARG  70   4.374  -9.372   9.754
  Start of MODEL    6
 4159   HH12  ARG  70          HH12      ARG  70   3.214  -9.071  11.014
  Start of MODEL    6
 4160   HH21  ARG  70          HH21      ARG  70   3.062 -12.421  12.044
  Start of MODEL    6
 4161   HH22  ARG  70          HH22      ARG  70   2.455 -10.814  12.305
  Start of MODEL    6
 4162    H    ASN  71           H        ASN  71  10.083 -12.297   6.341
  Start of MODEL    6
 4163    HA   ASN  71           HA       ASN  71  10.748 -13.680   8.820
  Start of MODEL    6
 4164    HB2  ASN  71           HB2      ASN  71  11.976 -13.773   6.067
  Start of MODEL    6
 4165    HB3  ASN  71           HB3      ASN  71  12.626 -14.653   7.448
  Start of MODEL    6
 4166   HD21  ASN  71          HD21      ASN  71   9.986 -15.203   8.557
  Start of MODEL    6
 4167   HD22  ASN  71          HD22      ASN  71   9.297 -16.436   7.562
  Start of MODEL    6
 4168    H    THR  72           H        THR  72  12.374 -11.419   6.591
  Start of MODEL    6
 4169    HA   THR  72           HA       THR  72  14.448 -10.948   8.590
  Start of MODEL    6
 4170    HB   THR  72           HB       THR  72  15.478  -9.547   6.770
  Start of MODEL    6
 4171    HG1  THR  72           HG1      THR  72  13.297 -10.624   5.258
  Start of MODEL    6
 4172   HG21  THR  72          HG21      THR  72  14.816 -12.423   6.124
  Start of MODEL    6
 4173   HG23  THR  72          HG22      THR  72  16.189 -11.841   7.071
  Start of MODEL    6
 4174   HG22  THR  72          HG23      THR  72  16.090 -11.482   5.347
  Start of MODEL    6
 4175    H    GLN  73           H        GLN  73  11.587  -9.519   7.446
  Start of MODEL    6
 4176    HA   GLN  73           HA       GLN  73  10.385  -7.713   8.122
  Start of MODEL    6
 4177    HB2  GLN  73           HB2      GLN  73  12.467  -7.560  10.307
  Start of MODEL    6
 4178    HB3  GLN  73           HB3      GLN  73  10.941  -6.680  10.299
  Start of MODEL    6
 4179    HG2  GLN  73           HG2      GLN  73   9.712  -8.775  10.336
  Start of MODEL    6
 4180    HG3  GLN  73           HG3      GLN  73  11.224  -9.678  10.274
  Start of MODEL    6
 4181   HE21  GLN  73          HE21      GLN  73  12.566  -7.807  12.077
  Start of MODEL    6
 4182   HE22  GLN  73          HE22      GLN  73  11.957  -8.152  13.657
  Start of MODEL    6
 4183    H    LYS  74           H        LYS  74  12.418  -7.481   6.178
  Start of MODEL    6
 4184    HA   LYS  74           HA       LYS  74  13.425  -4.746   6.520
  Start of MODEL    6
 4185    HB2  LYS  74           HB2      LYS  74  14.129  -6.862   4.477
  Start of MODEL    6
 4186    HB3  LYS  74           HB3      LYS  74  14.826  -5.247   4.533
  Start of MODEL    6
 4187    HG2  LYS  74           HG2      LYS  74  15.055  -7.315   6.714
  Start of MODEL    6
 4188    HG3  LYS  74           HG3      LYS  74  16.304  -6.937   5.528
  Start of MODEL    6
 4189    HD2  LYS  74           HD2      LYS  74  16.472  -4.676   6.382
  Start of MODEL    6
 4190    HD3  LYS  74           HD3      LYS  74  15.140  -4.973   7.501
  Start of MODEL    6
 4191    HE2  LYS  74           HE2      LYS  74  17.333  -5.101   8.606
  Start of MODEL    6
 4192    HE3  LYS  74           HE3      LYS  74  16.457  -6.630   8.679
  Start of MODEL    6
 4193    HZ3  LYS  74           HZ1      LYS  74  17.811  -7.510   6.930
  Start of MODEL    6
 4194    HZ2  LYS  74           HZ2      LYS  74  18.839  -6.867   8.116
  Start of MODEL    6
 4195    HZ1  LYS  74           HZ3      LYS  74  18.564  -6.014   6.674
  Start of MODEL    6
 4196    H    SER  75           H        SER  75  12.821  -3.112   5.128
  Start of MODEL    6
 4197    HA   SER  75           HA       SER  75  10.229  -3.207   4.120
  Start of MODEL    6
 4198    HB2  SER  75           HB2      SER  75  11.378  -1.133   4.791
  Start of MODEL    6
 4199    HB3  SER  75           HB3      SER  75  12.433  -1.267   3.387
  Start of MODEL    6
 4200    HG   SER  75           HG       SER  75  10.253   0.025   3.417
  Start of MODEL    6
 4201    H    ARG  76           H        ARG  76   9.337  -3.665   2.236
  Start of MODEL    6
 4202    HA   ARG  76           HA       ARG  76  11.060  -4.629   0.075
  Start of MODEL    6
 4203    HB2  ARG  76           HB2      ARG  76   8.055  -4.843   0.382
  Start of MODEL    6
 4204    HB3  ARG  76           HB3      ARG  76   9.034  -5.638  -0.841
  Start of MODEL    6
 4205    HG2  ARG  76           HG2      ARG  76  10.187  -6.896   0.940
  Start of MODEL    6
 4206    HG3  ARG  76           HG3      ARG  76   9.120  -6.138   2.124
  Start of MODEL    6
 4207    HD2  ARG  76           HD2      ARG  76   8.277  -8.321   1.593
  Start of MODEL    6
 4208    HD3  ARG  76           HD3      ARG  76   7.181  -7.107   0.935
  Start of MODEL    6
 4209    HE   ARG  76           HE       ARG  76   8.910  -7.714  -1.111
  Start of MODEL    6
 4210   HH11  ARG  76          HH11      ARG  76   6.682  -9.500   0.895
  Start of MODEL    6
 4211   HH12  ARG  76          HH12      ARG  76   6.347 -10.696  -0.311
  Start of MODEL    6
 4212   HH21  ARG  76          HH21      ARG  76   8.459  -9.273  -2.730
  Start of MODEL    6
 4213   HH22  ARG  76          HH22      ARG  76   7.335 -10.561  -2.380
  Start of MODEL    6
 4214    H    GLY  77           H        GLY  77  10.193  -1.809   0.982
  Start of MODEL    6
 4215    HA2  GLY  77           HA2      GLY  77  10.096   0.221  -0.098
  Start of MODEL    6
 4216    HA3  GLY  77           HA3      GLY  77  10.301  -0.653  -1.603
  Start of MODEL    6
 4217    H    TYR  78           H        TYR  78   7.592  -1.482   0.382
  Start of MODEL    6
 4218    HA   TYR  78           HA       TYR  78   5.871   0.507  -0.763
  Start of MODEL    6
 4219    HB2  TYR  78           HB2      TYR  78   4.330  -1.035  -1.873
  Start of MODEL    6
 4220    HB3  TYR  78           HB3      TYR  78   5.922  -1.099  -2.614
  Start of MODEL    6
 4221    HD1  TYR  78           HD1      TYR  78   3.435  -2.935  -0.659
  Start of MODEL    6
 4222    HD2  TYR  78           HD2      TYR  78   7.298  -3.100  -2.437
  Start of MODEL    6
 4223    HE1  TYR  78           HE1      TYR  78   3.460  -5.369  -0.363
  Start of MODEL    6
 4224    HE2  TYR  78           HE2      TYR  78   7.329  -5.542  -2.147
  Start of MODEL    6
 4225    HH   TYR  78           HH       TYR  78   6.239  -7.223  -0.642
  Start of MODEL    6
 4226    H    GLY  79           H        GLY  79   3.523   0.038  -0.030
  Start of MODEL    6
 4227    HA2  GLY  79           HA2      GLY  79   3.437  -1.399   2.489
  Start of MODEL    6
 4228    HA3  GLY  79           HA3      GLY  79   3.372   0.348   2.627
  Start of MODEL    6
 4229    H    PHE  80           H        PHE  80   1.299  -0.527   3.691
  Start of MODEL    6
 4230    HA   PHE  80           HA       PHE  80  -0.801  -0.304   1.660
  Start of MODEL    6
 4231    HB2  PHE  80           HB2      PHE  80  -0.652  -2.305   3.901
  Start of MODEL    6
 4232    HB3  PHE  80           HB3      PHE  80  -2.200  -1.808   3.224
  Start of MODEL    6
 4233    HD1  PHE  80           HD1      PHE  80   0.690  -3.885   2.812
  Start of MODEL    6
 4234    HD2  PHE  80           HD2      PHE  80  -2.626  -2.165   0.785
  Start of MODEL    6
 4235    HE1  PHE  80           HE1      PHE  80   0.968  -5.511   0.988
  Start of MODEL    6
 4236    HE2  PHE  80           HE2      PHE  80  -2.361  -3.788  -1.040
  Start of MODEL    6
 4237    HZ   PHE  80           HZ       PHE  80  -0.558  -5.467  -0.940
  Start of MODEL    6
 4238    H    VAL  81           H        VAL  81  -2.343   1.038   2.084
  Start of MODEL    6
 4239    HA   VAL  81           HA       VAL  81  -2.626   2.076   4.823
  Start of MODEL    6
 4240    HB   VAL  81           HB       VAL  81  -2.809   3.624   2.238
  Start of MODEL    6
 4241    H    THR  82           H        THR  82  -4.491   1.634   5.696
  Start of MODEL    6
 4242    HA   THR  82           HA       THR  82  -6.723   0.926   3.918
  Start of MODEL    6
 4243    HB   THR  82           HB       THR  82  -6.445   0.168   6.839
  Start of MODEL    6
 4244    HG1  THR  82           HG1      THR  82  -5.021  -0.746   4.799
  Start of MODEL    6
 4245   HG21  THR  82          HG21      THR  82  -8.715   0.123   5.808
  Start of MODEL    6
 4246   HG23  THR  82          HG22      THR  82  -8.156  -1.465   6.334
  Start of MODEL    6
 4247   HG22  THR  82          HG23      THR  82  -8.112  -1.035   4.624
  Start of MODEL    6
 4248    H    MET  83           H        MET  83  -8.037   2.618   3.729
  Start of MODEL    6
 4249    HA   MET  83           HA       MET  83  -8.014   4.692   5.732
  Start of MODEL    6
 4250    HB2  MET  83           HB2      MET  83  -9.641   4.469   3.188
  Start of MODEL    6
 4251    HB3  MET  83           HB3      MET  83  -9.490   5.905   4.195
  Start of MODEL    6
 4252    HG2  MET  83           HG2      MET  83  -7.215   4.565   2.750
  Start of MODEL    6
 4253    HG3  MET  83           HG3      MET  83  -8.095   5.975   2.173
  Start of MODEL    6
 4254    HE1  MET  83           HE1      MET  83  -8.534   7.811   4.638
  Start of MODEL    6
 4255    HE3  MET  83           HE2      MET  83  -7.862   8.372   3.105
  Start of MODEL    6
 4256    HE2  MET  83           HE3      MET  83  -7.054   8.775   4.620
  Start of MODEL    6
 4257    H    LYS  84           H        LYS  84  -9.721   5.326   6.972
  Start of MODEL    6
 4258    HA   LYS  84           HA       LYS  84 -11.405   3.254   7.926
  Start of MODEL    6
 4259    HB2  LYS  84           HB2      LYS  84 -10.504   5.087   9.336
  Start of MODEL    6
 4260    HB3  LYS  84           HB3      LYS  84 -11.521   6.229   8.472
  Start of MODEL    6
 4261    HG2  LYS  84           HG2      LYS  84 -13.494   5.312   9.381
  Start of MODEL    6
 4262    HG3  LYS  84           HG3      LYS  84 -12.642   3.888   9.975
  Start of MODEL    6
 4263    HD2  LYS  84           HD2      LYS  84 -12.006   6.662  10.945
  Start of MODEL    6
 4264    HD3  LYS  84           HD3      LYS  84 -13.264   5.674  11.685
  Start of MODEL    6
 4265    HE2  LYS  84           HE2      LYS  84 -11.426   5.222  13.025
  Start of MODEL    6
 4266    HE3  LYS  84           HE3      LYS  84 -11.399   3.880  11.884
  Start of MODEL    6
 4267    HZ2  LYS  84           HZ1      LYS  84  -9.208   4.775  12.197
  Start of MODEL    6
 4268    HZ1  LYS  84           HZ2      LYS  84  -9.720   6.324  11.746
  Start of MODEL    6
 4269    HZ3  LYS  84           HZ3      LYS  84  -9.716   5.068  10.615
  Start of MODEL    6
 4270    H    ASP  85           H        ASP  85 -11.674   5.451   5.356
  Start of MODEL    6
 4271    HA   ASP  85           HA       ASP  85 -14.461   4.703   4.939
  Start of MODEL    6
 4272    HB2  ASP  85           HB2      ASP  85 -15.003   6.782   5.723
  Start of MODEL    6
 4273    HB3  ASP  85           HB3      ASP  85 -13.419   7.449   5.364
  Start of MODEL    6
 4274    H    ARG  86           H        ARG  86 -15.068   4.533   2.816
  Start of MODEL    6
 4275    HA   ARG  86           HA       ARG  86 -13.151   3.916   0.897
  Start of MODEL    6
 4276    HB2  ARG  86           HB2      ARG  86 -15.305   2.928   0.781
  Start of MODEL    6
 4277    HB3  ARG  86           HB3      ARG  86 -16.101   4.490   0.729
  Start of MODEL    6
 4278    HG2  ARG  86           HG2      ARG  86 -15.157   4.871  -1.515
  Start of MODEL    6
 4279    HG3  ARG  86           HG3      ARG  86 -14.429   3.267  -1.460
  Start of MODEL    6
 4280    HD2  ARG  86           HD2      ARG  86 -16.617   2.243  -1.285
  Start of MODEL    6
 4281    HD3  ARG  86           HD3      ARG  86 -17.384   3.829  -1.220
  Start of MODEL    6
 4282    HE   ARG  86           HE       ARG  86 -15.906   3.732  -3.579
  Start of MODEL    6
 4283   HH11  ARG  86          HH11      ARG  86 -18.668   2.104  -2.158
  Start of MODEL    6
 4284   HH12  ARG  86          HH12      ARG  86 -19.417   1.763  -3.688
  Start of MODEL    6
 4285   HH21  ARG  86          HH21      ARG  86 -16.879   3.262  -5.591
  Start of MODEL    6
 4286   HH22  ARG  86          HH22      ARG  86 -18.390   2.412  -5.632
  Start of MODEL    6
 4287    H    ALA  87           H        ALA  87 -15.041   6.887   1.315
  Start of MODEL    6
 4288    HA   ALA  87           HA       ALA  87 -14.365   8.009  -1.198
  Start of MODEL    6
 4289    HB3  ALA  87           HB1      ALA  87 -16.276   8.806   0.058
  Start of MODEL    6
 4290    HB2  ALA  87           HB2      ALA  87 -15.155  10.135  -0.249
  Start of MODEL    6
 4291    HB1  ALA  87           HB3      ALA  87 -15.218   9.382   1.346
  Start of MODEL    6
 4292    H    SER  88           H        SER  88 -12.932   8.292   2.007
  Start of MODEL    6
 4293    HA   SER  88           HA       SER  88 -10.984  10.225   1.352
  Start of MODEL    6
 4294    HB2  SER  88           HB2      SER  88 -10.817   8.027   3.431
  Start of MODEL    6
 4295    HB3  SER  88           HB3      SER  88  -9.878   9.520   3.407
  Start of MODEL    6
 4296    HG   SER  88           HG       SER  88 -12.706   9.303   3.674
  Start of MODEL    6
 4297    H    ALA  89           H        ALA  89 -11.010   6.698   1.219
  Start of MODEL    6
 4298    HA   ALA  89           HA       ALA  89  -8.337   6.306   0.457
  Start of MODEL    6
 4299    HB3  ALA  89           HB1      ALA  89  -9.821   4.511   1.260
  Start of MODEL    6
 4300    HB2  ALA  89           HB2      ALA  89  -9.052   4.104  -0.273
  Start of MODEL    6
 4301    HB1  ALA  89           HB3      ALA  89 -10.737   4.618  -0.243
  Start of MODEL    6
 4302    H    GLU  90           H        GLU  90 -11.264   6.873  -1.439
  Start of MODEL    6
 4303    HA   GLU  90           HA       GLU  90 -10.068   6.418  -3.954
  Start of MODEL    6
 4304    HB2  GLU  90           HB2      GLU  90 -12.597   6.596  -3.162
  Start of MODEL    6
 4305    HB3  GLU  90           HB3      GLU  90 -12.397   8.234  -3.777
  Start of MODEL    6
 4306    HG2  GLU  90           HG2      GLU  90 -11.517   5.893  -5.392
  Start of MODEL    6
 4307    HG3  GLU  90           HG3      GLU  90 -13.213   6.368  -5.356
  Start of MODEL    6
 4308    H    ARG  91           H        ARG  91 -10.569   9.361  -2.024
  Start of MODEL    6
 4309    HA   ARG  91           HA       ARG  91  -9.735  11.192  -3.939
  Start of MODEL    6
 4310    HB2  ARG  91           HB2      ARG  91  -9.146  11.315  -0.981
  Start of MODEL    6
 4311    HB3  ARG  91           HB3      ARG  91  -9.149  12.673  -2.097
  Start of MODEL    6
 4312    HG2  ARG  91           HG2      ARG  91 -11.567  12.291  -2.469
  Start of MODEL    6
 4313    HG3  ARG  91           HG3      ARG  91 -11.515  11.038  -1.219
  Start of MODEL    6
 4314    HD2  ARG  91           HD2      ARG  91 -10.526  12.802   0.294
  Start of MODEL    6
 4315    HD3  ARG  91           HD3      ARG  91 -10.985  13.980  -0.929
  Start of MODEL    6
 4316    HE   ARG  91           HE       ARG  91 -13.041  12.211   0.171
  Start of MODEL    6
 4317   HH11  ARG  91          HH11      ARG  91 -11.679  15.403  -0.178
  Start of MODEL    6
 4318   HH12  ARG  91          HH12      ARG  91 -13.039  16.217   0.536
  Start of MODEL    6
 4319   HH21  ARG  91          HH21      ARG  91 -14.844  13.268   1.122
  Start of MODEL    6
 4320   HH22  ARG  91          HH22      ARG  91 -14.856  15.000   1.248
  Start of MODEL    6
 4321    H    ALA  92           H        ALA  92  -7.917   9.276  -1.630
  Start of MODEL    6
 4322    HA   ALA  92           HA       ALA  92  -5.347  10.203  -2.236
  Start of MODEL    6
 4323    HB2  ALA  92           HB1      ALA  92  -4.540   8.178  -1.178
  Start of MODEL    6
 4324    HB1  ALA  92           HB2      ALA  92  -6.139   7.447  -1.309
  Start of MODEL    6
 4325    HB3  ALA  92           HB3      ALA  92  -5.894   8.845  -0.262
  Start of MODEL    6
 4326    H    CYS  93           H        CYS  93  -7.329   7.681  -3.775
  Start of MODEL    6
 4327    HA   CYS  93           HA       CYS  93  -5.139   6.767  -5.399
  Start of MODEL    6
 4328    HB2  CYS  93           HB2      CYS  93  -8.085   6.094  -5.509
  Start of MODEL    6
 4329    HB3  CYS  93           HB3      CYS  93  -6.804   5.248  -6.374
  Start of MODEL    6
 4330    HG   CYS  93           HG       CYS  93  -7.170   5.377  -2.971
  Start of MODEL    6
 4331    H    LYS  94           H        LYS  94  -7.285   9.374  -5.639
  Start of MODEL    6
 4332    HA   LYS  94           HA       LYS  94  -7.691   9.339  -8.455
  Start of MODEL    6
 4333    HB2  LYS  94           HB2      LYS  94  -9.119  10.538  -6.762
  Start of MODEL    6
 4334    HB3  LYS  94           HB3      LYS  94  -7.828  11.719  -6.607
  Start of MODEL    6
 4335    HG2  LYS  94           HG2      LYS  94  -9.662  12.437  -8.099
  Start of MODEL    6
 4336    HG3  LYS  94           HG3      LYS  94  -8.083  12.406  -8.880
  Start of MODEL    6
 4337    HD2  LYS  94           HD2      LYS  94  -9.951  11.489 -10.267
  Start of MODEL    6
 4338    HD3  LYS  94           HD3      LYS  94  -8.601  10.380 -10.032
  Start of MODEL    6
 4339    HE2  LYS  94           HE2      LYS  94 -10.779   9.259  -9.823
  Start of MODEL    6
 4340    HE3  LYS  94           HE3      LYS  94  -9.845   9.182  -8.331
  Start of MODEL    6
 4341    HZ3  LYS  94           HZ1      LYS  94 -12.080   9.692  -7.781
  Start of MODEL    6
 4342    HZ2  LYS  94           HZ2      LYS  94 -12.149  10.957  -8.916
  Start of MODEL    6
 4343    HZ1  LYS  94           HZ3      LYS  94 -11.171  11.101  -7.543
  Start of MODEL    6
 4344    H    ASP  95           H        ASP  95  -5.279  10.758  -6.326
  Start of MODEL    6
 4345    HA   ASP  95           HA       ASP  95  -3.755  11.541  -8.720
  Start of MODEL    6
 4346    HB2  ASP  95           HB2      ASP  95  -4.098  13.259  -6.866
  Start of MODEL    6
 4347    HB3  ASP  95           HB3      ASP  95  -3.062  12.246  -5.865
  Start of MODEL    6
 4348    HA   PRO  96           HA       PRO  96  -2.157   7.465  -7.519
  Start of MODEL    6
 4349    HB2  PRO  96           HB2      PRO  96  -1.126   6.832  -9.950
  Start of MODEL    6
 4350    HB3  PRO  96           HB3      PRO  96  -2.842   6.673  -9.551
  Start of MODEL    6
 4351    HG2  PRO  96           HG2      PRO  96  -1.441   8.846 -11.056
  Start of MODEL    6
 4352    HG3  PRO  96           HG3      PRO  96  -3.004   8.074 -11.393
  Start of MODEL    6
 4353    HD2  PRO  96           HD2      PRO  96  -2.781  10.500 -10.186
  Start of MODEL    6
 4354    HD3  PRO  96           HD3      PRO  96  -4.121   9.384  -9.867
  Start of MODEL    6
 4355    H    ASN  97           H        ASN  97  -0.488  10.301  -8.246
  Start of MODEL    6
 4356    HA   ASN  97           HA       ASN  97   2.097   8.930  -7.836
  Start of MODEL    6
 4357    HB2  ASN  97           HB2      ASN  97   1.511  11.247  -9.683
  Start of MODEL    6
 4358    HB3  ASN  97           HB3      ASN  97   3.126  10.665  -9.304
  Start of MODEL    6
 4359   HD21  ASN  97          HD21      ASN  97   2.414   7.874  -9.274
  Start of MODEL    6
 4360   HD22  ASN  97          HD22      ASN  97   2.129   7.423 -10.919
  Start of MODEL    6
 4361    HA   PRO  98           HA       PRO  98   1.647  12.491  -4.774
  Start of MODEL    6
 4362    HB2  PRO  98           HB2      PRO  98   1.716  10.516  -2.642
  Start of MODEL    6
 4363    HB3  PRO  98           HB3      PRO  98   0.490  11.742  -2.980
  Start of MODEL    6
 4364    HG2  PRO  98           HG2      PRO  98   0.054   9.075  -3.284
  Start of MODEL    6
 4365    HG3  PRO  98           HG3      PRO  98  -0.774  10.312  -4.246
  Start of MODEL    6
 4366    HD2  PRO  98           HD2      PRO  98   1.569   8.596  -4.977
  Start of MODEL    6
 4367    HD3  PRO  98           HD3      PRO  98   0.161   9.059  -5.957
  Start of MODEL    6
 4368    H    ILE  99           H        ILE  99   3.460  13.380  -3.895
  Start of MODEL    6
 4369    HA   ILE  99           HA       ILE  99   5.926  11.887  -3.927
  Start of MODEL    6
 4370    HB   ILE  99           HB       ILE  99   5.363  14.700  -2.967
  Start of MODEL    6
 4371   HD13  ILE  99          HD11      ILE  99   7.840  13.497  -5.512
  Start of MODEL    6
 4372   HD12  ILE  99          HD12      ILE  99   6.810  13.879  -6.890
  Start of MODEL    6
 4373   HD11  ILE  99          HD13      ILE  99   6.424  12.507  -5.853
  Start of MODEL    6
 4374    H    ILE 100           H        ILE 100   6.399  10.519  -2.350
  Start of MODEL    6
 4375    HA   ILE 100           HA       ILE 100   5.690  11.244   0.420
  Start of MODEL    6
 4376    HB   ILE 100           HB       ILE 100   5.815   8.458  -0.762
  Start of MODEL    6
 4377   HD12  ILE 100          HD11      ILE 100   2.081   8.257  -0.750
  Start of MODEL    6
 4378   HD11  ILE 100          HD12      ILE 100   3.105   7.667   0.558
  Start of MODEL    6
 4379   HD13  ILE 100          HD13      ILE 100   3.546   7.352  -1.119
  Start of MODEL    6
 4380    H    ASP 101           H        ASP 101   7.427  11.623   1.586
  Start of MODEL    6
 4381    HA   ASP 101           HA       ASP 101   9.520  11.548   2.471
  Start of MODEL    6
 4382    HB2  ASP 101           HB2      ASP 101   8.842   9.195   2.912
  Start of MODEL    6
 4383    HB3  ASP 101           HB3      ASP 101   9.567   8.720   1.381
  Start of MODEL    6
 4384    H    GLY 102           H        GLY 102   9.240  12.685  -0.051
  Start of MODEL    6
 4385    HA2  GLY 102           HA2      GLY 102  10.655  13.689  -1.557
  Start of MODEL    6
 4386    HA3  GLY 102           HA3      GLY 102  11.981  12.799  -0.825
  Start of MODEL    6
 4387    H    ARG 103           H        ARG 103   9.458  10.754  -1.827
  Start of MODEL    6
 4388    HA   ARG 103           HA       ARG 103  10.620  10.469  -4.508
  Start of MODEL    6
 4389    HB2  ARG 103           HB2      ARG 103  11.638   8.722  -3.192
  Start of MODEL    6
 4390    HB3  ARG 103           HB3      ARG 103  10.073   8.229  -2.554
  Start of MODEL    6
 4391    HG2  ARG 103           HG2      ARG 103   9.404   7.326  -4.633
  Start of MODEL    6
 4392    HG3  ARG 103           HG3      ARG 103  10.729   8.117  -5.485
  Start of MODEL    6
 4393    HD2  ARG 103           HD2      ARG 103  12.344   6.703  -4.406
  Start of MODEL    6
 4394    HD3  ARG 103           HD3      ARG 103  11.094   5.988  -3.388
  Start of MODEL    6
 4395    HE   ARG 103           HE       ARG 103  10.227   5.470  -5.896
  Start of MODEL    6
 4396   HH11  ARG 103          HH11      ARG 103  13.298   4.970  -4.311
  Start of MODEL    6
 4397   HH12  ARG 103          HH12      ARG 103  13.654   3.501  -5.158
  Start of MODEL    6
 4398   HH21  ARG 103          HH21      ARG 103  10.697   3.548  -7.056
  Start of MODEL    6
 4399   HH22  ARG 103          HH22      ARG 103  12.162   2.689  -6.730
  Start of MODEL    6
 4400    H    LYS 104           H        LYS 104   9.179  10.028  -6.136
  Start of MODEL    6
 4401    HA   LYS 104           HA       LYS 104   6.403  10.412  -5.536
  Start of MODEL    6
 4402    HB2  LYS 104           HB2      LYS 104   7.385  11.297  -7.615
  Start of MODEL    6
 4403    HB3  LYS 104           HB3      LYS 104   7.726   9.658  -8.155
  Start of MODEL    6
 4404    HG2  LYS 104           HG2      LYS 104   5.377   9.165  -8.300
  Start of MODEL    6
 4405    HG3  LYS 104           HG3      LYS 104   4.968  10.732  -7.599
  Start of MODEL    6
 4406    HD2  LYS 104           HD2      LYS 104   6.490  10.403 -10.181
  Start of MODEL    6
 4407    HD3  LYS 104           HD3      LYS 104   4.738  10.595 -10.099
  Start of MODEL    6
 4408    HE2  LYS 104           HE2      LYS 104   6.709  12.558  -8.937
  Start of MODEL    6
 4409    HE3  LYS 104           HE3      LYS 104   6.013  12.708 -10.548
  Start of MODEL    6
 4410    HZ2  LYS 104           HZ1      LYS 104   4.883  14.011  -8.748
  Start of MODEL    6
 4411    HZ1  LYS 104           HZ2      LYS 104   4.351  12.541  -8.094
  Start of MODEL    6
 4412    HZ3  LYS 104           HZ3      LYS 104   3.866  13.002  -9.652
  Start of MODEL    6
 4413    H    ALA 105           H        ALA 105   4.907   8.950  -5.164
  Start of MODEL    6
 4414    HA   ALA 105           HA       ALA 105   5.635   6.115  -5.449
  Start of MODEL    6
 4415    HB3  ALA 105           HB1      ALA 105   5.275   6.831  -3.144
  Start of MODEL    6
 4416    HB2  ALA 105           HB2      ALA 105   4.035   5.683  -3.648
  Start of MODEL    6
 4417    HB1  ALA 105           HB3      ALA 105   3.659   7.405  -3.566
  Start of MODEL    6
 4418    H    ASN 106           H        ASN 106   3.857   4.636  -5.895
  Start of MODEL    6
 4419    HA   ASN 106           HA       ASN 106   1.857   5.861  -7.697
  Start of MODEL    6
 4420    HB2  ASN 106           HB2      ASN 106   3.092   3.093  -7.834
  Start of MODEL    6
 4421    HB3  ASN 106           HB3      ASN 106   1.756   3.636  -8.844
  Start of MODEL    6
 4422   HD21  ASN 106          HD21      ASN 106   4.346   2.728  -9.718
  Start of MODEL    6
 4423   HD22  ASN 106          HD22      ASN 106   5.075   4.045 -10.564
  Start of MODEL    6
 4424    H    VAL 107           H        VAL 107  -0.085   5.888  -6.814
  Start of MODEL    6
 4425    HA   VAL 107           HA       VAL 107  -0.729   3.865  -4.774
  Start of MODEL    6
 4426    HB   VAL 107           HB       VAL 107  -1.638   6.738  -5.000
  Start of MODEL    6
 4427    H    ASN 108           H        ASN 108  -2.453   2.605  -5.055
  Start of MODEL    6
 4428    HA   ASN 108           HA       ASN 108  -4.808   3.574  -6.427
  Start of MODEL    6
 4429    HB2  ASN 108           HB2      ASN 108  -4.935   1.668  -7.987
  Start of MODEL    6
 4430    HB3  ASN 108           HB3      ASN 108  -3.526   2.670  -8.314
  Start of MODEL    6
 4431   HD21  ASN 108          HD21      ASN 108  -4.668  -0.408  -7.185
  Start of MODEL    6
 4432   HD22  ASN 108          HD22      ASN 108  -3.132  -1.201  -7.196
  Start of MODEL    6
 4433    H    LEU 109           H        LEU 109  -6.689   2.248  -5.994
  Start of MODEL    6
 4434    HA   LEU 109           HA       LEU 109  -6.816   0.902  -3.579
  Start of MODEL    6
 4435    HB2  LEU 109           HB2      LEU 109  -8.500   0.538  -6.057
  Start of MODEL    6
 4436    HB3  LEU 109           HB3      LEU 109  -8.902  -0.153  -4.496
  Start of MODEL    6
 4437    HG   LEU 109           HG       LEU 109  -8.662   2.804  -5.074
  Start of MODEL    6
 4438   HD13  LEU 109          HD11      LEU 109 -10.605   1.852  -6.179
  Start of MODEL    6
 4439   HD12  LEU 109          HD12      LEU 109 -11.096   2.846  -4.808
  Start of MODEL    6
 4440   HD11  LEU 109          HD13      LEU 109 -11.111   1.088  -4.672
  Start of MODEL    6
 4441   HD21  LEU 109          HD21      LEU 109  -8.088   2.257  -2.777
  Start of MODEL    6
 4442   HD23  LEU 109          HD22      LEU 109  -9.580   1.335  -2.605
  Start of MODEL    6
 4443   HD22  LEU 109          HD23      LEU 109  -9.645   3.081  -2.849
  Start of MODEL    6
 4444    H    ALA 110           H        ALA 110  -6.341  -1.113  -2.901
  Start of MODEL    6
 4445    HA   ALA 110           HA       ALA 110  -4.263  -2.355  -4.338
  Start of MODEL    6
 4446    HB2  ALA 110           HB1      ALA 110  -5.673  -3.373  -1.891
  Start of MODEL    6
 4447    HB1  ALA 110           HB2      ALA 110  -4.373  -2.181  -1.886
  Start of MODEL    6
 4448    HB3  ALA 110           HB3      ALA 110  -4.065  -3.825  -2.451
  Start of MODEL    6
 4449    H    TYR 111           H        TYR 111  -7.661  -3.207  -4.032
  Start of MODEL    6
 4450    HA   TYR 111           HA       TYR 111  -7.336  -5.935  -4.738
  Start of MODEL    6
 4451    HB2  TYR 111           HB2      TYR 111  -9.689  -6.087  -4.828
  Start of MODEL    6
 4452    HB3  TYR 111           HB3      TYR 111  -9.350  -4.896  -3.582
  Start of MODEL    6
 4453    HD1  TYR 111           HD1      TYR 111  -9.222  -2.372  -4.613
  Start of MODEL    6
 4454    HD2  TYR 111           HD2      TYR 111 -11.438  -5.630  -6.213
  Start of MODEL    6
 4455    HE1  TYR 111           HE1      TYR 111 -10.742  -0.789  -5.718
  Start of MODEL    6
 4456    HE2  TYR 111           HE2      TYR 111 -12.963  -4.056  -7.320
  Start of MODEL    6
 4457    HH   TYR 111           HH       TYR 111 -13.698  -1.790  -7.184
  Start of MODEL    6
 4458    H    LEU 112           H        LEU 112  -7.165  -3.117  -6.597
  Start of MODEL    6
 4459    HA   LEU 112           HA       LEU 112  -8.052  -4.229  -9.079
  Start of MODEL    6
 4460    HB2  LEU 112           HB2      LEU 112  -6.485  -1.733  -8.453
  Start of MODEL    6
 4461    HB3  LEU 112           HB3      LEU 112  -7.038  -2.165 -10.061
  Start of MODEL    6
 4462    HG   LEU 112           HG       LEU 112  -8.794  -1.574  -7.676
  Start of MODEL    6
 4463   HD12  LEU 112          HD11      LEU 112  -9.497   0.365  -8.981
  Start of MODEL    6
 4464   HD11  LEU 112          HD12      LEU 112  -8.347  -0.061 -10.249
  Start of MODEL    6
 4465   HD13  LEU 112          HD13      LEU 112  -7.763   0.414  -8.652
  Start of MODEL    6
 4466   HD23  LEU 112          HD21      LEU 112  -9.561  -2.255 -10.511
  Start of MODEL    6
 4467   HD22  LEU 112          HD22      LEU 112 -10.663  -1.869  -9.186
  Start of MODEL    6
 4468   HD21  LEU 112          HD23      LEU 112  -9.691  -3.344  -9.131
  Start of MODEL    6
 4469    H    GLY 113           H        GLY 113  -5.263  -4.794  -7.319
  Start of MODEL    6
 4470    HA2  GLY 113           HA2      GLY 113  -3.865  -5.662  -9.748
  Start of MODEL    6
 4471    HA3  GLY 113           HA3      GLY 113  -3.011  -4.582  -8.651
  Start of MODEL    6
 4472    H    ALA 114           H        ALA 114  -5.129  -6.737  -7.068
  Start of MODEL    6
 4473    HA   ALA 114           HA       ALA 114  -2.863  -8.059  -5.854
  Start of MODEL    6
 4474    HB1  ALA 114           HB1      ALA 114  -5.817  -8.403  -5.328
  Start of MODEL    6
 4475    HB3  ALA 114           HB2      ALA 114  -4.732  -7.315  -4.459
  Start of MODEL    6
 4476    HB2  ALA 114           HB3      ALA 114  -4.505  -9.061  -4.349
  Start of MODEL    6
 4477    H    LYS 115           H        LYS 115  -2.040  -9.941  -6.501
  Start of MODEL    6
 4478    HA   LYS 115           HA       LYS 115  -3.460 -11.558  -8.438
  Start of MODEL    6
 4479    HB2  LYS 115           HB2      LYS 115  -0.707 -11.790  -7.224
  Start of MODEL    6
 4480    HB3  LYS 115           HB3      LYS 115  -1.388 -13.048  -8.240
  Start of MODEL    6
 4481    HG2  LYS 115           HG2      LYS 115  -0.098 -11.807  -9.707
  Start of MODEL    6
 4482    HG3  LYS 115           HG3      LYS 115  -1.726 -11.188  -9.976
  Start of MODEL    6
 4483    HD2  LYS 115           HD2      LYS 115  -0.275  -9.311  -9.878
  Start of MODEL    6
 4484    HD3  LYS 115           HD3      LYS 115  -1.175  -9.340  -8.362
  Start of MODEL    6
 4485    HE2  LYS 115           HE2      LYS 115   1.167  -8.851  -7.947
  Start of MODEL    6
 4486    HE3  LYS 115           HE3      LYS 115   0.740 -10.418  -7.263
  Start of MODEL    6
 4487    HZ2  LYS 115           HZ1      LYS 115   2.892 -10.370  -8.474
  Start of MODEL    6
 4488    HZ1  LYS 115           HZ2      LYS 115   2.043 -10.077  -9.910
  Start of MODEL    6
 4489    HZ3  LYS 115           HZ3      LYS 115   1.804 -11.526  -9.058
  Start of MODEL    6
 4490    HA   PRO 116           HA       PRO 116  -5.056 -14.274  -5.299
  Start of MODEL    6
 4491    HB2  PRO 116           HB2      PRO 116  -6.350 -15.978  -6.911
  Start of MODEL    6
 4492    HB3  PRO 116           HB3      PRO 116  -6.905 -14.316  -6.682
  Start of MODEL    6
 4493    HG2  PRO 116           HG2      PRO 116  -5.406 -15.518  -8.964
  Start of MODEL    6
 4494    HG3  PRO 116           HG3      PRO 116  -6.695 -14.303  -8.984
  Start of MODEL    6
 4495    HD2  PRO 116           HD2      PRO 116  -3.977 -13.767  -9.188
  Start of MODEL    6
 4496    HD3  PRO 116           HD3      PRO 116  -5.224 -12.592  -8.727
  Start of MODEL    6
 4497    H    ARG 117           H        ARG 117  -2.286 -14.661  -6.171
  Start of MODEL    6
 4498    HA   ARG 117           HA       ARG 117  -2.190 -17.601  -6.227
  Start of MODEL    6
 4499    HB2  ARG 117           HB2      ARG 117  -0.140 -15.617  -7.211
  Start of MODEL    6
 4500    HB3  ARG 117           HB3      ARG 117   0.129 -17.352  -7.110
  Start of MODEL    6
 4501    HG2  ARG 117           HG2      ARG 117  -1.795 -15.880  -8.882
  Start of MODEL    6
 4502    HG3  ARG 117           HG3      ARG 117  -0.431 -16.897  -9.350
  Start of MODEL    6
 4503    HD2  ARG 117           HD2      ARG 117  -2.949 -17.820  -7.972
  Start of MODEL    6
 4504    HD3  ARG 117           HD3      ARG 117  -2.546 -18.072  -9.670
  Start of MODEL    6
 4505    HE   ARG 117           HE       ARG 117  -0.573 -19.377  -8.752
  Start of MODEL    6
 4506   HH11  ARG 117          HH11      ARG 117  -3.563 -19.038  -6.955
  Start of MODEL    6
 4507   HH12  ARG 117          HH12      ARG 117  -3.433 -20.597  -6.196
  Start of MODEL    6
 4508   HH21  ARG 117          HH21      ARG 117  -0.400 -21.433  -7.774
  Start of MODEL    6
 4509   HH22  ARG 117          HH22      ARG 117  -1.636 -21.968  -6.669
  Start of MODEL    6
 4510    H    THR 118           H        THR 118  -2.684 -17.192  -3.940
  Start of MODEL    6
 4511    HA   THR 118           HA       THR 118  -0.699 -18.047  -2.290
  Start of MODEL    6
 4512    HB   THR 118           HB       THR 118   0.405 -15.833  -2.603
  Start of MODEL    6
 4513    HG1  THR 118           HG1      THR 118   0.781 -15.519  -0.413
  Start of MODEL    6
 4514   HG23  THR 118          HG21      THR 118  -1.591 -14.457  -2.950
  Start of MODEL    6
 4515   HG22  THR 118          HG22      THR 118  -0.601 -13.818  -1.637
  Start of MODEL    6
 4516   HG21  THR 118          HG23      THR 118  -2.069 -14.723  -1.271
  Start of MODEL    6
 4517    H    ASN 119           H        ASN 119  -1.453 -17.585   0.150
  Start of MODEL    6
 4518    HA   ASN 119           HA       ASN 119  -4.305 -18.068   0.120
  Start of MODEL    6
 4519    HB2  ASN 119           HB2      ASN 119  -2.805 -19.393   1.602
  Start of MODEL    6
 4520    HB3  ASN 119           HB3      ASN 119  -2.464 -17.927   2.520
  Start of MODEL    6
 4521   HD21  ASN 119          HD21      ASN 119  -4.051 -17.057   3.843
  Start of MODEL    6
 4522   HD22  ASN 119          HD22      ASN 119  -5.482 -17.923   4.279
  Start of MODEL    6
 4523    H    VAL 120           H        VAL 120  -5.233 -16.155  -0.459
  Start of MODEL    6
 4524    HA   VAL 120           HA       VAL 120  -4.696 -13.769   1.112
  Start of MODEL    6
 4525    HB   VAL 120           HB       VAL 120  -6.719 -14.100  -1.107
  Start of MODEL    6
 4526    H    GLN 121           H        GLN 121  -5.482 -14.338   3.121
  Start of MODEL    6
 4527    HA   GLN 121           HA       GLN 121  -6.995 -14.300   4.807
  Start of MODEL    6
 4528    HB2  GLN 121           HB2      GLN 121  -8.982 -13.463   2.682
  Start of MODEL    6
 4529    HB3  GLN 121           HB3      GLN 121  -9.192 -13.297   4.418
  Start of MODEL    6
 4530    HG2  GLN 121           HG2      GLN 121  -7.479 -11.655   4.550
  Start of MODEL    6
 4531    HG3  GLN 121           HG3      GLN 121  -6.986 -11.951   2.884
  Start of MODEL    6
 4532   HE21  GLN 121          HE21      GLN 121  -8.326 -11.225   1.199
  Start of MODEL    6
 4533   HE22  GLN 121          HE22      GLN 121  -9.495  -9.979   1.452
  Start of MODEL    6
 4534    H5'   DG   1           H5'       DG   1  21.160  -2.212  -5.361
  Start of MODEL    6
 4535    H4'   DG   1           H4'       DG   1  19.625  -3.952  -6.101
  Start of MODEL    6
 4536    H3'   DG   1           H3'       DG   1  17.684  -2.090  -6.513
  Start of MODEL    6
 4537    H2'   DG   1           H2'       DG   1  17.162  -1.591  -4.236
  Start of MODEL    6
 4538    H1'   DG   1           H1'       DG   1  17.625  -4.520  -3.507
  Start of MODEL    6
 4539    H8    DG   1           H8        DG   1  19.708  -1.621  -2.228
  Start of MODEL    6
 4540    H1    DG   1           H1        DG   1  15.236  -3.680   1.892
  Start of MODEL    6
 4541    H22   DG   1           H21       DG   1  14.145  -5.640  -0.749
  Start of MODEL    6
 4542    H21   DG   1           H22       DG   1  13.923  -5.144   0.915
  Start of MODEL    6
 4543   HO5'   DG   1           H5T       DG   1  18.786  -0.978  -4.701
  Start of MODEL    6
 4544   H5''   DG   1          5H''       DG   1  20.172  -1.716  -6.745
  Start of MODEL    6
 4545   H2''   DG   1          2H''       DG   1  16.090  -2.961  -4.477
  Start of MODEL    6
 4546    H5'   DG   2           H5'       DG   2  15.398  -3.612  -9.929
  Start of MODEL    6
 4547    H4'   DG   2           H4'       DG   2  13.289  -3.094  -9.517
  Start of MODEL    6
 4548    H3'   DG   2           H3'       DG   2  14.026  -1.024 -11.055
  Start of MODEL    6
 4549    H2'   DG   2           H2'       DG   2  14.700   0.424  -9.217
  Start of MODEL    6
 4550    H1'   DG   2           H1'       DG   2  12.110  -0.518  -7.877
  Start of MODEL    6
 4551    H8    DG   2           H8        DG   2  15.583   1.048  -7.293
  Start of MODEL    6
 4552    H1    DG   2           H1        DG   2  11.609   0.969  -2.253
  Start of MODEL    6
 4553    H22   DG   2           H21       DG   2   9.583  -0.940  -4.342
  Start of MODEL    6
 4554    H21   DG   2           H22       DG   2   9.780  -0.178  -2.784
  Start of MODEL    6
 4555   H5''   DG   2          5H''       DG   2  15.863  -1.905 -10.041
  Start of MODEL    6
 4556   H2''   DG   2          2H''       DG   2  13.069   0.972  -9.573
  Start of MODEL    6
 4557    H5'   DT   3           H5'       DT   3  10.904  -3.227  -9.563
  Start of MODEL    6
 4558    H4'   DT   3           H4'       DT   3   8.866  -4.792  -9.845
  Start of MODEL    6
 4559    H3'   DT   3           H3'       DT   3   9.435  -4.954 -12.494
  Start of MODEL    6
 4560    H2'   DT   3           H2'       DT   3   9.094  -2.629 -13.013
  Start of MODEL    6
 4561    H1'   DT   3           H1'       DT   3   6.697  -2.681 -11.094
  Start of MODEL    6
 4562    H3    DT   3           H3        DT   3   6.590   1.604 -13.084
  Start of MODEL    6
 4563    H71   DT   3           H71       DT   3   8.946   2.813  -9.243
  Start of MODEL    6
 4564    H73   DT   3           H72       DT   3  10.410   2.109  -9.977
  Start of MODEL    6
 4565    H72   DT   3           H73       DT   3   9.599   1.269  -8.637
  Start of MODEL    6
 4566    H6    DT   3           H6        DT   3   9.061  -0.754  -9.759
  Start of MODEL    6
 4567   H5''   DT   3          5H''       DT   3  11.092  -4.879 -10.173
  Start of MODEL    6
 4568   H2''   DT   3          2H''       DT   3   7.486  -3.282 -13.317
  Start of MODEL    6
 4569    H5'   DG   4           H5'       DG   4   4.827  -6.993  -9.662
  Start of MODEL    6
 4570    H4'   DG   4           H4'       DG   4   6.130  -5.645  -7.812
  Start of MODEL    6
 4571    H3'   DG   4           H3'       DG   4   3.339  -5.700  -8.558
  Start of MODEL    6
 4572    H2'   DG   4           H2'       DG   4   3.027  -3.388  -8.688
  Start of MODEL    6
 4573    H1'   DG   4           H1'       DG   4   5.686  -2.913  -7.261
  Start of MODEL    6
 4574    H8    DG   4           H8        DG   4   6.168  -0.449  -7.501
  Start of MODEL    6
 4575    H1    DG   4           H1        DG   4   2.999  -0.077 -13.069
  Start of MODEL    6
 4576    H22   DG   4           H21       DG   4   2.464  -3.477 -12.625
  Start of MODEL    6
 4577    H21   DG   4           H22       DG   4   2.220  -2.065 -13.629
  Start of MODEL    6
 4578   H5''   DG   4          5H''       DG   4   5.359  -5.638 -10.684
  Start of MODEL    6
 4579   H2''   DG   4          2H''       DG   4   3.383  -3.355  -6.963
  Start of MODEL    6
 4580    H5'   DT   5           H5'       DT   5   3.382  -9.243  -3.972
  Start of MODEL    6
 4581    H4'   DT   5           H4'       DT   5   2.710  -7.856  -2.243
  Start of MODEL    6
 4582    H3'   DT   5           H3'       DT   5   0.928  -9.754  -2.945
  Start of MODEL    6
 4583    H2'   DT   5           H2'       DT   5  -0.451  -8.385  -4.372
  Start of MODEL    6
 4584    H1'   DT   5           H1'       DT   5  -0.192  -6.148  -2.299
  Start of MODEL    6
 4585    H3    DT   5           H3        DT   5  -3.001  -3.748  -4.891
  Start of MODEL    6
 4586    H73   DT   5           H71       DT   5   0.655  -5.570  -8.219
  Start of MODEL    6
 4587    H71   DT   5           H72       DT   5  -0.251  -4.066  -8.521
  Start of MODEL    6
 4588    H72   DT   5           H73       DT   5   1.303  -4.011  -7.657
  Start of MODEL    6
 4589    H6    DT   5           H6        DT   5   1.059  -6.106  -5.704
  Start of MODEL    6
 4590   H5''   DT   5          5H''       DT   5   2.045  -8.742  -5.030
  Start of MODEL    6
 4591   H2''   DT   5          2H''       DT   5  -1.290  -8.225  -2.830
  Start of MODEL    6
 4592    H5'   DG   6           H5'       DG   6   2.734  -7.593   1.381
  Start of MODEL    6
 4593    H4'   DG   6           H4'       DG   6   3.287  -8.361   3.744
  Start of MODEL    6
 4594    H3'   DG   6           H3'       DG   6   1.667 -10.517   3.351
  Start of MODEL    6
 4595    H2'   DG   6           H2'       DG   6  -0.429  -9.381   3.237
  Start of MODEL    6
 4596    H1'   DG   6           H1'       DG   6   0.529  -7.400   5.359
  Start of MODEL    6
 4597    H8    DG   6           H8        DG   6  -1.190  -7.767   1.916
  Start of MODEL    6
 4598    H1    DG   6           H1        DG   6  -3.488  -3.126   5.722
  Start of MODEL    6
 4599    H22   DG   6           H21       DG   6  -0.938  -4.059   7.871
  Start of MODEL    6
 4600    H21   DG   6           H22       DG   6  -2.309  -3.016   7.571
  Start of MODEL    6
 4601   H5''   DG   6          5H''       DG   6   3.337  -9.246   1.616
  Start of MODEL    6
 4602   H2''   DG   6          2H''       DG   6  -0.313  -9.606   4.979
  Start of MODEL    6
 4603    H5'   DC   7           H5'       DC   7   2.726 -13.896   4.613
  Start of MODEL    6
 4604    H4'   DC   7           H4'       DC   7   1.145 -15.500   4.657
  Start of MODEL    6
 4605    H3'   DC   7           H3'       DC   7  -0.384 -14.021   3.010
  Start of MODEL    6
 4606   HO3'   DC   7           H3T       DC   7  -1.844 -15.713   3.173
  Start of MODEL    6
 4607    H2'   DC   7           H2'       DC   7  -1.382 -12.569   4.616
  Start of MODEL    6
 4608    H1'   DC   7           H1'       DC   7  -1.644 -14.883   6.587
  Start of MODEL    6
 4609    H42   DC   7           H41       DC   7  -1.528  -9.084   9.839
  Start of MODEL    6
 4610    H41   DC   7           H42       DC   7  -2.478 -10.206  10.788
  Start of MODEL    6
 4611    H5    DC   7           H5        DC   7  -0.473  -9.701   7.731
  Start of MODEL    6
 4612    H6    DC   7           H6        DC   7  -0.138 -11.508   6.131
  Start of MODEL    6
 4613   H5''   DC   7          5H''       DC   7   1.610 -13.200   3.422
  Start of MODEL    6
 4614   H2''   DC   7          2H''       DC   7  -2.559 -13.875   4.621
  Start of MODEL    7
 4615    H1   GLY  25           HT1      GLY  25 -12.492 -13.411 -13.177
  Start of MODEL    7
 4616    H2   GLY  25           HT2      GLY  25 -13.757 -12.400 -13.676
  Start of MODEL    7
 4617    H3   GLY  25           HT3      GLY  25 -13.754 -13.043 -12.108
  Start of MODEL    7
 4618    HA3  GLY  25           HA2      GLY  25 -13.104 -10.722 -12.092
  Start of MODEL    7
 4619    HA2  GLY  25           HA3      GLY  25 -11.795 -11.102 -13.199
  Start of MODEL    7
 4620    H    ALA  26           H        ALA  26 -12.156 -10.187 -10.236
  Start of MODEL    7
 4621    HA   ALA  26           HA       ALA  26  -9.782 -11.550  -9.311
  Start of MODEL    7
 4622    HB2  ALA  26           HB1      ALA  26 -11.461  -9.481  -7.900
  Start of MODEL    7
 4623    HB1  ALA  26           HB2      ALA  26 -10.097  -9.130  -8.962
  Start of MODEL    7
 4624    HB3  ALA  26           HB3      ALA  26  -9.839 -10.005  -7.452
  Start of MODEL    7
 4625    H    MET  27           H        MET  27  -9.821 -12.116  -6.837
  Start of MODEL    7
 4626    HA   MET  27           HA       MET  27 -11.724 -14.276  -6.573
  Start of MODEL    7
 4627    HB2  MET  27           HB2      MET  27 -10.425 -14.880  -4.563
  Start of MODEL    7
 4628    HB3  MET  27           HB3      MET  27  -9.396 -14.676  -5.974
  Start of MODEL    7
 4629    HG2  MET  27           HG2      MET  27  -8.702 -12.493  -5.192
  Start of MODEL    7
 4630    HG3  MET  27           HG3      MET  27  -9.798 -12.612  -3.817
  Start of MODEL    7
 4631    HE2  MET  27           HE1      MET  27  -6.093 -15.313  -4.383
  Start of MODEL    7
 4632    HE1  MET  27           HE2      MET  27  -6.513 -14.007  -5.491
  Start of MODEL    7
 4633    HE3  MET  27           HE3      MET  27  -7.540 -15.436  -5.381
  Start of MODEL    7
 4634    H    GLY  28           H        GLY  28 -12.059 -14.442  -3.821
  Start of MODEL    7
 4635    HA2  GLY  28           HA2      GLY  28 -14.333 -12.868  -3.380
  Start of MODEL    7
 4636    HA3  GLY  28           HA3      GLY  28 -13.464 -13.763  -2.142
  Start of MODEL    7
 4637    H    SER  29           H        SER  29 -14.748 -11.106  -2.059
  Start of MODEL    7
 4638    HA   SER  29           HA       SER  29 -12.377  -9.479  -1.430
  Start of MODEL    7
 4639    HB2  SER  29           HB2      SER  29 -15.100  -8.503  -2.318
  Start of MODEL    7
 4640    HB3  SER  29           HB3      SER  29 -13.679  -7.502  -2.005
  Start of MODEL    7
 4641    HG   SER  29           HG       SER  29 -13.228  -9.533  -3.801
  Start of MODEL    7
 4642    H    ARG  30           H        ARG  30 -12.907  -7.734   0.232
  Start of MODEL    7
 4643    HA   ARG  30           HA       ARG  30 -14.843  -8.670   2.217
  Start of MODEL    7
 4644    HB2  ARG  30           HB2      ARG  30 -11.889  -8.402   2.586
  Start of MODEL    7
 4645    HB3  ARG  30           HB3      ARG  30 -12.957  -8.073   3.940
  Start of MODEL    7
 4646    HG2  ARG  30           HG2      ARG  30 -12.977 -10.647   2.381
  Start of MODEL    7
 4647    HG3  ARG  30           HG3      ARG  30 -12.038 -10.389   3.853
  Start of MODEL    7
 4648    HD2  ARG  30           HD2      ARG  30 -14.025 -11.428   4.567
  Start of MODEL    7
 4649    HD3  ARG  30           HD3      ARG  30 -14.220  -9.718   4.953
  Start of MODEL    7
 4650    HE   ARG  30           HE       ARG  30 -15.387 -10.853   2.493
  Start of MODEL    7
 4651   HH11  ARG  30          HH11      ARG  30 -15.722  -9.112   5.505
  Start of MODEL    7
 4652   HH12  ARG  30          HH12      ARG  30 -17.395  -8.712   5.250
  Start of MODEL    7
 4653   HH21  ARG  30          HH21      ARG  30 -17.608 -10.338   2.143
  Start of MODEL    7
 4654   HH22  ARG  30          HH22      ARG  30 -18.462  -9.423   3.348
  Start of MODEL    7
 4655    H    ASP  31           H        ASP  31 -14.152  -6.982   4.242
  Start of MODEL    7
 4656    HA   ASP  31           HA       ASP  31 -15.431  -4.575   3.549
  Start of MODEL    7
 4657    HB2  ASP  31           HB2      ASP  31 -14.664  -3.896   5.883
  Start of MODEL    7
 4658    HB3  ASP  31           HB3      ASP  31 -15.636  -5.361   5.768
  Start of MODEL    7
 4659    H    THR  32           H        THR  32 -12.272  -5.529   3.037
  Start of MODEL    7
 4660    HA   THR  32           HA       THR  32 -11.178  -2.837   3.164
  Start of MODEL    7
 4661    HB   THR  32           HB       THR  32  -9.065  -4.084   2.366
  Start of MODEL    7
 4662    HG1  THR  32           HG1      THR  32  -9.801  -6.415   3.478
  Start of MODEL    7
 4663   HG22  THR  32          HG21      THR  32  -8.526  -4.800   4.616
  Start of MODEL    7
 4664   HG21  THR  32          HG22      THR  32 -10.234  -4.807   5.051
  Start of MODEL    7
 4665   HG23  THR  32          HG23      THR  32  -9.429  -3.288   4.670
  Start of MODEL    7
 4666    H    MET  33           H        MET  33 -13.007  -4.393   0.959
  Start of MODEL    7
 4667    HA   MET  33           HA       MET  33 -11.728  -4.448  -1.444
  Start of MODEL    7
 4668    HB2  MET  33           HB2      MET  33 -14.113  -5.062  -0.937
  Start of MODEL    7
 4669    HB3  MET  33           HB3      MET  33 -14.513  -3.365  -1.095
  Start of MODEL    7
 4670    HG2  MET  33           HG2      MET  33 -13.735  -3.375  -3.397
  Start of MODEL    7
 4671    HG3  MET  33           HG3      MET  33 -13.313  -5.083  -3.254
  Start of MODEL    7
 4672    HE1  MET  33           HE1      MET  33 -14.759  -5.638  -5.412
  Start of MODEL    7
 4673    HE3  MET  33           HE2      MET  33 -15.200  -3.935  -5.575
  Start of MODEL    7
 4674    HE2  MET  33           HE3      MET  33 -16.453  -5.177  -5.604
  Start of MODEL    7
 4675    H    PHE  34           H        PHE  34 -13.463  -1.543  -0.199
  Start of MODEL    7
 4676    HA   PHE  34           HA       PHE  34 -12.028   0.002  -2.248
  Start of MODEL    7
 4677    HB2  PHE  34           HB2      PHE  34 -14.621   0.486  -0.801
  Start of MODEL    7
 4678    HB3  PHE  34           HB3      PHE  34 -13.773   1.790  -1.625
  Start of MODEL    7
 4679    HD1  PHE  34           HD1      PHE  34 -15.644  -1.337  -2.064
  Start of MODEL    7
 4680    HD2  PHE  34           HD2      PHE  34 -13.673   1.892  -4.013
  Start of MODEL    7
 4681    HE1  PHE  34           HE1      PHE  34 -16.718  -1.965  -4.188
  Start of MODEL    7
 4682    HE2  PHE  34           HE2      PHE  34 -14.739   1.271  -6.139
  Start of MODEL    7
 4683    HZ   PHE  34           HZ       PHE  34 -16.270  -0.659  -6.227
  Start of MODEL    7
 4684    H    THR  35           H        THR  35 -11.586  -0.772   0.880
  Start of MODEL    7
 4685    HA   THR  35           HA       THR  35 -10.894   1.960   1.706
  Start of MODEL    7
 4686    HB   THR  35           HB       THR  35 -10.794   0.961   4.014
  Start of MODEL    7
 4687    HG1  THR  35           HG1      THR  35 -12.267  -1.127   3.832
  Start of MODEL    7
 4688   HG22  THR  35          HG21      THR  35 -13.237   0.865   4.283
  Start of MODEL    7
 4689   HG21  THR  35          HG22      THR  35 -13.419   0.734   2.530
  Start of MODEL    7
 4690   HG23  THR  35          HG23      THR  35 -12.751   2.205   3.243
  Start of MODEL    7
 4691    H    LYS  36           H        LYS  36  -9.499  -1.006   0.734
  Start of MODEL    7
 4692    HA   LYS  36           HA       LYS  36  -7.035  -0.577   2.211
  Start of MODEL    7
 4693    HB2  LYS  36           HB2      LYS  36  -7.980  -2.800   2.175
  Start of MODEL    7
 4694    HB3  LYS  36           HB3      LYS  36  -8.035  -2.792   0.422
  Start of MODEL    7
 4695    HG2  LYS  36           HG2      LYS  36  -5.616  -2.856   0.321
  Start of MODEL    7
 4696    HG3  LYS  36           HG3      LYS  36  -5.525  -2.773   2.089
  Start of MODEL    7
 4697    HD2  LYS  36           HD2      LYS  36  -6.636  -4.877   2.315
  Start of MODEL    7
 4698    HD3  LYS  36           HD3      LYS  36  -7.004  -4.929   0.592
  Start of MODEL    7
 4699    HE2  LYS  36           HE2      LYS  36  -4.647  -5.157   0.073
  Start of MODEL    7
 4700    HE3  LYS  36           HE3      LYS  36  -4.230  -5.014   1.779
  Start of MODEL    7
 4701    HZ3  LYS  36           HZ1      LYS  36  -5.218  -7.072   2.256
  Start of MODEL    7
 4702    HZ2  LYS  36           HZ2      LYS  36  -4.314  -7.330   0.840
  Start of MODEL    7
 4703    HZ1  LYS  36           HZ3      LYS  36  -5.997  -7.155   0.752
  Start of MODEL    7
 4704    H    ILE  37           H        ILE  37  -5.606   0.697   1.375
  Start of MODEL    7
 4705    HA   ILE  37           HA       ILE  37  -5.403   1.095  -1.517
  Start of MODEL    7
 4706    HB   ILE  37           HB       ILE  37  -4.271   2.705   0.778
  Start of MODEL    7
 4707   HD11  ILE  37          HD11      ILE  37  -5.342   5.344  -0.554
  Start of MODEL    7
 4708   HD13  ILE  37          HD12      ILE  37  -5.502   4.953   1.158
  Start of MODEL    7
 4709   HD12  ILE  37          HD13      ILE  37  -6.939   5.296   0.195
  Start of MODEL    7
 4710    H    PHE  38           H        PHE  38  -3.648   0.483  -2.624
  Start of MODEL    7
 4711    HA   PHE  38           HA       PHE  38  -1.395  -0.680  -1.144
  Start of MODEL    7
 4712    HB2  PHE  38           HB2      PHE  38  -2.370  -2.121  -2.862
  Start of MODEL    7
 4713    HB3  PHE  38           HB3      PHE  38  -2.149  -0.864  -4.075
  Start of MODEL    7
 4714    HD1  PHE  38           HD1      PHE  38  -0.201  -0.801  -5.332
  Start of MODEL    7
 4715    HD2  PHE  38           HD2      PHE  38  -0.258  -3.005  -1.694
  Start of MODEL    7
 4716    HE1  PHE  38           HE1      PHE  38   2.028  -1.698  -5.842
  Start of MODEL    7
 4717    HE2  PHE  38           HE2      PHE  38   1.973  -3.903  -2.202
  Start of MODEL    7
 4718    HZ   PHE  38           HZ       PHE  38   3.125  -3.237  -4.279
  Start of MODEL    7
 4719    H    VAL  39           H        VAL  39   0.430   0.466  -0.936
  Start of MODEL    7
 4720    HA   VAL  39           HA       VAL  39   0.777   2.816  -2.673
  Start of MODEL    7
 4721    HB   VAL  39           HB       VAL  39   2.259   2.343  -0.092
  Start of MODEL    7
 4722    H    GLY  40           H        GLY  40   2.442   2.886  -4.019
  Start of MODEL    7
 4723    HA2  GLY  40           HA2      GLY  40   4.485   0.756  -3.809
  Start of MODEL    7
 4724    HA3  GLY  40           HA3      GLY  40   3.679   1.079  -5.335
  Start of MODEL    7
 4725    H    GLY  41           H        GLY  41   6.464   1.165  -4.983
  Start of MODEL    7
 4726    HA2  GLY  41           HA2      GLY  41   8.113   2.475  -5.947
  Start of MODEL    7
 4727    HA3  GLY  41           HA3      GLY  41   6.937   3.765  -6.124
  Start of MODEL    7
 4728    H    LEU  42           H        LEU  42   7.122   2.489  -2.982
  Start of MODEL    7
 4729    HA   LEU  42           HA       LEU  42   8.059   5.000  -1.961
  Start of MODEL    7
 4730    HB2  LEU  42           HB2      LEU  42   7.353   2.399  -0.602
  Start of MODEL    7
 4731    HB3  LEU  42           HB3      LEU  42   7.823   3.852   0.256
  Start of MODEL    7
 4732    HG   LEU  42           HG       LEU  42   5.419   3.624  -1.542
  Start of MODEL    7
 4733   HD13  LEU  42          HD11      LEU  42   5.241   2.207   0.452
  Start of MODEL    7
 4734   HD12  LEU  42          HD12      LEU  42   4.117   3.565   0.502
  Start of MODEL    7
 4735   HD11  LEU  42          HD13      LEU  42   5.593   3.607   1.467
  Start of MODEL    7
 4736   HD23  LEU  42          HD21      LEU  42   6.261   5.778   0.394
  Start of MODEL    7
 4737   HD22  LEU  42          HD22      LEU  42   4.775   5.756  -0.557
  Start of MODEL    7
 4738   HD21  LEU  42          HD23      LEU  42   6.336   5.887  -1.364
  Start of MODEL    7
 4739    HA   PRO  43           HA       PRO  43  12.400   3.935  -1.578
  Start of MODEL    7
 4740    HB2  PRO  43           HB2      PRO  43  12.824   5.646   0.593
  Start of MODEL    7
 4741    HB3  PRO  43           HB3      PRO  43  13.052   6.059  -1.107
  Start of MODEL    7
 4742    HG2  PRO  43           HG2      PRO  43  10.823   6.723   0.718
  Start of MODEL    7
 4743    HG3  PRO  43           HG3      PRO  43  11.416   7.597  -0.702
  Start of MODEL    7
 4744    HD2  PRO  43           HD2      PRO  43   9.107   6.139  -0.669
  Start of MODEL    7
 4745    HD3  PRO  43           HD3      PRO  43  10.060   6.445  -2.132
  Start of MODEL    7
 4746    H    TYR  44           H        TYR  44  13.527   2.560  -0.216
  Start of MODEL    7
 4747    HA   TYR  44           HA       TYR  44  11.937   0.806   1.253
  Start of MODEL    7
 4748    HB2  TYR  44           HB2      TYR  44  14.944   1.120   1.335
  Start of MODEL    7
 4749    HB3  TYR  44           HB3      TYR  44  14.055  -0.270   1.944
  Start of MODEL    7
 4750    HD1  TYR  44           HD1      TYR  44  12.513  -1.470   0.194
  Start of MODEL    7
 4751    HD2  TYR  44           HD2      TYR  44  15.760   1.079  -0.829
  Start of MODEL    7
 4752    HE1  TYR  44           HE1      TYR  44  12.626  -2.520  -2.029
  Start of MODEL    7
 4753    HE2  TYR  44           HE2      TYR  44  15.880   0.043  -3.054
  Start of MODEL    7
 4754    HH   TYR  44           HH       TYR  44  13.437  -1.965  -4.289
  Start of MODEL    7
 4755    H    HIS  45           H        HIS  45  13.786   3.585   2.365
  Start of MODEL    7
 4756    HA   HIS  45           HA       HIS  45  13.630   2.761   5.116
  Start of MODEL    7
 4757    HB2  HIS  45           HB2      HIS  45  14.934   4.636   5.673
  Start of MODEL    7
 4758    HB3  HIS  45           HB3      HIS  45  15.546   4.098   4.115
  Start of MODEL    7
 4759    HD1  HIS  45           HD1      HIS  45  15.197   7.070   5.729
  Start of MODEL    7
 4760    HD2  HIS  45           HD2      HIS  45  13.748   5.758   2.055
  Start of MODEL    7
 4761    HE1  HIS  45           HE1      HIS  45  14.726   9.155   4.397
  Start of MODEL    7
 4762    HE2  HIS  45           HE2      HIS  45  13.537   8.327   2.333
  Start of MODEL    7
 4763    H    THR  46           H        THR  46  11.350   4.252   3.100
  Start of MODEL    7
 4764    HA   THR  46           HA       THR  46   9.988   6.001   4.735
  Start of MODEL    7
 4765    HB   THR  46           HB       THR  46   8.697   3.854   3.028
  Start of MODEL    7
 4766    HG1  THR  46           HG1      THR  46   9.866   4.804   1.526
  Start of MODEL    7
 4767   HG22  THR  46          HG21      THR  46   6.927   5.499   2.697
  Start of MODEL    7
 4768   HG21  THR  46          HG22      THR  46   7.772   6.638   3.743
  Start of MODEL    7
 4769   HG23  THR  46          HG23      THR  46   7.132   5.139   4.412
  Start of MODEL    7
 4770    H    SER  47           H        SER  47   8.576   5.795   6.495
  Start of MODEL    7
 4771    HA   SER  47           HA       SER  47   8.492   3.105   7.663
  Start of MODEL    7
 4772    HB2  SER  47           HB2      SER  47   8.301   4.237   9.849
  Start of MODEL    7
 4773    HB3  SER  47           HB3      SER  47   9.759   4.739   8.994
  Start of MODEL    7
 4774    HG   SER  47           HG       SER  47   8.507   6.598   8.279
  Start of MODEL    7
 4775    H    ASP  48           H        ASP  48   6.602   2.577   8.923
  Start of MODEL    7
 4776    HA   ASP  48           HA       ASP  48   4.150   2.890   7.706
  Start of MODEL    7
 4777    HB2  ASP  48           HB2      ASP  48   4.459   2.546  10.692
  Start of MODEL    7
 4778    HB3  ASP  48           HB3      ASP  48   3.193   1.897   9.653
  Start of MODEL    7
 4779    H    LYS  49           H        LYS  49   5.673   4.899  10.146
  Start of MODEL    7
 4780    HA   LYS  49           HA       LYS  49   3.517   6.585  10.770
  Start of MODEL    7
 4781    HB2  LYS  49           HB2      LYS  49   5.537   6.583  12.104
  Start of MODEL    7
 4782    HB3  LYS  49           HB3      LYS  49   6.484   7.145  10.733
  Start of MODEL    7
 4783    HG2  LYS  49           HG2      LYS  49   5.172   9.250  10.738
  Start of MODEL    7
 4784    HG3  LYS  49           HG3      LYS  49   4.345   8.685  12.192
  Start of MODEL    7
 4785    HD2  LYS  49           HD2      LYS  49   7.330   9.009  11.968
  Start of MODEL    7
 4786    HD3  LYS  49           HD3      LYS  49   6.250  10.241  12.625
  Start of MODEL    7
 4787    HE2  LYS  49           HE2      LYS  49   5.525   8.686  14.364
  Start of MODEL    7
 4788    HE3  LYS  49           HE3      LYS  49   6.576   7.435  13.694
  Start of MODEL    7
 4789    HZ1  LYS  49           HZ1      LYS  49   7.523  10.048  14.758
  Start of MODEL    7
 4790    HZ3  LYS  49           HZ2      LYS  49   8.493   8.757  14.216
  Start of MODEL    7
 4791    HZ2  LYS  49           HZ3      LYS  49   7.550   8.581  15.611
  Start of MODEL    7
 4792    H    THR  50           H        THR  50   5.982   6.806   8.229
  Start of MODEL    7
 4793    HA   THR  50           HA       THR  50   5.337   9.373   7.287
  Start of MODEL    7
 4794    HB   THR  50           HB       THR  50   6.390   7.124   5.558
  Start of MODEL    7
 4795    HG1  THR  50           HG1      THR  50   8.053   8.839   7.098
  Start of MODEL    7
 4796   HG21  THR  50          HG21      THR  50   6.948  10.095   5.536
  Start of MODEL    7
 4797   HG23  THR  50          HG22      THR  50   5.855   9.259   4.435
  Start of MODEL    7
 4798   HG22  THR  50          HG23      THR  50   7.580   8.901   4.402
  Start of MODEL    7
 4799    H    LEU  51           H        LEU  51   4.102   6.179   6.445
  Start of MODEL    7
 4800    HA   LEU  51           HA       LEU  51   2.450   7.135   4.289
  Start of MODEL    7
 4801    HB2  LEU  51           HB2      LEU  51   2.428   4.558   5.850
  Start of MODEL    7
 4802    HB3  LEU  51           HB3      LEU  51   1.300   4.897   4.551
  Start of MODEL    7
 4803    HG   LEU  51           HG       LEU  51   4.300   4.662   4.318
  Start of MODEL    7
 4804   HD12  LEU  51          HD11      LEU  51   3.769   2.742   2.897
  Start of MODEL    7
 4805   HD11  LEU  51          HD12      LEU  51   2.052   2.971   3.230
  Start of MODEL    7
 4806   HD13  LEU  51          HD13      LEU  51   3.152   2.527   4.535
  Start of MODEL    7
 4807   HD21  LEU  51          HD21      LEU  51   3.474   6.415   2.835
  Start of MODEL    7
 4808   HD23  LEU  51          HD22      LEU  51   2.250   5.314   2.198
  Start of MODEL    7
 4809   HD22  LEU  51          HD23      LEU  51   3.962   4.991   1.916
  Start of MODEL    7
 4810    H    HIS  52           H        HIS  52   2.007   6.365   7.664
  Start of MODEL    7
 4811    HA   HIS  52           HA       HIS  52  -0.718   6.745   7.983
  Start of MODEL    7
 4812    HB2  HIS  52           HB2      HIS  52   0.774   5.898   9.746
  Start of MODEL    7
 4813    HB3  HIS  52           HB3      HIS  52   1.522   7.480   9.887
  Start of MODEL    7
 4814    HD1  HIS  52           HD1      HIS  52   0.335   9.249  11.270
  Start of MODEL    7
 4815    HD2  HIS  52           HD2      HIS  52  -1.801   5.690  10.921
  Start of MODEL    7
 4816    HE1  HIS  52           HE1      HIS  52  -1.466   9.361  13.013
  Start of MODEL    7
 4817    HE2  HIS  52           HE2      HIS  52  -2.551   7.090  12.967
  Start of MODEL    7
 4818    H    GLU  53           H        GLU  53   1.826   9.207   8.498
  Start of MODEL    7
 4819    HA   GLU  53           HA       GLU  53   0.156  11.361   8.971
  Start of MODEL    7
 4820    HB2  GLU  53           HB2      GLU  53   2.827  11.490   7.580
  Start of MODEL    7
 4821    HB3  GLU  53           HB3      GLU  53   2.064  12.763   8.513
  Start of MODEL    7
 4822    HG2  GLU  53           HG2      GLU  53   3.088  10.145   9.582
  Start of MODEL    7
 4823    HG3  GLU  53           HG3      GLU  53   3.868  11.714   9.742
  Start of MODEL    7
 4824    H    TYR  54           H        TYR  54   1.465  10.278   5.843
  Start of MODEL    7
 4825    HA   TYR  54           HA       TYR  54   0.567  12.612   4.476
  Start of MODEL    7
 4826    HB2  TYR  54           HB2      TYR  54   2.436  11.092   3.700
  Start of MODEL    7
 4827    HB3  TYR  54           HB3      TYR  54   1.191   9.972   3.156
  Start of MODEL    7
 4828    HD1  TYR  54           HD1      TYR  54  -0.206  10.499   1.229
  Start of MODEL    7
 4829    HD2  TYR  54           HD2      TYR  54   2.795  13.206   2.559
  Start of MODEL    7
 4830    HE1  TYR  54           HE1      TYR  54  -0.414  11.757  -0.873
  Start of MODEL    7
 4831    HE2  TYR  54           HE2      TYR  54   2.598  14.467   0.461
  Start of MODEL    7
 4832    HH   TYR  54           HH       TYR  54   0.047  14.200  -1.605
  Start of MODEL    7
 4833    H    PHE  55           H        PHE  55  -0.692   9.263   4.417
  Start of MODEL    7
 4834    HA   PHE  55           HA       PHE  55  -2.824   9.924   2.713
  Start of MODEL    7
 4835    HB2  PHE  55           HB2      PHE  55  -2.225   7.530   4.419
  Start of MODEL    7
 4836    HB3  PHE  55           HB3      PHE  55  -3.718   7.643   3.489
  Start of MODEL    7
 4837    HD1  PHE  55           HD1      PHE  55  -0.054   7.408   3.275
  Start of MODEL    7
 4838    HD2  PHE  55           HD2      PHE  55  -3.718   7.476   1.107
  Start of MODEL    7
 4839    HE1  PHE  55           HE1      PHE  55   1.121   6.636   1.255
  Start of MODEL    7
 4840    HE2  PHE  55           HE2      PHE  55  -2.548   6.700  -0.908
  Start of MODEL    7
 4841    HZ   PHE  55           HZ       PHE  55  -0.125   6.279  -0.839
  Start of MODEL    7
 4842    H    GLU  56           H        GLU  56  -2.592  10.091   6.203
  Start of MODEL    7
 4843    HA   GLU  56           HA       GLU  56  -5.385   9.880   6.685
  Start of MODEL    7
 4844    HB2  GLU  56           HB2      GLU  56  -4.940  10.669   8.906
  Start of MODEL    7
 4845    HB3  GLU  56           HB3      GLU  56  -3.641   9.579   8.440
  Start of MODEL    7
 4846    HG2  GLU  56           HG2      GLU  56  -2.133  11.358   8.127
  Start of MODEL    7
 4847    HG3  GLU  56           HG3      GLU  56  -3.421  12.559   8.212
  Start of MODEL    7
 4848    H    GLN  57           H        GLN  57  -3.461  12.369   5.379
  Start of MODEL    7
 4849    HA   GLN  57           HA       GLN  57  -5.015  14.610   6.146
  Start of MODEL    7
 4850    HB2  GLN  57           HB2      GLN  57  -3.331  14.254   3.659
  Start of MODEL    7
 4851    HB3  GLN  57           HB3      GLN  57  -3.873  15.785   4.335
  Start of MODEL    7
 4852    HG2  GLN  57           HG2      GLN  57  -1.997  13.834   5.653
  Start of MODEL    7
 4853    HG3  GLN  57           HG3      GLN  57  -1.545  15.344   4.867
  Start of MODEL    7
 4854   HE21  GLN  57          HE21      GLN  57  -1.220  14.377   7.625
  Start of MODEL    7
 4855   HE22  GLN  57          HE22      GLN  57  -1.932  15.599   8.626
  Start of MODEL    7
 4856    H    PHE  58           H        PHE  58  -5.729  12.026   4.075
  Start of MODEL    7
 4857    HA   PHE  58           HA       PHE  58  -7.620  13.545   2.472
  Start of MODEL    7
 4858    HB2  PHE  58           HB2      PHE  58  -6.893  10.610   2.493
  Start of MODEL    7
 4859    HB3  PHE  58           HB3      PHE  58  -8.115  11.310   1.439
  Start of MODEL    7
 4860    HD1  PHE  58           HD1      PHE  58  -4.531  11.420   2.302
  Start of MODEL    7
 4861    HD2  PHE  58           HD2      PHE  58  -7.521  12.371  -0.571
  Start of MODEL    7
 4862    HE1  PHE  58           HE1      PHE  58  -2.781  11.950   0.656
  Start of MODEL    7
 4863    HE2  PHE  58           HE2      PHE  58  -5.775  12.914  -2.217
  Start of MODEL    7
 4864    HZ   PHE  58           HZ       PHE  58  -3.427  12.795  -1.603
  Start of MODEL    7
 4865    H    GLY  59           H        GLY  59  -7.582  11.817   5.399
  Start of MODEL    7
 4866    HA2  GLY  59           HA2      GLY  59 -10.098  12.556   6.214
  Start of MODEL    7
 4867    HA3  GLY  59           HA3      GLY  59 -10.339  11.019   5.397
  Start of MODEL    7
 4868    H    ASP  60           H        ASP  60 -10.246   9.276   6.650
  Start of MODEL    7
 4869    HA   ASP  60           HA       ASP  60  -8.679   9.423   9.150
  Start of MODEL    7
 4870    HB2  ASP  60           HB2      ASP  60 -11.366   8.078   8.773
  Start of MODEL    7
 4871    HB3  ASP  60           HB3      ASP  60 -10.412   8.061  10.249
  Start of MODEL    7
 4872    H    ILE  61           H        ILE  61  -7.286   7.749   9.471
  Start of MODEL    7
 4873    HA   ILE  61           HA       ILE  61  -7.462   5.481   7.638
  Start of MODEL    7
 4874    HB   ILE  61           HB       ILE  61  -5.188   6.750   9.136
  Start of MODEL    7
 4875   HD12  ILE  61          HD11      ILE  61  -3.646   7.446   5.840
  Start of MODEL    7
 4876   HD11  ILE  61          HD12      ILE  61  -3.158   6.163   6.949
  Start of MODEL    7
 4877   HD13  ILE  61          HD13      ILE  61  -3.521   7.774   7.570
  Start of MODEL    7
 4878    H    GLU  62           H        GLU  62  -7.652   3.442   8.298
  Start of MODEL    7
 4879    HA   GLU  62           HA       GLU  62  -8.229   2.738  11.023
  Start of MODEL    7
 4880    HB2  GLU  62           HB2      GLU  62  -7.751   1.127   8.509
  Start of MODEL    7
 4881    HB3  GLU  62           HB3      GLU  62  -8.169   0.400  10.040
  Start of MODEL    7
 4882    HG2  GLU  62           HG2      GLU  62  -9.865   2.372   8.537
  Start of MODEL    7
 4883    HG3  GLU  62           HG3      GLU  62 -10.074   0.624   8.500
  Start of MODEL    7
 4884    H    GLU  63           H        GLU  63  -5.719   1.999   8.681
  Start of MODEL    7
 4885    HA   GLU  63           HA       GLU  63  -3.655   1.815  10.687
  Start of MODEL    7
 4886    HB2  GLU  63           HB2      GLU  63  -4.689  -0.428  10.828
  Start of MODEL    7
 4887    HB3  GLU  63           HB3      GLU  63  -4.401  -0.659   9.108
  Start of MODEL    7
 4888    HG2  GLU  63           HG2      GLU  63  -2.733  -1.809  10.431
  Start of MODEL    7
 4889    HG3  GLU  63           HG3      GLU  63  -1.998  -0.518   9.480
  Start of MODEL    7
 4890    H    ALA  64           H        ALA  64  -1.604   2.071   9.810
  Start of MODEL    7
 4891    HA   ALA  64           HA       ALA  64  -1.395   2.092   6.877
  Start of MODEL    7
 4892    HB1  ALA  64           HB1      ALA  64  -0.500   4.367   8.651
  Start of MODEL    7
 4893    HB3  ALA  64           HB2      ALA  64  -1.875   4.400   7.550
  Start of MODEL    7
 4894    HB2  ALA  64           HB3      ALA  64  -0.238   4.251   6.911
  Start of MODEL    7
 4895    H    VAL  65           H        VAL  65   0.251   0.787   6.365
  Start of MODEL    7
 4896    HA   VAL  65           HA       VAL  65   2.606   0.709   8.124
  Start of MODEL    7
 4897    HB   VAL  65           HB       VAL  65   2.693  -1.759   7.976
  Start of MODEL    7
 4898    H    VAL  66           H        VAL  66   4.525   0.007   7.189
  Start of MODEL    7
 4899    HA   VAL  66           HA       VAL  66   4.598  -0.060   4.245
  Start of MODEL    7
 4900    HB   VAL  66           HB       VAL  66   6.863   0.180   6.248
  Start of MODEL    7
 4901    H    ILE  67           H        ILE  67   5.355  -1.932   3.166
  Start of MODEL    7
 4902    HA   ILE  67           HA       ILE  67   4.839  -4.297   4.760
  Start of MODEL    7
 4903    HB   ILE  67           HB       ILE  67   5.063  -3.877   1.794
  Start of MODEL    7
 4904   HD12  ILE  67          HD11      ILE  67   1.531  -4.289   4.106
  Start of MODEL    7
 4905   HD11  ILE  67          HD12      ILE  67   3.067  -3.842   4.848
  Start of MODEL    7
 4906   HD13  ILE  67          HD13      ILE  67   2.778  -5.511   4.354
  Start of MODEL    7
 4907    H    THR  68           H        THR  68   6.235  -5.659   5.430
  Start of MODEL    7
 4908    HA   THR  68           HA       THR  68   8.953  -5.678   4.316
  Start of MODEL    7
 4909    HB   THR  68           HB       THR  68   9.724  -6.230   6.655
  Start of MODEL    7
 4910    HG1  THR  68           HG1      THR  68   7.891  -5.171   8.128
  Start of MODEL    7
 4911   HG21  THR  68          HG21      THR  68   8.380  -3.551   6.281
  Start of MODEL    7
 4912   HG23  THR  68          HG22      THR  68  10.017  -3.975   5.782
  Start of MODEL    7
 4913   HG22  THR  68          HG23      THR  68   9.607  -3.915   7.495
  Start of MODEL    7
 4914    H    ASP  69           H        ASP  69   9.895  -7.765   4.117
  Start of MODEL    7
 4915    HA   ASP  69           HA       ASP  69   8.262  -9.990   3.869
  Start of MODEL    7
 4916    HB2  ASP  69           HB2      ASP  69  10.363 -10.129   2.819
  Start of MODEL    7
 4917    HB3  ASP  69           HB3      ASP  69  11.228  -9.697   4.293
  Start of MODEL    7
 4918    H    ARG  70           H        ARG  70   7.469 -11.463   5.226
  Start of MODEL    7
 4919    HA   ARG  70           HA       ARG  70   7.354 -10.909   7.942
  Start of MODEL    7
 4920    HB2  ARG  70           HB2      ARG  70   6.050 -12.880   8.227
  Start of MODEL    7
 4921    HB3  ARG  70           HB3      ARG  70   5.582 -12.075   6.740
  Start of MODEL    7
 4922    HG2  ARG  70           HG2      ARG  70   7.426 -14.439   6.874
  Start of MODEL    7
 4923    HG3  ARG  70           HG3      ARG  70   5.692 -14.538   6.571
  Start of MODEL    7
 4924    HD2  ARG  70           HD2      ARG  70   6.191 -12.851   4.676
  Start of MODEL    7
 4925    HD3  ARG  70           HD3      ARG  70   7.854 -13.393   4.862
  Start of MODEL    7
 4926    HE   ARG  70           HE       ARG  70   5.652 -15.278   4.303
  Start of MODEL    7
 4927   HH11  ARG  70          HH11      ARG  70   8.848 -13.982   3.548
  Start of MODEL    7
 4928   HH12  ARG  70          HH12      ARG  70   9.179 -15.210   2.361
  Start of MODEL    7
 4929   HH21  ARG  70          HH21      ARG  70   6.104 -16.864   2.729
  Start of MODEL    7
 4930   HH22  ARG  70          HH22      ARG  70   7.644 -16.852   1.909
  Start of MODEL    7
 4931    H    ASN  71           H        ASN  71   9.738 -12.754   6.244
  Start of MODEL    7
 4932    HA   ASN  71           HA       ASN  71  10.503 -14.184   8.656
  Start of MODEL    7
 4933    HB2  ASN  71           HB2      ASN  71  11.554 -14.245   5.830
  Start of MODEL    7
 4934    HB3  ASN  71           HB3      ASN  71  12.337 -15.103   7.149
  Start of MODEL    7
 4935   HD21  ASN  71          HD21      ASN  71   9.836 -15.763   8.471
  Start of MODEL    7
 4936   HD22  ASN  71          HD22      ASN  71   9.101 -17.013   7.524
  Start of MODEL    7
 4937    H    THR  72           H        THR  72  12.124 -11.938   6.388
  Start of MODEL    7
 4938    HA   THR  72           HA       THR  72  14.246 -11.552   8.353
  Start of MODEL    7
 4939    HB   THR  72           HB       THR  72  15.311 -10.179   6.546
  Start of MODEL    7
 4940    HG1  THR  72           HG1      THR  72  13.122 -11.180   4.982
  Start of MODEL    7
 4941   HG21  THR  72          HG21      THR  72  14.513 -12.990   5.790
  Start of MODEL    7
 4942   HG23  THR  72          HG22      THR  72  15.866 -12.542   6.833
  Start of MODEL    7
 4943   HG22  THR  72          HG23      THR  72  15.877 -12.093   5.126
  Start of MODEL    7
 4944    H    GLN  73           H        GLN  73  11.459  -9.985   7.241
  Start of MODEL    7
 4945    HA   GLN  73           HA       GLN  73  10.324  -8.134   7.975
  Start of MODEL    7
 4946    HB2  GLN  73           HB2      GLN  73  12.567  -7.925   9.993
  Start of MODEL    7
 4947    HB3  GLN  73           HB3      GLN  73  11.070  -7.003  10.037
  Start of MODEL    7
 4948    HG2  GLN  73           HG2      GLN  73   9.784  -9.006  10.385
  Start of MODEL    7
 4949    HG3  GLN  73           HG3      GLN  73  11.222 -10.007  10.171
  Start of MODEL    7
 4950   HE21  GLN  73          HE21      GLN  73  12.935  -8.201  11.665
  Start of MODEL    7
 4951   HE22  GLN  73          HE22      GLN  73  12.527  -8.425  13.330
  Start of MODEL    7
 4952    H    LYS  74           H        LYS  74  12.325  -8.018   5.885
  Start of MODEL    7
 4953    HA   LYS  74           HA       LYS  74  13.434  -5.330   6.161
  Start of MODEL    7
 4954    HB2  LYS  74           HB2      LYS  74  13.846  -7.402   4.001
  Start of MODEL    7
 4955    HB3  LYS  74           HB3      LYS  74  14.655  -5.845   4.073
  Start of MODEL    7
 4956    HG2  LYS  74           HG2      LYS  74  14.934  -8.113   6.035
  Start of MODEL    7
 4957    HG3  LYS  74           HG3      LYS  74  16.135  -7.585   4.856
  Start of MODEL    7
 4958    HD2  LYS  74           HD2      LYS  74  15.101  -5.924   7.161
  Start of MODEL    7
 4959    HD3  LYS  74           HD3      LYS  74  16.635  -6.793   7.134
  Start of MODEL    7
 4960    HE2  LYS  74           HE2      LYS  74  15.870  -4.647   5.168
  Start of MODEL    7
 4961    HE3  LYS  74           HE3      LYS  74  16.815  -4.359   6.628
  Start of MODEL    7
 4962    HZ3  LYS  74           HZ1      LYS  74  18.577  -5.657   5.821
  Start of MODEL    7
 4963    HZ2  LYS  74           HZ2      LYS  74  18.105  -4.702   4.503
  Start of MODEL    7
 4964    HZ1  LYS  74           HZ3      LYS  74  17.645  -6.333   4.578
  Start of MODEL    7
 4965    H    SER  75           H        SER  75  12.687  -3.614   5.064
  Start of MODEL    7
 4966    HA   SER  75           HA       SER  75  10.090  -3.587   4.070
  Start of MODEL    7
 4967    HB2  SER  75           HB2      SER  75  11.243  -1.598   4.950
  Start of MODEL    7
 4968    HB3  SER  75           HB3      SER  75  12.323  -1.605   3.557
  Start of MODEL    7
 4969    HG   SER  75           HG       SER  75  10.349  -0.188   3.552
  Start of MODEL    7
 4970    H    ARG  76           H        ARG  76   9.193  -3.744   2.120
  Start of MODEL    7
 4971    HA   ARG  76           HA       ARG  76  10.888  -4.649  -0.091
  Start of MODEL    7
 4972    HB2  ARG  76           HB2      ARG  76   7.876  -4.670   0.187
  Start of MODEL    7
 4973    HB3  ARG  76           HB3      ARG  76   8.786  -5.380  -1.138
  Start of MODEL    7
 4974    HG2  ARG  76           HG2      ARG  76   9.944  -6.728   0.781
  Start of MODEL    7
 4975    HG3  ARG  76           HG3      ARG  76   8.480  -6.314   1.671
  Start of MODEL    7
 4976    HD2  ARG  76           HD2      ARG  76   8.229  -8.470   0.566
  Start of MODEL    7
 4977    HD3  ARG  76           HD3      ARG  76   7.119  -7.282  -0.119
  Start of MODEL    7
 4978    HE   ARG  76           HE       ARG  76   9.145  -7.060  -1.806
  Start of MODEL    7
 4979   HH11  ARG  76          HH11      ARG  76   7.613  -9.919  -0.509
  Start of MODEL    7
 4980   HH12  ARG  76          HH12      ARG  76   8.012 -10.918  -1.874
  Start of MODEL    7
 4981   HH21  ARG  76          HH21      ARG  76   9.677  -8.332  -3.600
  Start of MODEL    7
 4982   HH22  ARG  76          HH22      ARG  76   9.209 -10.006  -3.643
  Start of MODEL    7
 4983    H    GLY  77           H        GLY  77  10.144  -1.791   0.953
  Start of MODEL    7
 4984    HA2  GLY  77           HA2      GLY  77  10.077   0.283  -0.050
  Start of MODEL    7
 4985    HA3  GLY  77           HA3      GLY  77  10.311  -0.531  -1.585
  Start of MODEL    7
 4986    H    TYR  78           H        TYR  78   7.558  -1.376   0.354
  Start of MODEL    7
 4987    HA   TYR  78           HA       TYR  78   5.872   0.666  -0.710
  Start of MODEL    7
 4988    HB2  TYR  78           HB2      TYR  78   4.310  -0.829  -1.903
  Start of MODEL    7
 4989    HB3  TYR  78           HB3      TYR  78   5.880  -0.731  -2.678
  Start of MODEL    7
 4990    HD1  TYR  78           HD1      TYR  78   3.725  -2.899  -0.576
  Start of MODEL    7
 4991    HD2  TYR  78           HD2      TYR  78   7.142  -2.670  -3.094
  Start of MODEL    7
 4992    HE1  TYR  78           HE1      TYR  78   3.823  -5.352  -0.659
  Start of MODEL    7
 4993    HE2  TYR  78           HE2      TYR  78   7.254  -5.123  -3.177
  Start of MODEL    7
 4994    HH   TYR  78           HH       TYR  78   4.734  -7.099  -2.226
  Start of MODEL    7
 4995    H    GLY  79           H        GLY  79   3.468   0.141  -0.062
  Start of MODEL    7
 4996    HA2  GLY  79           HA2      GLY  79   3.397  -1.341   2.438
  Start of MODEL    7
 4997    HA3  GLY  79           HA3      GLY  79   3.303   0.400   2.600
  Start of MODEL    7
 4998    H    PHE  80           H        PHE  80   1.279  -0.514   3.678
  Start of MODEL    7
 4999    HA   PHE  80           HA       PHE  80  -0.917  -0.327   1.747
  Start of MODEL    7
 5000    HB2  PHE  80           HB2      PHE  80  -0.595  -2.376   3.921
  Start of MODEL    7
 5001    HB3  PHE  80           HB3      PHE  80  -2.194  -1.893   3.368
  Start of MODEL    7
 5002    HD1  PHE  80           HD1      PHE  80   0.850  -3.705   2.548
  Start of MODEL    7
 5003    HD2  PHE  80           HD2      PHE  80  -2.944  -2.432   1.131
  Start of MODEL    7
 5004    HE1  PHE  80           HE1      PHE  80   0.974  -5.360   0.734
  Start of MODEL    7
 5005    HE2  PHE  80           HE2      PHE  80  -2.832  -4.076  -0.683
  Start of MODEL    7
 5006    HZ   PHE  80           HZ       PHE  80  -0.866  -5.551  -0.882
  Start of MODEL    7
 5007    H    VAL  81           H        VAL  81  -2.517   0.907   2.294
  Start of MODEL    7
 5008    HA   VAL  81           HA       VAL  81  -2.751   1.805   5.100
  Start of MODEL    7
 5009    HB   VAL  81           HB       VAL  81  -3.403   3.461   2.648
  Start of MODEL    7
 5010    H    THR  82           H        THR  82  -4.609   1.338   6.047
  Start of MODEL    7
 5011    HA   THR  82           HA       THR  82  -6.874   0.542   4.361
  Start of MODEL    7
 5012    HB   THR  82           HB       THR  82  -6.543   0.057   7.334
  Start of MODEL    7
 5013    HG1  THR  82           HG1      THR  82  -5.490  -1.273   5.110
  Start of MODEL    7
 5014   HG21  THR  82          HG21      THR  82  -8.831  -0.103   6.327
  Start of MODEL    7
 5015   HG23  THR  82          HG22      THR  82  -8.247  -1.614   7.023
  Start of MODEL    7
 5016   HG22  THR  82          HG23      THR  82  -8.221  -1.379   5.276
  Start of MODEL    7
 5017    H    MET  83           H        MET  83  -8.156   2.270   4.012
  Start of MODEL    7
 5018    HA   MET  83           HA       MET  83  -8.184   4.464   5.886
  Start of MODEL    7
 5019    HB2  MET  83           HB2      MET  83  -9.662   4.098   3.277
  Start of MODEL    7
 5020    HB3  MET  83           HB3      MET  83  -9.602   5.585   4.215
  Start of MODEL    7
 5021    HG2  MET  83           HG2      MET  83  -7.201   4.221   3.023
  Start of MODEL    7
 5022    HG3  MET  83           HG3      MET  83  -8.078   5.550   2.269
  Start of MODEL    7
 5023    HE3  MET  83           HE1      MET  83  -8.016   8.047   3.114
  Start of MODEL    7
 5024    HE2  MET  83           HE2      MET  83  -7.352   8.526   4.676
  Start of MODEL    7
 5025    HE1  MET  83           HE3      MET  83  -8.778   7.489   4.602
  Start of MODEL    7
 5026    H    LYS  84           H        LYS  84  -9.998   5.297   6.881
  Start of MODEL    7
 5027    HA   LYS  84           HA       LYS  84 -11.769   3.319   7.915
  Start of MODEL    7
 5028    HB2  LYS  84           HB2      LYS  84 -10.835   5.287   9.184
  Start of MODEL    7
 5029    HB3  LYS  84           HB3      LYS  84 -11.947   6.311   8.288
  Start of MODEL    7
 5030    HG2  LYS  84           HG2      LYS  84 -13.825   5.379   9.332
  Start of MODEL    7
 5031    HG3  LYS  84           HG3      LYS  84 -12.919   3.978   9.906
  Start of MODEL    7
 5032    HD2  LYS  84           HD2      LYS  84 -12.391   6.800  10.816
  Start of MODEL    7
 5033    HD3  LYS  84           HD3      LYS  84 -13.457   5.682  11.668
  Start of MODEL    7
 5034    HE2  LYS  84           HE2      LYS  84 -10.535   5.166  11.081
  Start of MODEL    7
 5035    HE3  LYS  84           HE3      LYS  84 -11.158   5.786  12.609
  Start of MODEL    7
 5036    HZ1  LYS  84           HZ1      LYS  84 -11.878   3.164  11.401
  Start of MODEL    7
 5037    HZ3  LYS  84           HZ2      LYS  84 -12.396   3.746  12.908
  Start of MODEL    7
 5038    HZ2  LYS  84           HZ3      LYS  84 -10.768   3.388  12.658
  Start of MODEL    7
 5039    H    ASP  85           H        ASP  85 -11.882   5.372   5.195
  Start of MODEL    7
 5040    HA   ASP  85           HA       ASP  85 -14.558   4.451   4.614
  Start of MODEL    7
 5041    HB2  ASP  85           HB2      ASP  85 -14.980   6.632   5.699
  Start of MODEL    7
 5042    HB3  ASP  85           HB3      ASP  85 -13.923   7.408   4.522
  Start of MODEL    7
 5043    H    ARG  86           H        ARG  86 -15.095   4.552   2.425
  Start of MODEL    7
 5044    HA   ARG  86           HA       ARG  86 -12.918   3.960   0.716
  Start of MODEL    7
 5045    HB2  ARG  86           HB2      ARG  86 -14.664   2.750  -0.018
  Start of MODEL    7
 5046    HB3  ARG  86           HB3      ARG  86 -15.839   3.881   0.630
  Start of MODEL    7
 5047    HG2  ARG  86           HG2      ARG  86 -15.281   5.361  -1.353
  Start of MODEL    7
 5048    HG3  ARG  86           HG3      ARG  86 -14.469   3.944  -2.029
  Start of MODEL    7
 5049    HD2  ARG  86           HD2      ARG  86 -16.946   4.400  -2.609
  Start of MODEL    7
 5050    HD3  ARG  86           HD3      ARG  86 -16.441   2.753  -2.228
  Start of MODEL    7
 5051    HE   ARG  86           HE       ARG  86 -17.317   4.146   0.099
  Start of MODEL    7
 5052   HH11  ARG  86          HH11      ARG  86 -18.494   2.539  -2.778
  Start of MODEL    7
 5053   HH12  ARG  86          HH12      ARG  86 -20.004   2.058  -2.062
  Start of MODEL    7
 5054   HH21  ARG  86          HH21      ARG  86 -19.291   3.552   1.055
  Start of MODEL    7
 5055   HH22  ARG  86          HH22      ARG  86 -20.464   2.638   0.148
  Start of MODEL    7
 5056    H    ALA  87           H        ALA  87 -15.000   6.838   1.042
  Start of MODEL    7
 5057    HA   ALA  87           HA       ALA  87 -14.290   7.991  -1.442
  Start of MODEL    7
 5058    HB3  ALA  87           HB1      ALA  87 -16.261   8.685  -0.151
  Start of MODEL    7
 5059    HB2  ALA  87           HB2      ALA  87 -15.223  10.049  -0.560
  Start of MODEL    7
 5060    HB1  ALA  87           HB3      ALA  87 -15.206   9.387   1.073
  Start of MODEL    7
 5061    H    SER  88           H        SER  88 -12.978   8.368   1.828
  Start of MODEL    7
 5062    HA   SER  88           HA       SER  88 -11.050  10.330   1.176
  Start of MODEL    7
 5063    HB2  SER  88           HB2      SER  88 -10.882   8.251   3.371
  Start of MODEL    7
 5064    HB3  SER  88           HB3      SER  88 -10.055   9.805   3.320
  Start of MODEL    7
 5065    HG   SER  88           HG       SER  88 -12.226  10.756   3.291
  Start of MODEL    7
 5066    H    ALA  89           H        ALA  89 -11.032   6.804   1.210
  Start of MODEL    7
 5067    HA   ALA  89           HA       ALA  89  -8.313   6.409   0.615
  Start of MODEL    7
 5068    HB1  ALA  89           HB1      ALA  89  -9.855   4.646   1.401
  Start of MODEL    7
 5069    HB3  ALA  89           HB2      ALA  89  -8.941   4.175  -0.031
  Start of MODEL    7
 5070    HB2  ALA  89           HB3      ALA  89 -10.633   4.655  -0.184
  Start of MODEL    7
 5071    H    GLU  90           H        GLU  90 -11.139   6.879  -1.475
  Start of MODEL    7
 5072    HA   GLU  90           HA       GLU  90  -9.707   6.334  -3.862
  Start of MODEL    7
 5073    HB2  GLU  90           HB2      GLU  90 -12.153   6.136  -3.807
  Start of MODEL    7
 5074    HB3  GLU  90           HB3      GLU  90 -12.277   7.883  -3.577
  Start of MODEL    7
 5075    HG2  GLU  90           HG2      GLU  90 -11.087   8.216  -5.702
  Start of MODEL    7
 5076    HG3  GLU  90           HG3      GLU  90 -11.068   6.468  -5.939
  Start of MODEL    7
 5077    H    ARG  91           H        ARG  91 -10.451   9.312  -2.093
  Start of MODEL    7
 5078    HA   ARG  91           HA       ARG  91  -9.588  11.092  -4.071
  Start of MODEL    7
 5079    HB2  ARG  91           HB2      ARG  91  -9.368  11.415  -1.075
  Start of MODEL    7
 5080    HB3  ARG  91           HB3      ARG  91  -9.243  12.709  -2.261
  Start of MODEL    7
 5081    HG2  ARG  91           HG2      ARG  91 -11.633  11.618  -2.930
  Start of MODEL    7
 5082    HG3  ARG  91           HG3      ARG  91 -11.611  11.361  -1.184
  Start of MODEL    7
 5083    HD2  ARG  91           HD2      ARG  91 -12.639  13.478  -1.645
  Start of MODEL    7
 5084    HD3  ARG  91           HD3      ARG  91 -11.070  13.764  -0.890
  Start of MODEL    7
 5085    HE   ARG  91           HE       ARG  91 -10.845  13.770  -3.720
  Start of MODEL    7
 5086   HH11  ARG  91          HH11      ARG  91 -11.984  15.753  -1.058
  Start of MODEL    7
 5087   HH12  ARG  91          HH12      ARG  91 -11.727  17.245  -1.909
  Start of MODEL    7
 5088   HH21  ARG  91          HH21      ARG  91 -10.538  15.726  -4.829
  Start of MODEL    7
 5089   HH22  ARG  91          HH22      ARG  91 -10.907  17.238  -4.044
  Start of MODEL    7
 5090    H    ALA  92           H        ALA  92  -7.810   9.359  -1.569
  Start of MODEL    7
 5091    HA   ALA  92           HA       ALA  92  -5.252  10.347  -2.151
  Start of MODEL    7
 5092    HB2  ALA  92           HB1      ALA  92  -5.958   7.568  -1.209
  Start of MODEL    7
 5093    HB1  ALA  92           HB2      ALA  92  -5.812   8.986  -0.167
  Start of MODEL    7
 5094    HB3  ALA  92           HB3      ALA  92  -4.399   8.377  -1.036
  Start of MODEL    7
 5095    H    CYS  93           H        CYS  93  -7.109   7.722  -3.637
  Start of MODEL    7
 5096    HA   CYS  93           HA       CYS  93  -4.851   6.850  -5.221
  Start of MODEL    7
 5097    HB2  CYS  93           HB2      CYS  93  -7.739   5.970  -5.326
  Start of MODEL    7
 5098    HB3  CYS  93           HB3      CYS  93  -6.384   5.170  -6.114
  Start of MODEL    7
 5099    HG   CYS  93           HG       CYS  93  -6.892   5.433  -2.742
  Start of MODEL    7
 5100    H    LYS  94           H        LYS  94  -7.128   9.296  -5.525
  Start of MODEL    7
 5101    HA   LYS  94           HA       LYS  94  -7.704   8.991  -8.301
  Start of MODEL    7
 5102    HB2  LYS  94           HB2      LYS  94  -9.085  10.223  -6.476
  Start of MODEL    7
 5103    HB3  LYS  94           HB3      LYS  94  -8.020  11.584  -6.811
  Start of MODEL    7
 5104    HG2  LYS  94           HG2      LYS  94 -10.163  11.654  -8.061
  Start of MODEL    7
 5105    HG3  LYS  94           HG3      LYS  94  -8.738  11.660  -9.102
  Start of MODEL    7
 5106    HD2  LYS  94           HD2      LYS  94  -9.012   9.253  -9.492
  Start of MODEL    7
 5107    HD3  LYS  94           HD3      LYS  94 -10.427   9.245  -8.440
  Start of MODEL    7
 5108    HE2  LYS  94           HE2      LYS  94 -10.293  11.051 -10.825
  Start of MODEL    7
 5109    HE3  LYS  94           HE3      LYS  94 -10.763   9.361 -10.999
  Start of MODEL    7
 5110    HZ3  LYS  94           HZ1      LYS  94 -12.663   9.678  -9.726
  Start of MODEL    7
 5111    HZ2  LYS  94           HZ2      LYS  94 -12.586  11.092 -10.663
  Start of MODEL    7
 5112    HZ1  LYS  94           HZ3      LYS  94 -12.098  11.116  -9.035
  Start of MODEL    7
 5113    H    ASP  95           H        ASP  95  -5.312  10.698  -6.429
  Start of MODEL    7
 5114    HA   ASP  95           HA       ASP  95  -3.960  11.338  -8.968
  Start of MODEL    7
 5115    HB2  ASP  95           HB2      ASP  95  -4.357  13.238  -7.270
  Start of MODEL    7
 5116    HB3  ASP  95           HB3      ASP  95  -3.152  12.431  -6.269
  Start of MODEL    7
 5117    HA   PRO  96           HA       PRO  96  -2.195   7.505  -7.361
  Start of MODEL    7
 5118    HB2  PRO  96           HB2      PRO  96  -1.238   6.606  -9.732
  Start of MODEL    7
 5119    HB3  PRO  96           HB3      PRO  96  -2.941   6.488  -9.274
  Start of MODEL    7
 5120    HG2  PRO  96           HG2      PRO  96  -1.585   8.503 -11.024
  Start of MODEL    7
 5121    HG3  PRO  96           HG3      PRO  96  -3.128   7.668 -11.273
  Start of MODEL    7
 5122    HD2  PRO  96           HD2      PRO  96  -2.976  10.202 -10.346
  Start of MODEL    7
 5123    HD3  PRO  96           HD3      PRO  96  -4.267   9.085  -9.858
  Start of MODEL    7
 5124    H    ASN  97           H        ASN  97  -0.611  10.275  -8.225
  Start of MODEL    7
 5125    HA   ASN  97           HA       ASN  97   2.004   8.984  -7.818
  Start of MODEL    7
 5126    HB2  ASN  97           HB2      ASN  97   1.211  10.961  -9.921
  Start of MODEL    7
 5127    HB3  ASN  97           HB3      ASN  97   2.880  10.849  -9.395
  Start of MODEL    7
 5128   HD21  ASN  97          HD21      ASN  97   2.675   7.932  -8.926
  Start of MODEL    7
 5129   HD22  ASN  97          HD22      ASN  97   2.688   7.219 -10.500
  Start of MODEL    7
 5130    HA   PRO  98           HA       PRO  98   1.653  12.650  -4.949
  Start of MODEL    7
 5131    HB2  PRO  98           HB2      PRO  98   1.688  11.334  -2.602
  Start of MODEL    7
 5132    HB3  PRO  98           HB3      PRO  98   0.186  11.652  -3.477
  Start of MODEL    7
 5133    HG2  PRO  98           HG2      PRO  98   1.796   9.139  -3.330
  Start of MODEL    7
 5134    HG3  PRO  98           HG3      PRO  98   0.035   9.349  -3.296
  Start of MODEL    7
 5135    HD2  PRO  98           HD2      PRO  98   1.460   8.607  -5.524
  Start of MODEL    7
 5136    HD3  PRO  98           HD3      PRO  98  -0.115   9.422  -5.575
  Start of MODEL    7
 5137    H    ILE  99           H        ILE  99   3.482  13.555  -4.075
  Start of MODEL    7
 5138    HA   ILE  99           HA       ILE  99   5.940  12.046  -4.154
  Start of MODEL    7
 5139    HB   ILE  99           HB       ILE  99   5.398  14.891  -3.293
  Start of MODEL    7
 5140   HD11  ILE  99          HD11      ILE  99   6.550  12.521  -5.969
  Start of MODEL    7
 5141   HD13  ILE  99          HD12      ILE  99   7.956  13.544  -5.700
  Start of MODEL    7
 5142   HD12  ILE  99          HD13      ILE  99   6.938  13.803  -7.113
  Start of MODEL    7
 5143    H    ILE 100           H        ILE 100   6.564  10.773  -2.573
  Start of MODEL    7
 5144    HA   ILE 100           HA       ILE 100   5.951  11.551   0.204
  Start of MODEL    7
 5145    HB   ILE 100           HB       ILE 100   5.976   8.740  -0.915
  Start of MODEL    7
 5146   HD12  ILE 100          HD11      ILE 100   2.235   8.625  -0.476
  Start of MODEL    7
 5147   HD11  ILE 100          HD12      ILE 100   3.425   7.987   0.656
  Start of MODEL    7
 5148   HD13  ILE 100          HD13      ILE 100   3.599   7.681  -1.069
  Start of MODEL    7
 5149    H    ASP 101           H        ASP 101   7.708  11.950   1.298
  Start of MODEL    7
 5150    HA   ASP 101           HA       ASP 101   9.849  11.942   2.070
  Start of MODEL    7
 5151    HB2  ASP 101           HB2      ASP 101   9.285   9.586   2.561
  Start of MODEL    7
 5152    HB3  ASP 101           HB3      ASP 101   9.869   9.118   0.970
  Start of MODEL    7
 5153    H    GLY 102           H        GLY 102   9.368  13.036  -0.470
  Start of MODEL    7
 5154    HA2  GLY 102           HA2      GLY 102  10.643  14.028  -2.112
  Start of MODEL    7
 5155    HA3  GLY 102           HA3      GLY 102  12.046  13.219  -1.433
  Start of MODEL    7
 5156    H    ARG 103           H        ARG 103   9.697  10.950  -2.047
  Start of MODEL    7
 5157    HA   ARG 103           HA       ARG 103  10.884  10.324  -4.667
  Start of MODEL    7
 5158    HB2  ARG 103           HB2      ARG 103  11.538   8.704  -2.976
  Start of MODEL    7
 5159    HB3  ARG 103           HB3      ARG 103   9.856   8.449  -2.530
  Start of MODEL    7
 5160    HG2  ARG 103           HG2      ARG 103  10.568   6.618  -3.888
  Start of MODEL    7
 5161    HG3  ARG 103           HG3      ARG 103   9.432   7.597  -4.818
  Start of MODEL    7
 5162    HD2  ARG 103           HD2      ARG 103  11.486   8.764  -5.781
  Start of MODEL    7
 5163    HD3  ARG 103           HD3      ARG 103  12.420   7.439  -5.085
  Start of MODEL    7
 5164    HE   ARG 103           HE       ARG 103  10.350   6.323  -6.585
  Start of MODEL    7
 5165   HH11  ARG 103          HH11      ARG 103  13.307   8.138  -7.037
  Start of MODEL    7
 5166   HH12  ARG 103          HH12      ARG 103  13.508   7.653  -8.700
  Start of MODEL    7
 5167   HH21  ARG 103          HH21      ARG 103  10.604   5.692  -8.785
  Start of MODEL    7
 5168   HH22  ARG 103          HH22      ARG 103  11.949   6.302  -9.701
  Start of MODEL    7
 5169    H    LYS 104           H        LYS 104   9.542   9.730  -6.322
  Start of MODEL    7
 5170    HA   LYS 104           HA       LYS 104   6.765  10.427  -6.104
  Start of MODEL    7
 5171    HB2  LYS 104           HB2      LYS 104   8.001  10.903  -8.159
  Start of MODEL    7
 5172    HB3  LYS 104           HB3      LYS 104   8.334   9.190  -8.377
  Start of MODEL    7
 5173    HG2  LYS 104           HG2      LYS 104   6.560   9.833  -9.842
  Start of MODEL    7
 5174    HG3  LYS 104           HG3      LYS 104   5.903   8.788  -8.580
  Start of MODEL    7
 5175    HD2  LYS 104           HD2      LYS 104   4.340  10.486  -8.678
  Start of MODEL    7
 5176    HD3  LYS 104           HD3      LYS 104   5.384  11.029  -7.370
  Start of MODEL    7
 5177    HE2  LYS 104           HE2      LYS 104   6.571  12.507  -8.886
  Start of MODEL    7
 5178    HE3  LYS 104           HE3      LYS 104   5.613  11.919 -10.243
  Start of MODEL    7
 5179    HZ1  LYS 104           HZ1      LYS 104   4.559  13.402  -7.896
  Start of MODEL    7
 5180    HZ3  LYS 104           HZ2      LYS 104   3.633  12.829  -9.194
  Start of MODEL    7
 5181    HZ2  LYS 104           HZ3      LYS 104   4.795  14.034  -9.451
  Start of MODEL    7
 5182    H    ALA 105           H        ALA 105   5.250   9.085  -5.350
  Start of MODEL    7
 5183    HA   ALA 105           HA       ALA 105   5.760   6.201  -5.476
  Start of MODEL    7
 5184    HB2  ALA 105           HB1      ALA 105   4.125   6.020  -3.661
  Start of MODEL    7
 5185    HB1  ALA 105           HB2      ALA 105   3.879   7.766  -3.715
  Start of MODEL    7
 5186    HB3  ALA 105           HB3      ALA 105   5.446   7.109  -3.241
  Start of MODEL    7
 5187    H    ASN 106           H        ASN 106   3.984   4.777  -5.881
  Start of MODEL    7
 5188    HA   ASN 106           HA       ASN 106   1.949   5.915  -7.691
  Start of MODEL    7
 5189    HB2  ASN 106           HB2      ASN 106   3.331   3.226  -7.705
  Start of MODEL    7
 5190    HB3  ASN 106           HB3      ASN 106   1.877   3.551  -8.635
  Start of MODEL    7
 5191   HD21  ASN 106          HD21      ASN 106   3.113   3.019 -10.492
  Start of MODEL    7
 5192   HD22  ASN 106          HD22      ASN 106   4.170   4.183 -11.206
  Start of MODEL    7
 5193    H    VAL 107           H        VAL 107   0.003   5.952  -6.733
  Start of MODEL    7
 5194    HA   VAL 107           HA       VAL 107  -0.583   3.853  -4.756
  Start of MODEL    7
 5195    HB   VAL 107           HB       VAL 107  -1.573   6.705  -4.846
  Start of MODEL    7
 5196    H    ASN 108           H        ASN 108  -2.281   2.585  -5.037
  Start of MODEL    7
 5197    HA   ASN 108           HA       ASN 108  -4.665   3.564  -6.373
  Start of MODEL    7
 5198    HB2  ASN 108           HB2      ASN 108  -4.824   1.586  -7.858
  Start of MODEL    7
 5199    HB3  ASN 108           HB3      ASN 108  -3.439   2.599  -8.248
  Start of MODEL    7
 5200   HD21  ASN 108          HD21      ASN 108  -4.496  -0.475  -7.006
  Start of MODEL    7
 5201   HD22  ASN 108          HD22      ASN 108  -2.940  -1.227  -7.004
  Start of MODEL    7
 5202    H    LEU 109           H        LEU 109  -6.566   2.314  -5.817
  Start of MODEL    7
 5203    HA   LEU 109           HA       LEU 109  -6.644   1.018  -3.380
  Start of MODEL    7
 5204    HB2  LEU 109           HB2      LEU 109  -8.400   0.587  -5.802
  Start of MODEL    7
 5205    HB3  LEU 109           HB3      LEU 109  -8.758  -0.047  -4.209
  Start of MODEL    7
 5206    HG   LEU 109           HG       LEU 109  -8.536   2.890  -4.887
  Start of MODEL    7
 5207   HD12  LEU 109          HD11      LEU 109 -10.956   2.932  -4.613
  Start of MODEL    7
 5208   HD11  LEU 109          HD12      LEU 109 -10.966   1.186  -4.361
  Start of MODEL    7
 5209   HD13  LEU 109          HD13      LEU 109 -10.483   1.849  -5.921
  Start of MODEL    7
 5210   HD21  LEU 109          HD21      LEU 109  -7.914   2.433  -2.588
  Start of MODEL    7
 5211   HD23  LEU 109          HD22      LEU 109  -9.379   1.474  -2.356
  Start of MODEL    7
 5212   HD22  LEU 109          HD23      LEU 109  -9.497   3.213  -2.643
  Start of MODEL    7
 5213    H    ALA 110           H        ALA 110  -6.203  -1.002  -2.657
  Start of MODEL    7
 5214    HA   ALA 110           HA       ALA 110  -4.208  -2.392  -4.026
  Start of MODEL    7
 5215    HB1  ALA 110           HB1      ALA 110  -5.846  -3.318  -1.677
  Start of MODEL    7
 5216    HB3  ALA 110           HB2      ALA 110  -4.406  -2.301  -1.598
  Start of MODEL    7
 5217    HB2  ALA 110           HB3      ALA 110  -4.282  -3.961  -2.178
  Start of MODEL    7
 5218    H    TYR 111           H        TYR 111  -7.670  -3.052  -3.827
  Start of MODEL    7
 5219    HA   TYR 111           HA       TYR 111  -7.446  -5.751  -4.675
  Start of MODEL    7
 5220    HB2  TYR 111           HB2      TYR 111  -9.783  -5.842  -4.664
  Start of MODEL    7
 5221    HB3  TYR 111           HB3      TYR 111  -9.405  -4.641  -3.437
  Start of MODEL    7
 5222    HD1  TYR 111           HD1      TYR 111  -9.271  -2.120  -4.488
  Start of MODEL    7
 5223    HD2  TYR 111           HD2      TYR 111 -11.528  -5.371  -6.047
  Start of MODEL    7
 5224    HE1  TYR 111           HE1      TYR 111 -10.779  -0.537  -5.606
  Start of MODEL    7
 5225    HE2  TYR 111           HE2      TYR 111 -13.042  -3.794  -7.169
  Start of MODEL    7
 5226    HH   TYR 111           HH       TYR 111 -13.756  -1.402  -6.870
  Start of MODEL    7
 5227    H    LEU 112           H        LEU 112  -7.225  -2.807  -6.327
  Start of MODEL    7
 5228    HA   LEU 112           HA       LEU 112  -8.128  -3.682  -8.890
  Start of MODEL    7
 5229    HB2  LEU 112           HB2      LEU 112  -6.382  -1.367  -8.063
  Start of MODEL    7
 5230    HB3  LEU 112           HB3      LEU 112  -6.952  -1.629  -9.701
  Start of MODEL    7
 5231    HG   LEU 112           HG       LEU 112  -8.668  -1.081  -7.281
  Start of MODEL    7
 5232   HD12  LEU 112          HD11      LEU 112  -9.228   0.983  -8.493
  Start of MODEL    7
 5233   HD11  LEU 112          HD12      LEU 112  -8.039   0.562  -9.728
  Start of MODEL    7
 5234   HD13  LEU 112          HD13      LEU 112  -7.517   0.893  -8.074
  Start of MODEL    7
 5235   HD23  LEU 112          HD21      LEU 112  -9.468  -1.505 -10.153
  Start of MODEL    7
 5236   HD22  LEU 112          HD22      LEU 112 -10.540  -1.102  -8.813
  Start of MODEL    7
 5237   HD21  LEU 112          HD23      LEU 112  -9.711  -2.659  -8.842
  Start of MODEL    7
 5238    H    GLY 113           H        GLY 113  -5.426  -4.517  -7.122
  Start of MODEL    7
 5239    HA2  GLY 113           HA2      GLY 113  -4.012  -5.302  -9.577
  Start of MODEL    7
 5240    HA3  GLY 113           HA3      GLY 113  -3.136  -4.446  -8.316
  Start of MODEL    7
 5241    H    ALA 114           H        ALA 114  -5.585  -6.486  -7.169
  Start of MODEL    7
 5242    HA   ALA 114           HA       ALA 114  -3.632  -8.218  -5.930
  Start of MODEL    7
 5243    HB1  ALA 114           HB1      ALA 114  -6.649  -8.196  -5.789
  Start of MODEL    7
 5244    HB3  ALA 114           HB2      ALA 114  -5.531  -7.494  -4.617
  Start of MODEL    7
 5245    HB2  ALA 114           HB3      ALA 114  -5.597  -9.244  -4.837
  Start of MODEL    7
 5246    H    LYS 115           H        LYS 115  -3.197 -10.304  -6.480
  Start of MODEL    7
 5247    HA   LYS 115           HA       LYS 115  -3.983 -11.090  -9.138
  Start of MODEL    7
 5248    HB2  LYS 115           HB2      LYS 115  -2.149 -12.463  -7.161
  Start of MODEL    7
 5249    HB3  LYS 115           HB3      LYS 115  -2.339 -12.901  -8.856
  Start of MODEL    7
 5250    HG2  LYS 115           HG2      LYS 115  -1.551 -10.612  -9.453
  Start of MODEL    7
 5251    HG3  LYS 115           HG3      LYS 115  -1.200 -10.349  -7.745
  Start of MODEL    7
 5252    HD2  LYS 115           HD2      LYS 115   0.351 -12.244  -7.770
  Start of MODEL    7
 5253    HD3  LYS 115           HD3      LYS 115  -0.002 -12.514  -9.479
  Start of MODEL    7
 5254    HE2  LYS 115           HE2      LYS 115   0.780 -10.157  -9.898
  Start of MODEL    7
 5255    HE3  LYS 115           HE3      LYS 115   1.340 -10.124  -8.228
  Start of MODEL    7
 5256    HZ3  LYS 115           HZ1      LYS 115   2.787 -12.004  -8.720
  Start of MODEL    7
 5257    HZ2  LYS 115           HZ2      LYS 115   3.123 -10.697  -9.741
  Start of MODEL    7
 5258    HZ1  LYS 115           HZ3      LYS 115   2.247 -12.018 -10.325
  Start of MODEL    7
 5259    HA   PRO 116           HA       PRO 116  -7.132 -13.876  -7.650
  Start of MODEL    7
 5260    HB2  PRO 116           HB2      PRO 116  -8.023 -14.710 -10.026
  Start of MODEL    7
 5261    HB3  PRO 116           HB3      PRO 116  -8.308 -13.057  -9.471
  Start of MODEL    7
 5262    HG2  PRO 116           HG2      PRO 116  -6.290 -14.085 -11.416
  Start of MODEL    7
 5263    HG3  PRO 116           HG3      PRO 116  -7.254 -12.599 -11.482
  Start of MODEL    7
 5264    HD2  PRO 116           HD2      PRO 116  -4.615 -12.744 -10.640
  Start of MODEL    7
 5265    HD3  PRO 116           HD3      PRO 116  -5.742 -11.437 -10.229
  Start of MODEL    7
 5266    H    ARG 117           H        ARG 117  -7.841 -16.215  -8.490
  Start of MODEL    7
 5267    HA   ARG 117           HA       ARG 117  -7.394 -18.400  -8.211
  Start of MODEL    7
 5268    HB2  ARG 117           HB2      ARG 117  -5.078 -17.699  -9.996
  Start of MODEL    7
 5269    HB3  ARG 117           HB3      ARG 117  -5.588 -19.340  -9.618
  Start of MODEL    7
 5270    HG2  ARG 117           HG2      ARG 117  -7.895 -18.597 -10.496
  Start of MODEL    7
 5271    HG3  ARG 117           HG3      ARG 117  -7.007 -17.247 -11.212
  Start of MODEL    7
 5272    HD2  ARG 117           HD2      ARG 117  -5.549 -18.806 -12.372
  Start of MODEL    7
 5273    HD3  ARG 117           HD3      ARG 117  -6.411 -20.157 -11.636
  Start of MODEL    7
 5274    HE   ARG 117           HE       ARG 117  -8.173 -18.427 -13.052
  Start of MODEL    7
 5275   HH11  ARG 117          HH11      ARG 117  -5.856 -21.021 -13.459
  Start of MODEL    7
 5276   HH12  ARG 117          HH12      ARG 117  -6.579 -21.607 -14.924
  Start of MODEL    7
 5277   HH21  ARG 117          HH21      ARG 117  -9.103 -19.160 -14.982
  Start of MODEL    7
 5278   HH22  ARG 117          HH22      ARG 117  -8.410 -20.510 -15.824
  Start of MODEL    7
 5279    H    THR 118           H        THR 118  -4.039 -17.226  -8.282
  Start of MODEL    7
 5280    HA   THR 118           HA       THR 118  -3.450 -18.893  -5.984
  Start of MODEL    7
 5281    HB   THR 118           HB       THR 118  -1.860 -18.820  -7.861
  Start of MODEL    7
 5282    HG1  THR 118           HG1      THR 118  -1.199 -19.014  -5.511
  Start of MODEL    7
 5283   HG22  THR 118          HG21      THR 118  -1.354 -15.952  -7.064
  Start of MODEL    7
 5284   HG21  THR 118          HG22      THR 118  -2.240 -16.459  -8.502
  Start of MODEL    7
 5285   HG23  THR 118          HG23      THR 118  -0.528 -16.857  -8.334
  Start of MODEL    7
 5286    H    ASN 119           H        ASN 119  -2.525 -18.107  -4.049
  Start of MODEL    7
 5287    HA   ASN 119           HA       ASN 119  -2.891 -15.243  -3.525
  Start of MODEL    7
 5288    HB2  ASN 119           HB2      ASN 119  -4.882 -16.558  -2.689
  Start of MODEL    7
 5289    HB3  ASN 119           HB3      ASN 119  -3.786 -17.430  -1.626
  Start of MODEL    7
 5290   HD21  ASN 119          HD21      ASN 119  -5.362 -14.396  -2.258
  Start of MODEL    7
 5291   HD22  ASN 119          HD22      ASN 119  -5.039 -13.684  -0.717
  Start of MODEL    7
 5292    H    VAL 120           H        VAL 120  -1.626 -14.531  -1.606
  Start of MODEL    7
 5293    HA   VAL 120           HA       VAL 120   0.960 -15.746  -1.659
  Start of MODEL    7
 5294    HB   VAL 120           HB       VAL 120  -0.042 -13.546   0.161
  Start of MODEL    7
 5295    H    GLN 121           H        GLN 121   0.645 -17.809  -0.894
  Start of MODEL    7
 5296    HA   GLN 121           HA       GLN 121   0.266 -18.030   2.009
  Start of MODEL    7
 5297    HB2  GLN 121           HB2      GLN 121  -0.769 -19.961  -0.078
  Start of MODEL    7
 5298    HB3  GLN 121           HB3      GLN 121  -0.895 -20.168   1.663
  Start of MODEL    7
 5299    HG2  GLN 121           HG2      GLN 121  -2.340 -18.236   1.819
  Start of MODEL    7
 5300    HG3  GLN 121           HG3      GLN 121  -2.168 -17.938   0.090
  Start of MODEL    7
 5301   HE21  GLN 121          HE21      GLN 121  -4.571 -18.461   1.663
  Start of MODEL    7
 5302   HE22  GLN 121          HE22      GLN 121  -5.307 -19.859   0.960
  Start of MODEL    7
 5303    H5'   DG   1           H5'       DG   1  12.157  -7.679  -4.518
  Start of MODEL    7
 5304    H4'   DG   1           H4'       DG   1  12.012  -5.054  -4.989
  Start of MODEL    7
 5305    H3'   DG   1           H3'       DG   1  13.898  -6.800  -5.659
  Start of MODEL    7
 5306    H2'   DG   1           H2'       DG   1  14.797  -7.098  -3.416
  Start of MODEL    7
 5307    H1'   DG   1           H1'       DG   1  14.862  -4.057  -3.179
  Start of MODEL    7
 5308    H8    DG   1           H8        DG   1  13.439  -7.018  -1.130
  Start of MODEL    7
 5309    H1    DG   1           H1        DG   1  17.345  -2.995   1.997
  Start of MODEL    7
 5310    H22   DG   1           H21       DG   1  17.687  -1.425  -1.076
  Start of MODEL    7
 5311    H21   DG   1           H22       DG   1  18.135  -1.468   0.613
  Start of MODEL    7
 5312   HO5'   DG   1           H5T       DG   1  10.304  -5.738  -4.264
  Start of MODEL    7
 5313   H5''   DG   1          5H''       DG   1  12.140  -7.054  -2.870
  Start of MODEL    7
 5314   H2''   DG   1          2H''       DG   1  15.945  -5.992  -4.156
  Start of MODEL    7
 5315    H5'   DG   2           H5'       DG   2  14.499  -3.586  -9.795
  Start of MODEL    7
 5316    H4'   DG   2           H4'       DG   2  12.517  -2.528  -9.715
  Start of MODEL    7
 5317    H3'   DG   2           H3'       DG   2  14.279  -0.997 -11.071
  Start of MODEL    7
 5318    H2'   DG   2           H2'       DG   2  14.887   0.425  -9.213
  Start of MODEL    7
 5319    H1'   DG   2           H1'       DG   2  11.897   0.479  -8.536
  Start of MODEL    7
 5320    H8    DG   2           H8        DG   2  15.051   2.003  -7.651
  Start of MODEL    7
 5321    H1    DG   2           H1        DG   2  11.466   0.844  -2.450
  Start of MODEL    7
 5322    H22   DG   2           H21       DG   2   9.668  -1.236  -4.573
  Start of MODEL    7
 5323    H21   DG   2           H22       DG   2   9.846  -0.577  -2.964
  Start of MODEL    7
 5324   H5''   DG   2          5H''       DG   2  15.420  -2.153  -9.302
  Start of MODEL    7
 5325   H2''   DG   2          2H''       DG   2  13.642   1.373 -10.012
  Start of MODEL    7
 5326    H5'   DT   3           H5'       DT   3  10.563  -2.763 -10.028
  Start of MODEL    7
 5327    H4'   DT   3           H4'       DT   3   8.321  -3.893 -10.122
  Start of MODEL    7
 5328    H3'   DT   3           H3'       DT   3   8.091  -3.328 -12.741
  Start of MODEL    7
 5329    H2'   DT   3           H2'       DT   3   8.157  -0.911 -12.483
  Start of MODEL    7
 5330    H1'   DT   3           H1'       DT   3   6.217  -1.354 -10.141
  Start of MODEL    7
 5331    H3    DT   3           H3        DT   3   6.144   3.289 -10.946
  Start of MODEL    7
 5332    H73   DT   3           H71       DT   3  10.602   2.641  -8.707
  Start of MODEL    7
 5333    H72   DT   3           H72       DT   3   9.777   1.826  -7.356
  Start of MODEL    7
 5334    H71   DT   3           H73       DT   3   9.388   3.519  -7.744
  Start of MODEL    7
 5335    H6    DT   3           H6        DT   3   9.036   0.053  -8.970
  Start of MODEL    7
 5336   H5''   DT   3          5H''       DT   3  10.294  -3.896 -11.370
  Start of MODEL    7
 5337   H2''   DT   3          2H''       DT   3   6.431  -1.251 -12.595
  Start of MODEL    7
 5338    H5'   DG   4           H5'       DG   4   7.362  -5.568  -9.311
  Start of MODEL    7
 5339    H4'   DG   4           H4'       DG   4   6.429  -4.911  -7.227
  Start of MODEL    7
 5340    H3'   DG   4           H3'       DG   4   3.869  -5.883  -8.240
  Start of MODEL    7
 5341    H2'   DG   4           H2'       DG   4   2.880  -3.784  -8.378
  Start of MODEL    7
 5342    H1'   DG   4           H1'       DG   4   5.233  -2.563  -6.862
  Start of MODEL    7
 5343    H8    DG   4           H8        DG   4   5.513  -0.100  -7.411
  Start of MODEL    7
 5344    H1    DG   4           H1        DG   4   1.180  -0.427 -12.141
  Start of MODEL    7
 5345    H22   DG   4           H21       DG   4   1.267  -3.840 -11.565
  Start of MODEL    7
 5346    H21   DG   4           H22       DG   4   0.588  -2.514 -12.482
  Start of MODEL    7
 5347   H5''   DG   4          5H''       DG   4   6.210  -6.809  -8.780
  Start of MODEL    7
 5348   H2''   DG   4          2H''       DG   4   3.125  -3.642  -6.639
  Start of MODEL    7
 5349    H5'   DT   5           H5'       DT   5   3.588  -8.983  -3.392
  Start of MODEL    7
 5350    H4'   DT   5           H4'       DT   5   2.560  -7.695  -1.799
  Start of MODEL    7
 5351    H3'   DT   5           H3'       DT   5   1.020  -9.741  -2.616
  Start of MODEL    7
 5352    H2'   DT   5           H2'       DT   5  -0.204  -8.492  -4.300
  Start of MODEL    7
 5353    H1'   DT   5           H1'       DT   5  -0.434  -6.292  -2.180
  Start of MODEL    7
 5354    H3    DT   5           H3        DT   5  -3.046  -3.834  -4.844
  Start of MODEL    7
 5355    H72   DT   5           H71       DT   5   0.802  -3.621  -7.726
  Start of MODEL    7
 5356    H73   DT   5           H72       DT   5   1.298  -5.331  -7.677
  Start of MODEL    7
 5357    H71   DT   5           H73       DT   5  -0.213  -4.865  -8.494
  Start of MODEL    7
 5358    H6    DT   5           H6        DT   5   1.045  -6.179  -5.520
  Start of MODEL    7
 5359   H5''   DT   5          5H''       DT   5   2.275  -8.780  -4.566
  Start of MODEL    7
 5360   H2''   DT   5          2H''       DT   5  -1.296  -8.462  -2.923
  Start of MODEL    7
 5361    H5'   DG   6           H5'       DG   6   2.612  -7.699   1.408
  Start of MODEL    7
 5362    H4'   DG   6           H4'       DG   6   3.192  -8.080   3.769
  Start of MODEL    7
 5363    H3'   DG   6           H3'       DG   6   1.671 -10.342   3.824
  Start of MODEL    7
 5364    H2'   DG   6           H2'       DG   6  -0.491  -9.304   3.743
  Start of MODEL    7
 5365    H1'   DG   6           H1'       DG   6   0.577  -7.040   5.495
  Start of MODEL    7
 5366    H8    DG   6           H8        DG   6  -1.426  -7.756   2.254
  Start of MODEL    7
 5367    H1    DG   6           H1        DG   6  -3.630  -2.990   5.957
  Start of MODEL    7
 5368    H22   DG   6           H21       DG   6  -0.940  -3.777   8.008
  Start of MODEL    7
 5369    H21   DG   6           H22       DG   6  -2.336  -2.758   7.738
  Start of MODEL    7
 5370   H5''   DG   6          5H''       DG   6   2.973  -9.391   1.795
  Start of MODEL    7
 5371   H2''   DG   6          2H''       DG   6  -0.219  -9.292   5.482
  Start of MODEL    7
 5372    H5'   DC   7           H5'       DC   7   3.971 -12.640   4.490
  Start of MODEL    7
 5373    H4'   DC   7           H4'       DC   7   3.819 -14.207   6.350
  Start of MODEL    7
 5374    H3'   DC   7           H3'       DC   7   2.296 -14.810   3.852
  Start of MODEL    7
 5375   HO3'   DC   7           H3T       DC   7   3.883 -16.387   3.772
  Start of MODEL    7
 5376    H2'   DC   7           H2'       DC   7   1.279 -16.722   4.844
  Start of MODEL    7
 5377    H1'   DC   7           H1'       DC   7   0.941 -15.667   7.422
  Start of MODEL    7
 5378    H42   DC   7           H41       DC   7  -4.241 -13.962   3.646
  Start of MODEL    7
 5379    H41   DC   7           H42       DC   7  -4.866 -14.497   5.190
  Start of MODEL    7
 5380    H5    DC   7           H5        DC   7  -1.876 -13.846   3.155
  Start of MODEL    7
 5381    H6    DC   7           H6        DC   7   0.367 -14.261   4.019
  Start of MODEL    7
 5382   H5''   DC   7          5H''       DC   7   2.215 -12.381   4.557
  Start of MODEL    7
 5383   H2''   DC   7          2H''       DC   7   2.481 -16.817   6.125
  Start of MODEL    8
 5384    H1   GLY  25           HT1      GLY  25  -3.225 -12.777   0.151
  Start of MODEL    8
 5385    H2   GLY  25           HT2      GLY  25  -3.435 -11.128   0.462
  Start of MODEL    8
 5386    H3   GLY  25           HT3      GLY  25  -2.373 -11.632  -0.757
  Start of MODEL    8
 5387    HA3  GLY  25           HA2      GLY  25  -4.221 -12.551  -2.024
  Start of MODEL    8
 5388    HA2  GLY  25           HA3      GLY  25  -4.406 -10.826  -1.743
  Start of MODEL    8
 5389    H    ALA  26           H        ALA  26  -6.462 -12.833  -2.294
  Start of MODEL    8
 5390    HA   ALA  26           HA       ALA  26  -8.462 -12.004  -0.549
  Start of MODEL    8
 5391    HB2  ALA  26           HB1      ALA  26  -8.423 -14.522  -2.205
  Start of MODEL    8
 5392    HB1  ALA  26           HB2      ALA  26  -8.859 -12.923  -2.798
  Start of MODEL    8
 5393    HB3  ALA  26           HB3      ALA  26  -9.852 -13.709  -1.571
  Start of MODEL    8
 5394    H    MET  27           H        MET  27  -9.037 -12.581   1.429
  Start of MODEL    8
 5395    HA   MET  27           HA       MET  27  -8.172 -15.197   2.470
  Start of MODEL    8
 5396    HB2  MET  27           HB2      MET  27  -8.236 -12.574   3.976
  Start of MODEL    8
 5397    HB3  MET  27           HB3      MET  27  -7.877 -14.138   4.690
  Start of MODEL    8
 5398    HG2  MET  27           HG2      MET  27  -5.893 -14.318   3.252
  Start of MODEL    8
 5399    HG3  MET  27           HG3      MET  27  -6.251 -12.729   2.583
  Start of MODEL    8
 5400    HE3  MET  27           HE1      MET  27  -6.309 -10.505   4.084
  Start of MODEL    8
 5401    HE2  MET  27           HE2      MET  27  -5.815 -10.451   5.774
  Start of MODEL    8
 5402    HE1  MET  27           HE3      MET  27  -7.313 -11.263   5.317
  Start of MODEL    8
 5403    H    GLY  28           H        GLY  28 -10.705 -14.062   1.273
  Start of MODEL    8
 5404    HA2  GLY  28           HA2      GLY  28 -12.936 -14.581   1.605
  Start of MODEL    8
 5405    HA3  GLY  28           HA3      GLY  28 -12.522 -15.202   3.195
  Start of MODEL    8
 5406    H    SER  29           H        SER  29 -11.712 -11.992   2.053
  Start of MODEL    8
 5407    HA   SER  29           HA       SER  29 -13.829 -10.814   3.695
  Start of MODEL    8
 5408    HB2  SER  29           HB2      SER  29 -10.921  -9.976   3.878
  Start of MODEL    8
 5409    HB3  SER  29           HB3      SER  29 -12.271  -9.317   4.805
  Start of MODEL    8
 5410    HG   SER  29           HG       SER  29 -12.326 -11.906   5.192
  Start of MODEL    8
 5411    H    ARG  30           H        ARG  30 -14.486  -8.757   2.998
  Start of MODEL    8
 5412    HA   ARG  30           HA       ARG  30 -13.235  -7.792   0.538
  Start of MODEL    8
 5413    HB2  ARG  30           HB2      ARG  30 -15.673  -7.361  -0.276
  Start of MODEL    8
 5414    HB3  ARG  30           HB3      ARG  30 -14.935  -8.938  -0.496
  Start of MODEL    8
 5415    HG2  ARG  30           HG2      ARG  30 -17.223  -9.162   0.254
  Start of MODEL    8
 5416    HG3  ARG  30           HG3      ARG  30 -16.111  -9.761   1.483
  Start of MODEL    8
 5417    HD2  ARG  30           HD2      ARG  30 -16.390  -7.792   2.797
  Start of MODEL    8
 5418    HD3  ARG  30           HD3      ARG  30 -17.307  -7.000   1.516
  Start of MODEL    8
 5419    HE   ARG  30           HE       ARG  30 -18.915  -9.015   1.932
  Start of MODEL    8
 5420   HH11  ARG  30          HH11      ARG  30 -17.113  -7.283   4.409
  Start of MODEL    8
 5421   HH12  ARG  30          HH12      ARG  30 -18.330  -7.510   5.616
  Start of MODEL    8
 5422   HH21  ARG  30          HH21      ARG  30 -20.501  -9.312   3.538
  Start of MODEL    8
 5423   HH22  ARG  30          HH22      ARG  30 -20.254  -8.651   5.128
  Start of MODEL    8
 5424    H    ASP  31           H        ASP  31 -13.900  -7.011   3.527
  Start of MODEL    8
 5425    HA   ASP  31           HA       ASP  31 -15.328  -4.563   3.354
  Start of MODEL    8
 5426    HB2  ASP  31           HB2      ASP  31 -13.320  -5.418   5.447
  Start of MODEL    8
 5427    HB3  ASP  31           HB3      ASP  31 -14.564  -4.186   5.633
  Start of MODEL    8
 5428    H    THR  32           H        THR  32 -12.127  -5.492   2.688
  Start of MODEL    8
 5429    HA   THR  32           HA       THR  32 -11.071  -2.782   2.805
  Start of MODEL    8
 5430    HB   THR  32           HB       THR  32  -8.969  -4.120   1.940
  Start of MODEL    8
 5431    HG1  THR  32           HG1      THR  32  -9.672  -6.305   3.314
  Start of MODEL    8
 5432   HG22  THR  32          HG21      THR  32  -8.338  -4.597   4.240
  Start of MODEL    8
 5433   HG21  THR  32          HG22      THR  32 -10.024  -4.478   4.749
  Start of MODEL    8
 5434   HG23  THR  32          HG23      THR  32  -9.179  -3.048   4.152
  Start of MODEL    8
 5435    H    MET  33           H        MET  33 -12.910  -4.268   0.611
  Start of MODEL    8
 5436    HA   MET  33           HA       MET  33 -11.671  -4.299  -1.810
  Start of MODEL    8
 5437    HB2  MET  33           HB2      MET  33 -14.046  -4.876  -1.361
  Start of MODEL    8
 5438    HB3  MET  33           HB3      MET  33 -14.425  -3.170  -1.315
  Start of MODEL    8
 5439    HG2  MET  33           HG2      MET  33 -13.675  -2.957  -3.642
  Start of MODEL    8
 5440    HG3  MET  33           HG3      MET  33 -13.371  -4.692  -3.687
  Start of MODEL    8
 5441    HE3  MET  33           HE1      MET  33 -15.187  -3.150  -5.791
  Start of MODEL    8
 5442    HE2  MET  33           HE2      MET  33 -16.566  -4.238  -5.934
  Start of MODEL    8
 5443    HE1  MET  33           HE3      MET  33 -14.932  -4.896  -5.859
  Start of MODEL    8
 5444    H    PHE  34           H        PHE  34 -13.301  -1.384  -0.458
  Start of MODEL    8
 5445    HA   PHE  34           HA       PHE  34 -11.839   0.181  -2.465
  Start of MODEL    8
 5446    HB2  PHE  34           HB2      PHE  34 -14.391   0.702  -0.965
  Start of MODEL    8
 5447    HB3  PHE  34           HB3      PHE  34 -13.509   1.997  -1.758
  Start of MODEL    8
 5448    HD1  PHE  34           HD1      PHE  34 -15.507  -1.019  -2.240
  Start of MODEL    8
 5449    HD2  PHE  34           HD2      PHE  34 -13.449   2.171  -4.162
  Start of MODEL    8
 5450    HE1  PHE  34           HE1      PHE  34 -16.634  -1.567  -4.352
  Start of MODEL    8
 5451    HE2  PHE  34           HE2      PHE  34 -14.582   1.629  -6.274
  Start of MODEL    8
 5452    HZ   PHE  34           HZ       PHE  34 -16.191  -0.186  -6.377
  Start of MODEL    8
 5453    H    THR  35           H        THR  35 -11.526  -0.701   0.671
  Start of MODEL    8
 5454    HA   THR  35           HA       THR  35 -10.788   1.973   1.611
  Start of MODEL    8
 5455    HB   THR  35           HB       THR  35 -10.716   0.855   3.881
  Start of MODEL    8
 5456    HG1  THR  35           HG1      THR  35 -12.349  -1.161   3.376
  Start of MODEL    8
 5457   HG22  THR  35          HG21      THR  35 -13.142   0.879   4.149
  Start of MODEL    8
 5458   HG21  THR  35          HG22      THR  35 -13.351   0.761   2.402
  Start of MODEL    8
 5459   HG23  THR  35          HG23      THR  35 -12.632   2.208   3.108
  Start of MODEL    8
 5460    H    LYS  36           H        LYS  36  -9.402  -1.085   0.711
  Start of MODEL    8
 5461    HA   LYS  36           HA       LYS  36  -6.936  -0.593   2.140
  Start of MODEL    8
 5462    HB2  LYS  36           HB2      LYS  36  -7.866  -2.829   2.120
  Start of MODEL    8
 5463    HB3  LYS  36           HB3      LYS  36  -7.952  -2.817   0.371
  Start of MODEL    8
 5464    HG2  LYS  36           HG2      LYS  36  -5.560  -2.935   0.204
  Start of MODEL    8
 5465    HG3  LYS  36           HG3      LYS  36  -5.398  -2.777   1.959
  Start of MODEL    8
 5466    HD2  LYS  36           HD2      LYS  36  -6.559  -4.871   2.297
  Start of MODEL    8
 5467    HD3  LYS  36           HD3      LYS  36  -6.891  -5.002   0.571
  Start of MODEL    8
 5468    HE2  LYS  36           HE2      LYS  36  -4.113  -4.929   1.712
  Start of MODEL    8
 5469    HE3  LYS  36           HE3      LYS  36  -5.013  -6.424   1.465
  Start of MODEL    8
 5470    HZ2  LYS  36           HZ1      LYS  36  -3.547  -5.962  -0.388
  Start of MODEL    8
 5471    HZ1  LYS  36           HZ2      LYS  36  -4.282  -4.465  -0.646
  Start of MODEL    8
 5472    HZ3  LYS  36           HZ3      LYS  36  -5.163  -5.894  -0.891
  Start of MODEL    8
 5473    H    ILE  37           H        ILE  37  -5.539   0.726   1.260
  Start of MODEL    8
 5474    HA   ILE  37           HA       ILE  37  -5.367   1.000  -1.649
  Start of MODEL    8
 5475    HB   ILE  37           HB       ILE  37  -4.212   2.730   0.553
  Start of MODEL    8
 5476   HD12  ILE  37          HD11      ILE  37  -6.932   5.240  -0.031
  Start of MODEL    8
 5477   HD11  ILE  37          HD12      ILE  37  -5.353   5.311  -0.812
  Start of MODEL    8
 5478   HD13  ILE  37          HD13      ILE  37  -5.471   4.938   0.910
  Start of MODEL    8
 5479    H    PHE  38           H        PHE  38  -3.589   0.342  -2.739
  Start of MODEL    8
 5480    HA   PHE  38           HA       PHE  38  -1.380  -0.792  -1.187
  Start of MODEL    8
 5481    HB2  PHE  38           HB2      PHE  38  -2.287  -2.282  -2.894
  Start of MODEL    8
 5482    HB3  PHE  38           HB3      PHE  38  -2.070  -1.044  -4.127
  Start of MODEL    8
 5483    HD1  PHE  38           HD1      PHE  38  -0.182  -1.120  -5.439
  Start of MODEL    8
 5484    HD2  PHE  38           HD2      PHE  38  -0.100  -2.923  -1.587
  Start of MODEL    8
 5485    HE1  PHE  38           HE1      PHE  38   2.091  -1.942  -5.880
  Start of MODEL    8
 5486    HE2  PHE  38           HE2      PHE  38   2.177  -3.749  -2.021
  Start of MODEL    8
 5487    HZ   PHE  38           HZ       PHE  38   3.275  -3.261  -4.169
  Start of MODEL    8
 5488    H    VAL  39           H        VAL  39   0.506   0.288  -1.024
  Start of MODEL    8
 5489    HA   VAL  39           HA       VAL  39   0.913   2.556  -2.850
  Start of MODEL    8
 5490    HB   VAL  39           HB       VAL  39   2.341   2.184  -0.228
  Start of MODEL    8
 5491    H    GLY  40           H        GLY  40   2.619   2.529  -4.136
  Start of MODEL    8
 5492    HA2  GLY  40           HA2      GLY  40   4.581   0.339  -3.810
  Start of MODEL    8
 5493    HA3  GLY  40           HA3      GLY  40   3.814   0.643  -5.363
  Start of MODEL    8
 5494    H    GLY  41           H        GLY  41   6.599   0.664  -4.977
  Start of MODEL    8
 5495    HA2  GLY  41           HA2      GLY  41   8.344   1.907  -5.813
  Start of MODEL    8
 5496    HA3  GLY  41           HA3      GLY  41   7.176   3.139  -6.260
  Start of MODEL    8
 5497    H    LEU  42           H        LEU  42   7.405   2.026  -2.988
  Start of MODEL    8
 5498    HA   LEU  42           HA       LEU  42   7.988   4.694  -2.083
  Start of MODEL    8
 5499    HB2  LEU  42           HB2      LEU  42   7.531   2.085  -0.638
  Start of MODEL    8
 5500    HB3  LEU  42           HB3      LEU  42   7.898   3.583   0.192
  Start of MODEL    8
 5501    HG   LEU  42           HG       LEU  42   5.498   3.166  -1.584
  Start of MODEL    8
 5502   HD13  LEU  42          HD11      LEU  42   5.349   1.770   0.398
  Start of MODEL    8
 5503   HD12  LEU  42          HD12      LEU  42   4.228   3.127   0.520
  Start of MODEL    8
 5504   HD11  LEU  42          HD13      LEU  42   5.743   3.150   1.423
  Start of MODEL    8
 5505   HD23  LEU  42          HD21      LEU  42   6.263   5.403   0.291
  Start of MODEL    8
 5506   HD22  LEU  42          HD22      LEU  42   4.731   5.262  -0.571
  Start of MODEL    8
 5507   HD21  LEU  42          HD23      LEU  42   6.232   5.483  -1.472
  Start of MODEL    8
 5508    HA   PRO  43           HA       PRO  43  12.377   4.128  -1.645
  Start of MODEL    8
 5509    HB2  PRO  43           HB2      PRO  43  12.764   6.084   0.240
  Start of MODEL    8
 5510    HB3  PRO  43           HB3      PRO  43  12.671   6.388  -1.497
  Start of MODEL    8
 5511    HG2  PRO  43           HG2      PRO  43  10.599   6.771   0.607
  Start of MODEL    8
 5512    HG3  PRO  43           HG3      PRO  43  10.921   7.734  -0.846
  Start of MODEL    8
 5513    HD2  PRO  43           HD2      PRO  43   8.867   5.946  -0.647
  Start of MODEL    8
 5514    HD3  PRO  43           HD3      PRO  43   9.652   6.373  -2.178
  Start of MODEL    8
 5515    H    TYR  44           H        TYR  44  13.620   2.959  -0.254
  Start of MODEL    8
 5516    HA   TYR  44           HA       TYR  44  12.217   1.345   1.560
  Start of MODEL    8
 5517    HB2  TYR  44           HB2      TYR  44  15.197   1.649   1.183
  Start of MODEL    8
 5518    HB3  TYR  44           HB3      TYR  44  14.421   0.348   2.077
  Start of MODEL    8
 5519    HD1  TYR  44           HD1      TYR  44  12.340  -0.700   0.539
  Start of MODEL    8
 5520    HD2  TYR  44           HD2      TYR  44  15.974   0.994  -0.882
  Start of MODEL    8
 5521    HE1  TYR  44           HE1      TYR  44  12.131  -2.008  -1.539
  Start of MODEL    8
 5522    HE2  TYR  44           HE2      TYR  44  15.773  -0.304  -2.959
  Start of MODEL    8
 5523    HH   TYR  44           HH       TYR  44  12.919  -1.928  -3.856
  Start of MODEL    8
 5524    H    HIS  45           H        HIS  45  13.761   4.360   2.040
  Start of MODEL    8
 5525    HA   HIS  45           HA       HIS  45  14.230   4.112   4.849
  Start of MODEL    8
 5526    HB2  HIS  45           HB2      HIS  45  13.721   6.748   3.493
  Start of MODEL    8
 5527    HB3  HIS  45           HB3      HIS  45  14.742   6.412   4.883
  Start of MODEL    8
 5528    HD1  HIS  45           HD1      HIS  45  17.141   5.573   4.418
  Start of MODEL    8
 5529    HD2  HIS  45           HD2      HIS  45  14.863   6.299   1.015
  Start of MODEL    8
 5530    HE1  HIS  45           HE1      HIS  45  18.768   5.575   2.499
  Start of MODEL    8
 5531    HE2  HIS  45           HE2      HIS  45  17.402   6.256   0.487
  Start of MODEL    8
 5532    H    THR  46           H        THR  46  11.376   4.796   2.988
  Start of MODEL    8
 5533    HA   THR  46           HA       THR  46   9.977   6.455   4.692
  Start of MODEL    8
 5534    HB   THR  46           HB       THR  46   8.830   4.280   2.921
  Start of MODEL    8
 5535    HG1  THR  46           HG1      THR  46  10.097   6.667   2.403
  Start of MODEL    8
 5536   HG21  THR  46          HG21      THR  46   7.590   6.850   3.928
  Start of MODEL    8
 5537   HG23  THR  46          HG22      THR  46   7.174   5.226   4.479
  Start of MODEL    8
 5538   HG22  THR  46          HG23      THR  46   6.845   5.706   2.812
  Start of MODEL    8
 5539    H    SER  47           H        SER  47   8.574   6.171   6.417
  Start of MODEL    8
 5540    HA   SER  47           HA       SER  47   8.637   3.511   7.661
  Start of MODEL    8
 5541    HB2  SER  47           HB2      SER  47   8.396   4.668   9.818
  Start of MODEL    8
 5542    HB3  SER  47           HB3      SER  47   9.826   5.233   8.953
  Start of MODEL    8
 5543    HG   SER  47           HG       SER  47   8.574   7.053   8.271
  Start of MODEL    8
 5544    H    ASP  48           H        ASP  48   6.768   2.914   8.945
  Start of MODEL    8
 5545    HA   ASP  48           HA       ASP  48   4.319   3.065   7.697
  Start of MODEL    8
 5546    HB2  ASP  48           HB2      ASP  48   4.581   2.829  10.695
  Start of MODEL    8
 5547    HB3  ASP  48           HB3      ASP  48   3.373   2.088   9.653
  Start of MODEL    8
 5548    H    LYS  49           H        LYS  49   5.709   5.184  10.113
  Start of MODEL    8
 5549    HA   LYS  49           HA       LYS  49   3.419   6.673  10.764
  Start of MODEL    8
 5550    HB2  LYS  49           HB2      LYS  49   5.561   6.720  12.033
  Start of MODEL    8
 5551    HB3  LYS  49           HB3      LYS  49   6.287   7.633  10.717
  Start of MODEL    8
 5552    HG2  LYS  49           HG2      LYS  49   4.535   9.388  11.088
  Start of MODEL    8
 5553    HG3  LYS  49           HG3      LYS  49   4.057   8.505  12.540
  Start of MODEL    8
 5554    HD2  LYS  49           HD2      LYS  49   5.561  10.201  13.242
  Start of MODEL    8
 5555    HD3  LYS  49           HD3      LYS  49   6.449   8.679  13.302
  Start of MODEL    8
 5556    HE2  LYS  49           HE2      LYS  49   7.896  10.286  12.322
  Start of MODEL    8
 5557    HE3  LYS  49           HE3      LYS  49   7.350   9.223  11.025
  Start of MODEL    8
 5558    HZ2  LYS  49           HZ1      LYS  49   7.301  11.573  10.399
  Start of MODEL    8
 5559    HZ1  LYS  49           HZ2      LYS  49   6.200  11.888  11.643
  Start of MODEL    8
 5560    HZ3  LYS  49           HZ3      LYS  49   5.753  10.885  10.348
  Start of MODEL    8
 5561    H    THR  50           H        THR  50   5.870   7.083   8.257
  Start of MODEL    8
 5562    HA   THR  50           HA       THR  50   5.001   9.599   7.324
  Start of MODEL    8
 5563    HB   THR  50           HB       THR  50   6.357   7.468   5.646
  Start of MODEL    8
 5564    HG1  THR  50           HG1      THR  50   7.620   9.368   7.373
  Start of MODEL    8
 5565   HG21  THR  50          HG21      THR  50   6.577  10.483   5.571
  Start of MODEL    8
 5566   HG23  THR  50          HG22      THR  50   5.613   9.508   4.462
  Start of MODEL    8
 5567   HG22  THR  50          HG23      THR  50   7.369   9.344   4.480
  Start of MODEL    8
 5568    H    LEU  51           H        LEU  51   4.070   6.295   6.447
  Start of MODEL    8
 5569    HA   LEU  51           HA       LEU  51   2.448   7.123   4.218
  Start of MODEL    8
 5570    HB2  LEU  51           HB2      LEU  51   2.486   4.569   5.817
  Start of MODEL    8
 5571    HB3  LEU  51           HB3      LEU  51   1.380   4.842   4.485
  Start of MODEL    8
 5572    HG   LEU  51           HG       LEU  51   4.385   4.669   4.346
  Start of MODEL    8
 5573   HD13  LEU  51          HD11      LEU  51   3.253   2.532   4.496
  Start of MODEL    8
 5574   HD12  LEU  51          HD12      LEU  51   3.898   2.771   2.873
  Start of MODEL    8
 5575   HD11  LEU  51          HD13      LEU  51   2.175   2.988   3.176
  Start of MODEL    8
 5576   HD22  LEU  51          HD21      LEU  51   4.142   5.026   1.941
  Start of MODEL    8
 5577   HD21  LEU  51          HD22      LEU  51   3.591   6.432   2.852
  Start of MODEL    8
 5578   HD23  LEU  51          HD23      LEU  51   2.415   5.317   2.156
  Start of MODEL    8
 5579    H    HIS  52           H        HIS  52   1.868   6.250   7.559
  Start of MODEL    8
 5580    HA   HIS  52           HA       HIS  52  -0.873   6.600   7.718
  Start of MODEL    8
 5581    HB2  HIS  52           HB2      HIS  52   0.750   5.786   9.517
  Start of MODEL    8
 5582    HB3  HIS  52           HB3      HIS  52   1.052   7.480   9.872
  Start of MODEL    8
 5583    HD1  HIS  52           HD1      HIS  52  -1.275   8.859  10.565
  Start of MODEL    8
 5584    HD2  HIS  52           HD2      HIS  52  -1.237   4.713  10.940
  Start of MODEL    8
 5585    HE1  HIS  52           HE1      HIS  52  -3.112   8.296  12.185
  Start of MODEL    8
 5586    HE2  HIS  52           HE2      HIS  52  -2.884   5.821  12.583
  Start of MODEL    8
 5587    H    GLU  53           H        GLU  53   1.613   9.052   8.469
  Start of MODEL    8
 5588    HA   GLU  53           HA       GLU  53  -0.136  11.125   8.956
  Start of MODEL    8
 5589    HB2  GLU  53           HB2      GLU  53   1.736  12.492   9.112
  Start of MODEL    8
 5590    HB3  GLU  53           HB3      GLU  53   2.335  10.884   9.491
  Start of MODEL    8
 5591    HG2  GLU  53           HG2      GLU  53   3.103  10.707   7.134
  Start of MODEL    8
 5592    HG3  GLU  53           HG3      GLU  53   2.746  12.427   6.967
  Start of MODEL    8
 5593    H    TYR  54           H        TYR  54   1.396  10.238   5.927
  Start of MODEL    8
 5594    HA   TYR  54           HA       TYR  54   0.539  12.559   4.536
  Start of MODEL    8
 5595    HB2  TYR  54           HB2      TYR  54   2.409  10.946   3.880
  Start of MODEL    8
 5596    HB3  TYR  54           HB3      TYR  54   1.141   9.917   3.217
  Start of MODEL    8
 5597    HD1  TYR  54           HD1      TYR  54  -0.083  10.589   1.229
  Start of MODEL    8
 5598    HD2  TYR  54           HD2      TYR  54   2.979  13.057   2.843
  Start of MODEL    8
 5599    HE1  TYR  54           HE1      TYR  54  -0.052  11.893  -0.852
  Start of MODEL    8
 5600    HE2  TYR  54           HE2      TYR  54   3.025  14.372   0.766
  Start of MODEL    8
 5601    HH   TYR  54           HH       TYR  54   0.597  14.139  -1.602
  Start of MODEL    8
 5602    H    PHE  55           H        PHE  55  -0.732   9.220   4.482
  Start of MODEL    8
 5603    HA   PHE  55           HA       PHE  55  -2.874   9.891   2.762
  Start of MODEL    8
 5604    HB2  PHE  55           HB2      PHE  55  -2.233   7.478   4.421
  Start of MODEL    8
 5605    HB3  PHE  55           HB3      PHE  55  -3.732   7.588   3.500
  Start of MODEL    8
 5606    HD1  PHE  55           HD1      PHE  55  -0.075   7.434   3.275
  Start of MODEL    8
 5607    HD2  PHE  55           HD2      PHE  55  -3.738   7.411   1.115
  Start of MODEL    8
 5608    HE1  PHE  55           HE1      PHE  55   1.123   6.688   1.259
  Start of MODEL    8
 5609    HE2  PHE  55           HE2      PHE  55  -2.549   6.666  -0.904
  Start of MODEL    8
 5610    HZ   PHE  55           HZ       PHE  55  -0.128   6.308  -0.845
  Start of MODEL    8
 5611    H    GLU  56           H        GLU  56  -2.607   9.960   6.246
  Start of MODEL    8
 5612    HA   GLU  56           HA       GLU  56  -5.360   9.638   6.788
  Start of MODEL    8
 5613    HB2  GLU  56           HB2      GLU  56  -4.888  10.422   9.026
  Start of MODEL    8
 5614    HB3  GLU  56           HB3      GLU  56  -3.618   9.325   8.503
  Start of MODEL    8
 5615    HG2  GLU  56           HG2      GLU  56  -2.162  11.219   8.029
  Start of MODEL    8
 5616    HG3  GLU  56           HG3      GLU  56  -3.436  12.334   8.520
  Start of MODEL    8
 5617    H    GLN  57           H        GLN  57  -3.593  12.282   5.553
  Start of MODEL    8
 5618    HA   GLN  57           HA       GLN  57  -5.228  14.400   6.487
  Start of MODEL    8
 5619    HB2  GLN  57           HB2      GLN  57  -3.465  14.232   4.042
  Start of MODEL    8
 5620    HB3  GLN  57           HB3      GLN  57  -4.192  15.711   4.658
  Start of MODEL    8
 5621    HG2  GLN  57           HG2      GLN  57  -2.977  15.350   6.793
  Start of MODEL    8
 5622    HG3  GLN  57           HG3      GLN  57  -2.169  13.974   6.047
  Start of MODEL    8
 5623   HE21  GLN  57          HE21      GLN  57  -2.455  17.436   6.115
  Start of MODEL    8
 5624   HE22  GLN  57          HE22      GLN  57  -1.025  17.771   5.209
  Start of MODEL    8
 5625    H    PHE  58           H        PHE  58  -6.013  11.920   4.375
  Start of MODEL    8
 5626    HA   PHE  58           HA       PHE  58  -7.829  13.554   2.768
  Start of MODEL    8
 5627    HB2  PHE  58           HB2      PHE  58  -7.216  10.596   2.694
  Start of MODEL    8
 5628    HB3  PHE  58           HB3      PHE  58  -8.420  11.370   1.677
  Start of MODEL    8
 5629    HD1  PHE  58           HD1      PHE  58  -4.830  11.195   2.447
  Start of MODEL    8
 5630    HD2  PHE  58           HD2      PHE  58  -7.800  12.581  -0.268
  Start of MODEL    8
 5631    HE1  PHE  58           HE1      PHE  58  -3.077  11.710   0.799
  Start of MODEL    8
 5632    HE2  PHE  58           HE2      PHE  58  -6.052  13.106  -1.916
  Start of MODEL    8
 5633    HZ   PHE  58           HZ       PHE  58  -3.721  12.732  -1.403
  Start of MODEL    8
 5634    H    GLY  59           H        GLY  59  -7.825  11.756   5.634
  Start of MODEL    8
 5635    HA2  GLY  59           HA2      GLY  59 -10.383  12.479   6.425
  Start of MODEL    8
 5636    HA3  GLY  59           HA3      GLY  59 -10.534  10.899   5.669
  Start of MODEL    8
 5637    H    ASP  60           H        ASP  60 -10.245   9.192   6.905
  Start of MODEL    8
 5638    HA   ASP  60           HA       ASP  60  -8.464   9.406   9.230
  Start of MODEL    8
 5639    HB2  ASP  60           HB2      ASP  60 -11.256   8.261   9.170
  Start of MODEL    8
 5640    HB3  ASP  60           HB3      ASP  60 -10.086   7.795  10.400
  Start of MODEL    8
 5641    H    ILE  61           H        ILE  61  -7.329   7.497   9.748
  Start of MODEL    8
 5642    HA   ILE  61           HA       ILE  61  -7.468   5.415   7.684
  Start of MODEL    8
 5643    HB   ILE  61           HB       ILE  61  -5.168   6.565   9.221
  Start of MODEL    8
 5644   HD13  ILE  61          HD11      ILE  61  -3.456   7.571   7.660
  Start of MODEL    8
 5645   HD12  ILE  61          HD12      ILE  61  -3.628   7.326   5.921
  Start of MODEL    8
 5646   HD11  ILE  61          HD13      ILE  61  -3.180   5.973   6.964
  Start of MODEL    8
 5647    H    GLU  62           H        GLU  62  -7.616   3.332   8.221
  Start of MODEL    8
 5648    HA   GLU  62           HA       GLU  62  -8.315   2.553  10.908
  Start of MODEL    8
 5649    HB2  GLU  62           HB2      GLU  62  -8.001   1.142   8.261
  Start of MODEL    8
 5650    HB3  GLU  62           HB3      GLU  62  -8.245   0.235   9.737
  Start of MODEL    8
 5651    HG2  GLU  62           HG2      GLU  62 -10.121   2.345   8.705
  Start of MODEL    8
 5652    HG3  GLU  62           HG3      GLU  62 -10.306   0.616   8.416
  Start of MODEL    8
 5653    H    GLU  63           H        GLU  63  -5.742   1.889   8.595
  Start of MODEL    8
 5654    HA   GLU  63           HA       GLU  63  -3.737   1.498  10.641
  Start of MODEL    8
 5655    HB2  GLU  63           HB2      GLU  63  -4.766  -0.717  10.630
  Start of MODEL    8
 5656    HB3  GLU  63           HB3      GLU  63  -4.618  -0.806   8.884
  Start of MODEL    8
 5657    HG2  GLU  63           HG2      GLU  63  -2.927  -2.166   9.885
  Start of MODEL    8
 5658    HG3  GLU  63           HG3      GLU  63  -2.161  -0.775   9.120
  Start of MODEL    8
 5659    H    ALA  64           H        ALA  64  -1.695   1.942   9.817
  Start of MODEL    8
 5660    HA   ALA  64           HA       ALA  64  -1.400   1.990   6.904
  Start of MODEL    8
 5661    HB2  ALA  64           HB1      ALA  64  -0.354   4.186   6.952
  Start of MODEL    8
 5662    HB1  ALA  64           HB2      ALA  64  -0.650   4.305   8.685
  Start of MODEL    8
 5663    HB3  ALA  64           HB3      ALA  64  -2.007   4.272   7.560
  Start of MODEL    8
 5664    H    VAL  65           H        VAL  65   0.294   0.775   6.432
  Start of MODEL    8
 5665    HA   VAL  65           HA       VAL  65   2.658   0.889   8.166
  Start of MODEL    8
 5666    HB   VAL  65           HB       VAL  65   2.927  -1.591   8.026
  Start of MODEL    8
 5667    H    VAL  66           H        VAL  66   4.622   0.399   7.178
  Start of MODEL    8
 5668    HA   VAL  66           HA       VAL  66   4.578   0.178   4.246
  Start of MODEL    8
 5669    HB   VAL  66           HB       VAL  66   6.948   0.567   6.098
  Start of MODEL    8
 5670    H    ILE  67           H        ILE  67   5.367  -1.705   3.225
  Start of MODEL    8
 5671    HA   ILE  67           HA       ILE  67   5.041  -3.966   5.002
  Start of MODEL    8
 5672    HB   ILE  67           HB       ILE  67   5.192  -3.837   1.999
  Start of MODEL    8
 5673   HD11  ILE  67          HD11      ILE  67   3.214  -3.695   5.114
  Start of MODEL    8
 5674   HD13  ILE  67          HD12      ILE  67   2.805  -5.321   4.563
  Start of MODEL    8
 5675   HD12  ILE  67          HD13      ILE  67   1.655  -4.001   4.350
  Start of MODEL    8
 5676    H    THR  68           H        THR  68   6.557  -5.165   5.724
  Start of MODEL    8
 5677    HA   THR  68           HA       THR  68   9.243  -4.993   4.550
  Start of MODEL    8
 5678    HB   THR  68           HB       THR  68  10.106  -5.409   6.855
  Start of MODEL    8
 5679    HG1  THR  68           HG1      THR  68   8.010  -4.596   8.280
  Start of MODEL    8
 5680   HG21  THR  68          HG21      THR  68   8.367  -2.957   6.547
  Start of MODEL    8
 5681   HG23  THR  68          HG22      THR  68  10.044  -3.129   6.023
  Start of MODEL    8
 5682   HG22  THR  68          HG23      THR  68   9.653  -3.150   7.743
  Start of MODEL    8
 5683    H    ASP  69           H        ASP  69  10.367  -7.000   4.359
  Start of MODEL    8
 5684    HA   ASP  69           HA       ASP  69   8.988  -9.363   4.159
  Start of MODEL    8
 5685    HB2  ASP  69           HB2      ASP  69  11.171  -9.240   3.228
  Start of MODEL    8
 5686    HB3  ASP  69           HB3      ASP  69  11.885  -8.763   4.764
  Start of MODEL    8
 5687    H    ARG  70           H        ARG  70   8.114 -10.728   5.573
  Start of MODEL    8
 5688    HA   ARG  70           HA       ARG  70   7.800 -10.085   8.249
  Start of MODEL    8
 5689    HB2  ARG  70           HB2      ARG  70   6.317 -11.562   6.886
  Start of MODEL    8
 5690    HB3  ARG  70           HB3      ARG  70   7.518 -12.838   7.038
  Start of MODEL    8
 5691    HG2  ARG  70           HG2      ARG  70   5.674 -13.109   8.625
  Start of MODEL    8
 5692    HG3  ARG  70           HG3      ARG  70   7.223 -12.866   9.441
  Start of MODEL    8
 5693    HD2  ARG  70           HD2      ARG  70   6.702 -10.591   9.919
  Start of MODEL    8
 5694    HD3  ARG  70           HD3      ARG  70   5.282 -10.636   8.878
  Start of MODEL    8
 5695    HE   ARG  70           HE       ARG  70   4.946 -12.564  10.877
  Start of MODEL    8
 5696   HH11  ARG  70          HH11      ARG  70   5.207  -9.082  10.605
  Start of MODEL    8
 5697   HH12  ARG  70          HH12      ARG  70   4.129  -8.759  11.929
  Start of MODEL    8
 5698   HH21  ARG  70          HH21      ARG  70   3.551 -12.158  12.647
  Start of MODEL    8
 5699   HH22  ARG  70          HH22      ARG  70   3.215 -10.518  13.110
  Start of MODEL    8
 5700    H    ASN  71           H        ASN  71  10.394 -11.781   6.761
  Start of MODEL    8
 5701    HA   ASN  71           HA       ASN  71  11.174 -13.166   9.176
  Start of MODEL    8
 5702    HB2  ASN  71           HB2      ASN  71  12.741 -12.929   6.603
  Start of MODEL    8
 5703    HB3  ASN  71           HB3      ASN  71  12.973 -14.099   7.893
  Start of MODEL    8
 5704   HD21  ASN  71          HD21      ASN  71  11.037 -13.207   5.146
  Start of MODEL    8
 5705   HD22  ASN  71          HD22      ASN  71  10.149 -14.690   5.055
  Start of MODEL    8
 5706    H    THR  72           H        THR  72  12.640 -10.650   7.104
  Start of MODEL    8
 5707    HA   THR  72           HA       THR  72  14.563 -10.110   9.250
  Start of MODEL    8
 5708    HB   THR  72           HB       THR  72  15.733  -8.762   7.474
  Start of MODEL    8
 5709    HG1  THR  72           HG1      THR  72  13.810 -10.025   5.761
  Start of MODEL    8
 5710   HG21  THR  72          HG21      THR  72  15.215 -11.654   6.769
  Start of MODEL    8
 5711   HG23  THR  72          HG22      THR  72  16.346 -11.099   8.001
  Start of MODEL    8
 5712   HG22  THR  72          HG23      THR  72  16.623 -10.695   6.308
  Start of MODEL    8
 5713    H    GLN  73           H        GLN  73  11.735  -8.825   7.938
  Start of MODEL    8
 5714    HA   GLN  73           HA       GLN  73  10.536  -6.938   8.293
  Start of MODEL    8
 5715    HB2  GLN  73           HB2      GLN  73  12.539  -6.413  10.496
  Start of MODEL    8
 5716    HB3  GLN  73           HB3      GLN  73  11.002  -5.580  10.290
  Start of MODEL    8
 5717    HG2  GLN  73           HG2      GLN  73   9.919  -7.870  10.452
  Start of MODEL    8
 5718    HG3  GLN  73           HG3      GLN  73  11.489  -8.450  11.021
  Start of MODEL    8
 5719   HE21  GLN  73          HE21      GLN  73   8.706  -6.514  11.723
  Start of MODEL    8
 5720   HE22  GLN  73          HE22      GLN  73   9.029  -6.277  13.410
  Start of MODEL    8
 5721    H    LYS  74           H        LYS  74  12.756  -7.014   6.452
  Start of MODEL    8
 5722    HA   LYS  74           HA       LYS  74  13.661  -4.240   6.354
  Start of MODEL    8
 5723    HB2  LYS  74           HB2      LYS  74  14.214  -6.589   4.527
  Start of MODEL    8
 5724    HB3  LYS  74           HB3      LYS  74  14.862  -4.972   4.289
  Start of MODEL    8
 5725    HG2  LYS  74           HG2      LYS  74  15.372  -6.700   6.701
  Start of MODEL    8
 5726    HG3  LYS  74           HG3      LYS  74  16.474  -6.505   5.337
  Start of MODEL    8
 5727    HD2  LYS  74           HD2      LYS  74  15.519  -4.281   7.142
  Start of MODEL    8
 5728    HD3  LYS  74           HD3      LYS  74  17.086  -5.087   7.259
  Start of MODEL    8
 5729    HE2  LYS  74           HE2      LYS  74  17.666  -4.317   5.023
  Start of MODEL    8
 5730    HE3  LYS  74           HE3      LYS  74  16.084  -3.557   4.855
  Start of MODEL    8
 5731    HZ1  LYS  74           HZ1      LYS  74  18.175  -2.808   6.833
  Start of MODEL    8
 5732    HZ3  LYS  74           HZ2      LYS  74  16.645  -2.092   6.706
  Start of MODEL    8
 5733    HZ2  LYS  74           HZ3      LYS  74  17.762  -1.934   5.442
  Start of MODEL    8
 5734    H    SER  75           H        SER  75  12.847  -2.728   4.993
  Start of MODEL    8
 5735    HA   SER  75           HA       SER  75  10.220  -2.996   4.111
  Start of MODEL    8
 5736    HB2  SER  75           HB2      SER  75  10.813  -0.814   2.840
  Start of MODEL    8
 5737    HB3  SER  75           HB3      SER  75  10.909  -0.817   4.602
  Start of MODEL    8
 5738    HG   SER  75           HG       SER  75  12.800   0.057   3.966
  Start of MODEL    8
 5739    H    ARG  76           H        ARG  76   9.279  -3.517   2.229
  Start of MODEL    8
 5740    HA   ARG  76           HA       ARG  76  10.995  -4.646   0.137
  Start of MODEL    8
 5741    HB2  ARG  76           HB2      ARG  76   7.991  -4.839   0.377
  Start of MODEL    8
 5742    HB3  ARG  76           HB3      ARG  76   9.045  -5.828  -0.621
  Start of MODEL    8
 5743    HG2  ARG  76           HG2      ARG  76  10.103  -6.622   1.549
  Start of MODEL    8
 5744    HG3  ARG  76           HG3      ARG  76   8.737  -5.858   2.364
  Start of MODEL    8
 5745    HD2  ARG  76           HD2      ARG  76   8.274  -8.207   2.028
  Start of MODEL    8
 5746    HD3  ARG  76           HD3      ARG  76   7.199  -7.241   1.017
  Start of MODEL    8
 5747    HE   ARG  76           HE       ARG  76   8.632  -7.806  -0.876
  Start of MODEL    8
 5748   HH11  ARG  76          HH11      ARG  76   8.905  -9.761   2.008
  Start of MODEL    8
 5749   HH12  ARG  76          HH12      ARG  76   9.619 -11.116   1.190
  Start of MODEL    8
 5750   HH21  ARG  76          HH21      ARG  76   9.578  -9.591  -1.978
  Start of MODEL    8
 5751   HH22  ARG  76          HH22      ARG  76   9.977 -11.020  -1.072
  Start of MODEL    8
 5752    H    GLY  77           H        GLY  77  10.234  -1.739   0.661
  Start of MODEL    8
 5753    HA2  GLY  77           HA2      GLY  77  10.004   0.133  -0.656
  Start of MODEL    8
 5754    HA3  GLY  77           HA3      GLY  77  10.120  -0.931  -2.044
  Start of MODEL    8
 5755    H    TYR  78           H        TYR  78   7.549  -1.650   0.104
  Start of MODEL    8
 5756    HA   TYR  78           HA       TYR  78   5.711   0.189  -1.129
  Start of MODEL    8
 5757    HB2  TYR  78           HB2      TYR  78   4.164  -1.553  -1.949
  Start of MODEL    8
 5758    HB3  TYR  78           HB3      TYR  78   5.695  -1.559  -2.809
  Start of MODEL    8
 5759    HD1  TYR  78           HD1      TYR  78   3.623  -3.351  -0.360
  Start of MODEL    8
 5760    HD2  TYR  78           HD2      TYR  78   7.127  -3.487  -2.767
  Start of MODEL    8
 5761    HE1  TYR  78           HE1      TYR  78   3.854  -5.746   0.122
  Start of MODEL    8
 5762    HE2  TYR  78           HE2      TYR  78   7.365  -5.886  -2.296
  Start of MODEL    8
 5763    HH   TYR  78           HH       TYR  78   6.681  -7.515  -0.634
  Start of MODEL    8
 5764    H    GLY  79           H        GLY  79   3.430  -0.201  -0.198
  Start of MODEL    8
 5765    HA2  GLY  79           HA2      GLY  79   3.473  -1.424   2.429
  Start of MODEL    8
 5766    HA3  GLY  79           HA3      GLY  79   3.423   0.330   2.430
  Start of MODEL    8
 5767    H    PHE  80           H        PHE  80   1.421  -0.500   3.685
  Start of MODEL    8
 5768    HA   PHE  80           HA       PHE  80  -0.815  -0.448   1.806
  Start of MODEL    8
 5769    HB2  PHE  80           HB2      PHE  80  -0.388  -2.433   4.005
  Start of MODEL    8
 5770    HB3  PHE  80           HB3      PHE  80  -2.012  -2.014   3.472
  Start of MODEL    8
 5771    HD1  PHE  80           HD1      PHE  80   1.012  -3.818   2.732
  Start of MODEL    8
 5772    HD2  PHE  80           HD2      PHE  80  -2.697  -2.501   1.136
  Start of MODEL    8
 5773    HE1  PHE  80           HE1      PHE  80   1.244  -5.427   0.894
  Start of MODEL    8
 5774    HE2  PHE  80           HE2      PHE  80  -2.480  -4.106  -0.709
  Start of MODEL    8
 5775    HZ   PHE  80           HZ       PHE  80  -0.607  -5.589  -0.830
  Start of MODEL    8
 5776    H    VAL  81           H        VAL  81  -2.459   0.720   2.321
  Start of MODEL    8
 5777    HA   VAL  81           HA       VAL  81  -2.724   1.674   5.099
  Start of MODEL    8
 5778    HB   VAL  81           HB       VAL  81  -3.288   3.334   2.628
  Start of MODEL    8
 5779    H    THR  82           H        THR  82  -4.636   1.273   5.984
  Start of MODEL    8
 5780    HA   THR  82           HA       THR  82  -6.878   0.575   4.218
  Start of MODEL    8
 5781    HB   THR  82           HB       THR  82  -6.671   0.028   7.190
  Start of MODEL    8
 5782    HG1  THR  82           HG1      THR  82  -5.644  -1.366   4.980
  Start of MODEL    8
 5783   HG23  THR  82          HG21      THR  82  -8.936  -0.002   6.162
  Start of MODEL    8
 5784   HG22  THR  82          HG22      THR  82  -8.441  -1.576   6.777
  Start of MODEL    8
 5785   HG21  THR  82          HG23      THR  82  -8.379  -1.248   5.047
  Start of MODEL    8
 5786    H    MET  83           H        MET  83  -8.098   2.334   3.887
  Start of MODEL    8
 5787    HA   MET  83           HA       MET  83  -8.041   4.528   5.767
  Start of MODEL    8
 5788    HB2  MET  83           HB2      MET  83  -9.538   4.204   3.155
  Start of MODEL    8
 5789    HB3  MET  83           HB3      MET  83  -9.432   5.690   4.092
  Start of MODEL    8
 5790    HG2  MET  83           HG2      MET  83  -7.094   4.245   2.872
  Start of MODEL    8
 5791    HG3  MET  83           HG3      MET  83  -7.909   5.634   2.157
  Start of MODEL    8
 5792    HE1  MET  83           HE1      MET  83  -8.489   7.515   4.671
  Start of MODEL    8
 5793    HE3  MET  83           HE2      MET  83  -7.824   8.065   3.131
  Start of MODEL    8
 5794    HE2  MET  83           HE3      MET  83  -7.027   8.509   4.639
  Start of MODEL    8
 5795    H    LYS  84           H        LYS  84  -9.881   5.423   6.750
  Start of MODEL    8
 5796    HA   LYS  84           HA       LYS  84 -11.595   3.396   7.827
  Start of MODEL    8
 5797    HB2  LYS  84           HB2      LYS  84 -10.530   5.394   9.044
  Start of MODEL    8
 5798    HB3  LYS  84           HB3      LYS  84 -11.819   6.351   8.329
  Start of MODEL    8
 5799    HG2  LYS  84           HG2      LYS  84 -13.486   5.113   9.495
  Start of MODEL    8
 5800    HG3  LYS  84           HG3      LYS  84 -12.296   3.938  10.060
  Start of MODEL    8
 5801    HD2  LYS  84           HD2      LYS  84 -12.226   6.874  10.753
  Start of MODEL    8
 5802    HD3  LYS  84           HD3      LYS  84 -12.980   5.646  11.768
  Start of MODEL    8
 5803    HE2  LYS  84           HE2      LYS  84 -10.109   5.439  10.897
  Start of MODEL    8
 5804    HE3  LYS  84           HE3      LYS  84 -10.581   6.354  12.330
  Start of MODEL    8
 5805    HZ1  LYS  84           HZ1      LYS  84 -11.047   3.461  11.838
  Start of MODEL    8
 5806    HZ3  LYS  84           HZ2      LYS  84 -11.602   4.312  13.195
  Start of MODEL    8
 5807    HZ2  LYS  84           HZ3      LYS  84  -9.943   4.139  12.931
  Start of MODEL    8
 5808    H    ASP  85           H        ASP  85 -11.797   5.582   5.200
  Start of MODEL    8
 5809    HA   ASP  85           HA       ASP  85 -14.583   4.835   4.789
  Start of MODEL    8
 5810    HB2  ASP  85           HB2      ASP  85 -14.659   7.055   5.866
  Start of MODEL    8
 5811    HB3  ASP  85           HB3      ASP  85 -13.646   7.703   4.577
  Start of MODEL    8
 5812    H    ARG  86           H        ARG  86 -15.232   4.778   2.647
  Start of MODEL    8
 5813    HA   ARG  86           HA       ARG  86 -13.351   4.081   0.731
  Start of MODEL    8
 5814    HB2  ARG  86           HB2      ARG  86 -15.667   3.340   0.696
  Start of MODEL    8
 5815    HB3  ARG  86           HB3      ARG  86 -16.219   4.986   0.438
  Start of MODEL    8
 5816    HG2  ARG  86           HG2      ARG  86 -15.103   4.995  -1.750
  Start of MODEL    8
 5817    HG3  ARG  86           HG3      ARG  86 -14.618   3.319  -1.489
  Start of MODEL    8
 5818    HD2  ARG  86           HD2      ARG  86 -17.418   4.411  -1.763
  Start of MODEL    8
 5819    HD3  ARG  86           HD3      ARG  86 -16.592   3.291  -2.846
  Start of MODEL    8
 5820    HE   ARG  86           HE       ARG  86 -17.041   2.429  -0.092
  Start of MODEL    8
 5821   HH11  ARG  86          HH11      ARG  86 -18.019   2.257  -3.459
  Start of MODEL    8
 5822   HH12  ARG  86          HH12      ARG  86 -18.917   0.781  -3.243
  Start of MODEL    8
 5823   HH21  ARG  86          HH21      ARG  86 -18.253   0.521   0.197
  Start of MODEL    8
 5824   HH22  ARG  86          HH22      ARG  86 -19.019  -0.221  -1.181
  Start of MODEL    8
 5825    H    ALA  87           H        ALA  87 -15.055   7.148   1.203
  Start of MODEL    8
 5826    HA   ALA  87           HA       ALA  87 -14.273   8.285  -1.277
  Start of MODEL    8
 5827    HB3  ALA  87           HB1      ALA  87 -16.178   9.136  -0.008
  Start of MODEL    8
 5828    HB2  ALA  87           HB2      ALA  87 -15.016  10.418  -0.347
  Start of MODEL    8
 5829    HB1  ALA  87           HB3      ALA  87 -15.089   9.699   1.262
  Start of MODEL    8
 5830    H    SER  88           H        SER  88 -12.879   8.418   1.957
  Start of MODEL    8
 5831    HA   SER  88           HA       SER  88 -10.882  10.331   1.424
  Start of MODEL    8
 5832    HB2  SER  88           HB2      SER  88 -10.660   8.014   3.360
  Start of MODEL    8
 5833    HB3  SER  88           HB3      SER  88  -9.872   9.588   3.476
  Start of MODEL    8
 5834    HG   SER  88           HG       SER  88 -12.206  10.373   3.473
  Start of MODEL    8
 5835    H    ALA  89           H        ALA  89 -10.934   6.805   1.223
  Start of MODEL    8
 5836    HA   ALA  89           HA       ALA  89  -8.243   6.406   0.499
  Start of MODEL    8
 5837    HB1  ALA  89           HB1      ALA  89 -10.638   4.705  -0.202
  Start of MODEL    8
 5838    HB3  ALA  89           HB2      ALA  89  -9.716   4.604   1.298
  Start of MODEL    8
 5839    HB2  ALA  89           HB3      ALA  89  -8.948   4.199  -0.236
  Start of MODEL    8
 5840    H    GLU  90           H        GLU  90 -11.157   6.903  -1.445
  Start of MODEL    8
 5841    HA   GLU  90           HA       GLU  90  -9.861   6.392  -3.911
  Start of MODEL    8
 5842    HB2  GLU  90           HB2      GLU  90 -12.335   6.184  -3.482
  Start of MODEL    8
 5843    HB3  GLU  90           HB3      GLU  90 -12.419   7.943  -3.545
  Start of MODEL    8
 5844    HG2  GLU  90           HG2      GLU  90 -11.743   7.990  -5.807
  Start of MODEL    8
 5845    HG3  GLU  90           HG3      GLU  90 -11.270   6.290  -5.768
  Start of MODEL    8
 5846    H    ARG  91           H        ARG  91 -10.537   9.374  -2.097
  Start of MODEL    8
 5847    HA   ARG  91           HA       ARG  91  -9.722  11.202  -4.048
  Start of MODEL    8
 5848    HB2  ARG  91           HB2      ARG  91  -9.275  11.375  -1.057
  Start of MODEL    8
 5849    HB3  ARG  91           HB3      ARG  91  -9.115  12.712  -2.184
  Start of MODEL    8
 5850    HG2  ARG  91           HG2      ARG  91 -11.616  11.230  -1.445
  Start of MODEL    8
 5851    HG3  ARG  91           HG3      ARG  91 -11.214  12.910  -1.094
  Start of MODEL    8
 5852    HD2  ARG  91           HD2      ARG  91 -11.745  11.703  -3.808
  Start of MODEL    8
 5853    HD3  ARG  91           HD3      ARG  91 -12.777  12.832  -2.932
  Start of MODEL    8
 5854    HE   ARG  91           HE       ARG  91 -10.444  14.187  -3.154
  Start of MODEL    8
 5855   HH11  ARG  91          HH11      ARG  91 -12.511  12.565  -5.461
  Start of MODEL    8
 5856   HH12  ARG  91          HH12      ARG  91 -12.080  13.600  -6.782
  Start of MODEL    8
 5857   HH21  ARG  91          HH21      ARG  91  -9.851  15.534  -4.859
  Start of MODEL    8
 5858   HH22  ARG  91          HH22      ARG  91 -10.525  15.297  -6.446
  Start of MODEL    8
 5859    H    ALA  92           H        ALA  92  -7.855   9.415  -1.646
  Start of MODEL    8
 5860    HA   ALA  92           HA       ALA  92  -5.321  10.410  -2.291
  Start of MODEL    8
 5861    HB2  ALA  92           HB1      ALA  92  -4.425   8.418  -1.211
  Start of MODEL    8
 5862    HB1  ALA  92           HB2      ALA  92  -6.007   7.646  -1.295
  Start of MODEL    8
 5863    HB3  ALA  92           HB3      ALA  92  -5.774   9.071  -0.284
  Start of MODEL    8
 5864    H    CYS  93           H        CYS  93  -7.247   7.859  -3.776
  Start of MODEL    8
 5865    HA   CYS  93           HA       CYS  93  -5.063   6.935  -5.404
  Start of MODEL    8
 5866    HB2  CYS  93           HB2      CYS  93  -7.996   6.259  -5.540
  Start of MODEL    8
 5867    HB3  CYS  93           HB3      CYS  93  -6.701   5.407  -6.375
  Start of MODEL    8
 5868    HG   CYS  93           HG       CYS  93  -7.154   5.549  -2.981
  Start of MODEL    8
 5869    H    LYS  94           H        LYS  94  -7.247   9.518  -5.671
  Start of MODEL    8
 5870    HA   LYS  94           HA       LYS  94  -7.438   9.517  -8.531
  Start of MODEL    8
 5871    HB2  LYS  94           HB2      LYS  94  -9.082  10.691  -7.085
  Start of MODEL    8
 5872    HB3  LYS  94           HB3      LYS  94  -7.830  11.849  -6.643
  Start of MODEL    8
 5873    HG2  LYS  94           HG2      LYS  94  -9.347  12.690  -8.401
  Start of MODEL    8
 5874    HG3  LYS  94           HG3      LYS  94  -7.666  12.607  -8.934
  Start of MODEL    8
 5875    HD2  LYS  94           HD2      LYS  94  -8.127  10.487 -10.058
  Start of MODEL    8
 5876    HD3  LYS  94           HD3      LYS  94  -9.801  10.555  -9.519
  Start of MODEL    8
 5877    HE2  LYS  94           HE2      LYS  94  -9.652  11.270 -11.826
  Start of MODEL    8
 5878    HE3  LYS  94           HE3      LYS  94 -10.114  12.632 -10.806
  Start of MODEL    8
 5879    HZ1  LYS  94           HZ1      LYS  94  -7.303  12.152 -11.604
  Start of MODEL    8
 5880    HZ3  LYS  94           HZ2      LYS  94  -8.001  13.577 -11.000
  Start of MODEL    8
 5881    HZ2  LYS  94           HZ3      LYS  94  -8.367  13.045 -12.562
  Start of MODEL    8
 5882    H    ASP  95           H        ASP  95  -5.204  10.804  -6.174
  Start of MODEL    8
 5883    HA   ASP  95           HA       ASP  95  -3.520  11.722  -8.409
  Start of MODEL    8
 5884    HB2  ASP  95           HB2      ASP  95  -3.996  13.350  -6.506
  Start of MODEL    8
 5885    HB3  ASP  95           HB3      ASP  95  -3.041  12.288  -5.476
  Start of MODEL    8
 5886    HA   PRO  96           HA       PRO  96  -2.162   7.538  -7.257
  Start of MODEL    8
 5887    HB2  PRO  96           HB2      PRO  96  -1.106   6.887  -9.665
  Start of MODEL    8
 5888    HB3  PRO  96           HB3      PRO  96  -2.840   6.833  -9.325
  Start of MODEL    8
 5889    HG2  PRO  96           HG2      PRO  96  -1.246   8.947 -10.723
  Start of MODEL    8
 5890    HG3  PRO  96           HG3      PRO  96  -2.829   8.270 -11.149
  Start of MODEL    8
 5891    HD2  PRO  96           HD2      PRO  96  -2.538  10.651  -9.887
  Start of MODEL    8
 5892    HD3  PRO  96           HD3      PRO  96  -3.941   9.596  -9.633
  Start of MODEL    8
 5893    H    ASN  97           H        ASN  97  -0.278  10.258  -8.011
  Start of MODEL    8
 5894    HA   ASN  97           HA       ASN  97   2.170   8.744  -7.416
  Start of MODEL    8
 5895    HB2  ASN  97           HB2      ASN  97   1.790  10.735  -9.649
  Start of MODEL    8
 5896    HB3  ASN  97           HB3      ASN  97   3.372  10.231  -9.070
  Start of MODEL    8
 5897   HD21  ASN  97          HD21      ASN  97   2.635   7.486  -8.582
  Start of MODEL    8
 5898   HD22  ASN  97          HD22      ASN  97   2.443   6.741 -10.139
  Start of MODEL    8
 5899    HA   PRO  98           HA       PRO  98   1.996  12.647  -4.844
  Start of MODEL    8
 5900    HB2  PRO  98           HB2      PRO  98   2.092  10.908  -2.516
  Start of MODEL    8
 5901    HB3  PRO  98           HB3      PRO  98   0.881  12.119  -2.942
  Start of MODEL    8
 5902    HG2  PRO  98           HG2      PRO  98   0.375   9.445  -2.947
  Start of MODEL    8
 5903    HG3  PRO  98           HG3      PRO  98  -0.460  10.596  -4.009
  Start of MODEL    8
 5904    HD2  PRO  98           HD2      PRO  98   1.829   8.757  -4.626
  Start of MODEL    8
 5905    HD3  PRO  98           HD3      PRO  98   0.395   9.139  -5.603
  Start of MODEL    8
 5906    H    ILE  99           H        ILE  99   3.847  13.548  -3.981
  Start of MODEL    8
 5907    HA   ILE  99           HA       ILE  99   6.270  11.982  -4.040
  Start of MODEL    8
 5908    HB   ILE  99           HB       ILE  99   5.874  14.833  -3.111
  Start of MODEL    8
 5909   HD13  ILE  99          HD11      ILE  99   7.981  13.361  -5.853
  Start of MODEL    8
 5910   HD12  ILE  99          HD12      ILE  99   6.882  13.864  -7.138
  Start of MODEL    8
 5911   HD11  ILE  99          HD13      ILE  99   6.426  12.553  -6.050
  Start of MODEL    8
 5912    H    ILE 100           H        ILE 100   6.716  10.645  -2.429
  Start of MODEL    8
 5913    HA   ILE 100           HA       ILE 100   6.187  11.527   0.336
  Start of MODEL    8
 5914    HB   ILE 100           HB       ILE 100   5.969   8.699  -0.724
  Start of MODEL    8
 5915   HD11  ILE 100          HD11      ILE 100   3.315   8.173   0.724
  Start of MODEL    8
 5916   HD13  ILE 100          HD12      ILE 100   3.554   7.844  -0.990
  Start of MODEL    8
 5917   HD12  ILE 100          HD13      ILE 100   2.231   8.885  -0.468
  Start of MODEL    8
 5918    H    ASP 101           H        ASP 101   8.024  11.804   1.380
  Start of MODEL    8
 5919    HA   ASP 101           HA       ASP 101  10.127  11.507   2.207
  Start of MODEL    8
 5920    HB2  ASP 101           HB2      ASP 101   9.230   9.233   2.690
  Start of MODEL    8
 5921    HB3  ASP 101           HB3      ASP 101   9.839   8.685   1.134
  Start of MODEL    8
 5922    H    GLY 102           H        GLY 102   9.717  12.540  -0.406
  Start of MODEL    8
 5923    HA2  GLY 102           HA2      GLY 102  11.189  13.493  -1.916
  Start of MODEL    8
 5924    HA3  GLY 102           HA3      GLY 102  12.448  12.421  -1.321
  Start of MODEL    8
 5925    H    ARG 103           H        ARG 103   9.801  10.561  -2.060
  Start of MODEL    8
 5926    HA   ARG 103           HA       ARG 103  10.754  10.098  -4.811
  Start of MODEL    8
 5927    HB2  ARG 103           HB2      ARG 103  11.634   8.300  -3.570
  Start of MODEL    8
 5928    HB3  ARG 103           HB3      ARG 103  10.183   8.150  -2.592
  Start of MODEL    8
 5929    HG2  ARG 103           HG2      ARG 103  10.181   6.293  -4.010
  Start of MODEL    8
 5930    HG3  ARG 103           HG3      ARG 103   9.003   7.401  -4.707
  Start of MODEL    8
 5931    HD2  ARG 103           HD2      ARG 103  10.743   8.157  -6.300
  Start of MODEL    8
 5932    HD3  ARG 103           HD3      ARG 103  11.829   6.931  -5.644
  Start of MODEL    8
 5933    HE   ARG 103           HE       ARG 103   9.309   5.858  -6.485
  Start of MODEL    8
 5934   HH11  ARG 103          HH11      ARG 103  12.496   6.811  -7.627
  Start of MODEL    8
 5935   HH12  ARG 103          HH12      ARG 103  12.455   5.742  -9.004
  Start of MODEL    8
 5936   HH21  ARG 103          HH21      ARG 103   9.260   4.463  -8.283
  Start of MODEL    8
 5937   HH22  ARG 103          HH22      ARG 103  10.605   4.411  -9.382
  Start of MODEL    8
 5938    H    LYS 104           H        LYS 104   9.210   9.924  -6.352
  Start of MODEL    8
 5939    HA   LYS 104           HA       LYS 104   6.465  10.344  -5.686
  Start of MODEL    8
 5940    HB2  LYS 104           HB2      LYS 104   7.403  11.228  -7.763
  Start of MODEL    8
 5941    HB3  LYS 104           HB3      LYS 104   7.787   9.602  -8.306
  Start of MODEL    8
 5942    HG2  LYS 104           HG2      LYS 104   5.468   9.056  -8.521
  Start of MODEL    8
 5943    HG3  LYS 104           HG3      LYS 104   4.994  10.575  -7.758
  Start of MODEL    8
 5944    HD2  LYS 104           HD2      LYS 104   6.590  10.475 -10.312
  Start of MODEL    8
 5945    HD3  LYS 104           HD3      LYS 104   4.826  10.480 -10.293
  Start of MODEL    8
 5946    HE2  LYS 104           HE2      LYS 104   6.504  12.585  -8.943
  Start of MODEL    8
 5947    HE3  LYS 104           HE3      LYS 104   5.921  12.727 -10.601
  Start of MODEL    8
 5948    HZ3  LYS 104           HZ1      LYS 104   3.687  12.725  -9.868
  Start of MODEL    8
 5949    HZ2  LYS 104           HZ2      LYS 104   4.502  13.827  -8.871
  Start of MODEL    8
 5950    HZ1  LYS 104           HZ3      LYS 104   4.114  12.285  -8.287
  Start of MODEL    8
 5951    H    ALA 105           H        ALA 105   4.962   8.871  -5.239
  Start of MODEL    8
 5952    HA   ALA 105           HA       ALA 105   5.788   6.052  -5.376
  Start of MODEL    8
 5953    HB2  ALA 105           HB1      ALA 105   4.259   5.679  -3.510
  Start of MODEL    8
 5954    HB1  ALA 105           HB2      ALA 105   3.795   7.380  -3.545
  Start of MODEL    8
 5955    HB3  ALA 105           HB3      ALA 105   5.445   6.925  -3.121
  Start of MODEL    8
 5956    H    ASN 106           H        ASN 106   4.109   4.465  -5.696
  Start of MODEL    8
 5957    HA   ASN 106           HA       ASN 106   2.133   5.382  -7.680
  Start of MODEL    8
 5958    HB2  ASN 106           HB2      ASN 106   3.062   2.545  -7.111
  Start of MODEL    8
 5959    HB3  ASN 106           HB3      ASN 106   2.106   3.089  -8.483
  Start of MODEL    8
 5960   HD21  ASN 106          HD21      ASN 106   3.132   3.772 -10.282
  Start of MODEL    8
 5961   HD22  ASN 106          HD22      ASN 106   4.850   3.931 -10.422
  Start of MODEL    8
 5962    H    VAL 107           H        VAL 107   0.163   5.711  -6.778
  Start of MODEL    8
 5963    HA   VAL 107           HA       VAL 107  -0.657   3.875  -4.620
  Start of MODEL    8
 5964    HB   VAL 107           HB       VAL 107  -1.464   6.760  -5.039
  Start of MODEL    8
 5965    H    ASN 108           H        ASN 108  -2.360   2.657  -4.946
  Start of MODEL    8
 5966    HA   ASN 108           HA       ASN 108  -4.653   3.635  -6.410
  Start of MODEL    8
 5967    HB2  ASN 108           HB2      ASN 108  -4.779   1.705  -7.930
  Start of MODEL    8
 5968    HB3  ASN 108           HB3      ASN 108  -3.321   2.645  -8.225
  Start of MODEL    8
 5969   HD21  ASN 108          HD21      ASN 108  -4.605  -0.372  -7.085
  Start of MODEL    8
 5970   HD22  ASN 108          HD22      ASN 108  -3.100  -1.217  -7.017
  Start of MODEL    8
 5971    H    LEU 109           H        LEU 109  -6.576   2.429  -5.933
  Start of MODEL    8
 5972    HA   LEU 109           HA       LEU 109  -6.735   1.128  -3.479
  Start of MODEL    8
 5973    HB2  LEU 109           HB2      LEU 109  -8.506   0.950  -5.909
  Start of MODEL    8
 5974    HB3  LEU 109           HB3      LEU 109  -8.901   0.174  -4.387
  Start of MODEL    8
 5975    HG   LEU 109           HG       LEU 109  -8.547   3.137  -4.822
  Start of MODEL    8
 5976   HD12  LEU 109          HD11      LEU 109 -10.943   3.263  -4.416
  Start of MODEL    8
 5977   HD11  LEU 109          HD12      LEU 109 -11.022   1.509  -4.262
  Start of MODEL    8
 5978   HD13  LEU 109          HD13      LEU 109 -10.598   2.240  -5.809
  Start of MODEL    8
 5979   HD23  LEU 109          HD21      LEU 109  -9.390   1.631  -2.346
  Start of MODEL    8
 5980   HD22  LEU 109          HD22      LEU 109  -9.294   3.385  -2.523
  Start of MODEL    8
 5981   HD21  LEU 109          HD23      LEU 109  -7.825   2.411  -2.590
  Start of MODEL    8
 5982    H    ALA 110           H        ALA 110  -6.470  -0.936  -2.807
  Start of MODEL    8
 5983    HA   ALA 110           HA       ALA 110  -4.520  -2.342  -4.276
  Start of MODEL    8
 5984    HB2  ALA 110           HB1      ALA 110  -5.986  -3.217  -1.803
  Start of MODEL    8
 5985    HB1  ALA 110           HB2      ALA 110  -4.547  -2.201  -1.835
  Start of MODEL    8
 5986    HB3  ALA 110           HB3      ALA 110  -4.465  -3.868  -2.403
  Start of MODEL    8
 5987    H    TYR 111           H        TYR 111  -7.982  -2.840  -3.987
  Start of MODEL    8
 5988    HA   TYR 111           HA       TYR 111  -7.965  -5.574  -4.746
  Start of MODEL    8
 5989    HB2  TYR 111           HB2      TYR 111 -10.314  -5.425  -4.933
  Start of MODEL    8
 5990    HB3  TYR 111           HB3      TYR 111  -9.878  -4.305  -3.652
  Start of MODEL    8
 5991    HD1  TYR 111           HD1      TYR 111  -9.279  -1.850  -4.734
  Start of MODEL    8
 5992    HD2  TYR 111           HD2      TYR 111 -12.045  -4.684  -6.278
  Start of MODEL    8
 5993    HE1  TYR 111           HE1      TYR 111 -10.472  -0.040  -5.891
  Start of MODEL    8
 5994    HE2  TYR 111           HE2      TYR 111 -13.244  -2.880  -7.439
  Start of MODEL    8
 5995    HH   TYR 111           HH       TYR 111 -13.550  -0.468  -7.270
  Start of MODEL    8
 5996    H    LEU 112           H        LEU 112  -7.515  -2.706  -6.535
  Start of MODEL    8
 5997    HA   LEU 112           HA       LEU 112  -8.427  -3.516  -9.060
  Start of MODEL    8
 5998    HB2  LEU 112           HB2      LEU 112  -6.293  -1.531  -8.301
  Start of MODEL    8
 5999    HB3  LEU 112           HB3      LEU 112  -6.915  -1.735  -9.931
  Start of MODEL    8
 6000    HG   LEU 112           HG       LEU 112  -8.512  -0.851  -7.525
  Start of MODEL    8
 6001   HD13  LEU 112          HD11      LEU 112  -7.008   0.869  -8.330
  Start of MODEL    8
 6002   HD12  LEU 112          HD12      LEU 112  -8.674   1.273  -8.740
  Start of MODEL    8
 6003   HD11  LEU 112          HD13      LEU 112  -7.588   0.639  -9.977
  Start of MODEL    8
 6004   HD22  LEU 112          HD21      LEU 112 -10.344  -0.565  -9.082
  Start of MODEL    8
 6005   HD21  LEU 112          HD22      LEU 112  -9.790  -2.241  -9.089
  Start of MODEL    8
 6006   HD23  LEU 112          HD23      LEU 112  -9.339  -1.158 -10.405
  Start of MODEL    8
 6007    H    GLY 113           H        GLY 113  -5.644  -4.586  -7.338
  Start of MODEL    8
 6008    HA2  GLY 113           HA2      GLY 113  -4.650  -5.860  -9.767
  Start of MODEL    8
 6009    HA3  GLY 113           HA3      GLY 113  -3.561  -4.754  -8.947
  Start of MODEL    8
 6010    H    ALA 114           H        ALA 114  -5.711  -6.510  -6.928
  Start of MODEL    8
 6011    HA   ALA 114           HA       ALA 114  -3.446  -7.692  -5.592
  Start of MODEL    8
 6012    HB2  ALA 114           HB1      ALA 114  -5.053  -8.401  -3.911
  Start of MODEL    8
 6013    HB1  ALA 114           HB2      ALA 114  -6.384  -7.922  -4.962
  Start of MODEL    8
 6014    HB3  ALA 114           HB3      ALA 114  -5.289  -6.701  -4.315
  Start of MODEL    8
 6015    H    LYS 115           H        LYS 115  -2.795  -9.763  -5.653
  Start of MODEL    8
 6016    HA   LYS 115           HA       LYS 115  -3.969 -11.559  -7.562
  Start of MODEL    8
 6017    HB2  LYS 115           HB2      LYS 115  -1.704 -11.924  -5.593
  Start of MODEL    8
 6018    HB3  LYS 115           HB3      LYS 115  -2.230 -13.172  -6.709
  Start of MODEL    8
 6019    HG2  LYS 115           HG2      LYS 115  -0.376 -12.196  -7.741
  Start of MODEL    8
 6020    HG3  LYS 115           HG3      LYS 115  -1.762 -11.482  -8.560
  Start of MODEL    8
 6021    HD2  LYS 115           HD2      LYS 115  -1.561  -9.487  -7.157
  Start of MODEL    8
 6022    HD3  LYS 115           HD3      LYS 115  -0.175 -10.203  -6.336
  Start of MODEL    8
 6023    HE2  LYS 115           HE2      LYS 115  -0.355  -9.495  -9.261
  Start of MODEL    8
 6024    HE3  LYS 115           HE3      LYS 115   0.554  -8.620  -8.031
  Start of MODEL    8
 6025    HZ2  LYS 115           HZ1      LYS 115   1.077 -11.386  -8.981
  Start of MODEL    8
 6026    HZ1  LYS 115           HZ2      LYS 115   1.898 -10.649  -7.700
  Start of MODEL    8
 6027    HZ3  LYS 115           HZ3      LYS 115   2.034 -10.020  -9.273
  Start of MODEL    8
 6028    HA   PRO 116           HA       PRO 116  -6.910 -13.228  -4.712
  Start of MODEL    8
 6029    HB2  PRO 116           HB2      PRO 116  -7.870 -15.211  -6.255
  Start of MODEL    8
 6030    HB3  PRO 116           HB3      PRO 116  -8.196 -13.507  -6.595
  Start of MODEL    8
 6031    HG2  PRO 116           HG2      PRO 116  -6.161 -15.327  -7.832
  Start of MODEL    8
 6032    HG3  PRO 116           HG3      PRO 116  -7.253 -14.176  -8.622
  Start of MODEL    8
 6033    HD2  PRO 116           HD2      PRO 116  -4.647 -13.622  -8.108
  Start of MODEL    8
 6034    HD3  PRO 116           HD3      PRO 116  -5.911 -12.375  -8.131
  Start of MODEL    8
 6035    H    ARG 117           H        ARG 117  -4.435 -13.953  -3.913
  Start of MODEL    8
 6036    HA   ARG 117           HA       ARG 117  -3.263 -15.470  -2.720
  Start of MODEL    8
 6037    HB2  ARG 117           HB2      ARG 117  -5.317 -15.638  -1.435
  Start of MODEL    8
 6038    HB3  ARG 117           HB3      ARG 117  -5.917 -16.882  -2.530
  Start of MODEL    8
 6039    HG2  ARG 117           HG2      ARG 117  -4.348 -18.452  -1.794
  Start of MODEL    8
 6040    HG3  ARG 117           HG3      ARG 117  -3.340 -17.216  -1.040
  Start of MODEL    8
 6041    HD2  ARG 117           HD2      ARG 117  -5.054 -16.813   0.629
  Start of MODEL    8
 6042    HD3  ARG 117           HD3      ARG 117  -6.095 -18.018  -0.130
  Start of MODEL    8
 6043    HE   ARG 117           HE       ARG 117  -3.811 -19.390   0.398
  Start of MODEL    8
 6044   HH11  ARG 117          HH11      ARG 117  -5.995 -17.500   2.406
  Start of MODEL    8
 6045   HH12  ARG 117          HH12      ARG 117  -5.629 -18.389   3.849
  Start of MODEL    8
 6046   HH21  ARG 117          HH21      ARG 117  -3.319 -20.525   2.284
  Start of MODEL    8
 6047   HH22  ARG 117          HH22      ARG 117  -4.092 -20.103   3.786
  Start of MODEL    8
 6048    H    THR 118           H        THR 118  -1.928 -16.100  -4.434
  Start of MODEL    8
 6049    HA   THR 118           HA       THR 118  -2.545 -18.521  -5.876
  Start of MODEL    8
 6050    HB   THR 118           HB       THR 118  -0.104 -18.226  -6.640
  Start of MODEL    8
 6051    HG1  THR 118           HG1      THR 118   0.395 -15.804  -6.272
  Start of MODEL    8
 6052   HG21  THR 118          HG21      THR 118  -2.089 -15.997  -7.164
  Start of MODEL    8
 6053   HG23  THR 118          HG22      THR 118  -2.031 -17.546  -8.007
  Start of MODEL    8
 6054   HG22  THR 118          HG23      THR 118  -0.700 -16.399  -8.179
  Start of MODEL    8
 6055    H    ASN 119           H        ASN 119   0.519 -17.859  -4.236
  Start of MODEL    8
 6056    HA   ASN 119           HA       ASN 119   0.133 -19.230  -1.866
  Start of MODEL    8
 6057    HB2  ASN 119           HB2      ASN 119  -0.123 -21.250  -3.370
  Start of MODEL    8
 6058    HB3  ASN 119           HB3      ASN 119   1.567 -21.038  -3.829
  Start of MODEL    8
 6059   HD21  ASN 119          HD21      ASN 119   2.220 -22.997  -2.935
  Start of MODEL    8
 6060   HD22  ASN 119          HD22      ASN 119   2.276 -23.260  -1.222
  Start of MODEL    8
 6061    H    VAL 120           H        VAL 120   1.609 -18.219  -0.681
  Start of MODEL    8
 6062    HA   VAL 120           HA       VAL 120   4.024 -17.197  -1.843
  Start of MODEL    8
 6063    HB   VAL 120           HB       VAL 120   3.295 -17.287   1.086
  Start of MODEL    8
 6064    H    GLN 121           H        GLN 121   3.716 -19.062   1.138
  Start of MODEL    8
 6065    HA   GLN 121           HA       GLN 121   4.881 -20.775   2.042
  Start of MODEL    8
 6066    HB2  GLN 121           HB2      GLN 121   3.713 -21.888   0.109
  Start of MODEL    8
 6067    HB3  GLN 121           HB3      GLN 121   5.204 -21.712  -0.802
  Start of MODEL    8
 6068    HG2  GLN 121           HG2      GLN 121   6.375 -23.093   0.825
  Start of MODEL    8
 6069    HG3  GLN 121           HG3      GLN 121   4.885 -23.262   1.756
  Start of MODEL    8
 6070   HE21  GLN 121          HE21      GLN 121   3.203 -24.505   0.933
  Start of MODEL    8
 6071   HE22  GLN 121          HE22      GLN 121   3.480 -25.680  -0.314
  Start of MODEL    8
 6072    H5'   DG   1           H5'       DG   1  21.237  -3.727  -5.326
  Start of MODEL    8
 6073    H4'   DG   1           H4'       DG   1  19.247  -4.654  -6.670
  Start of MODEL    8
 6074    H3'   DG   1           H3'       DG   1  18.588  -2.075  -7.224
  Start of MODEL    8
 6075    H2'   DG   1           H2'       DG   1  18.004  -1.362  -5.026
  Start of MODEL    8
 6076    H1'   DG   1           H1'       DG   1  16.822  -4.124  -4.463
  Start of MODEL    8
 6077    H8    DG   1           H8        DG   1  19.486  -1.763  -2.909
  Start of MODEL    8
 6078    H1    DG   1           H1        DG   1  14.835  -3.757   1.042
  Start of MODEL    8
 6079    H22   DG   1           H21       DG   1  13.586  -5.392  -1.760
  Start of MODEL    8
 6080    H21   DG   1           H22       DG   1  13.409  -5.047  -0.052
  Start of MODEL    8
 6081   HO5'   DG   1           H5T       DG   1  19.811  -1.643  -5.159
  Start of MODEL    8
 6082   H5''   DG   1          5H''       DG   1  21.049  -3.294  -7.034
  Start of MODEL    8
 6083   H2''   DG   1          2H''       DG   1  16.451  -2.014  -5.534
  Start of MODEL    8
 6084    H5'   DG   2           H5'       DG   2  13.617  -4.497  -9.112
  Start of MODEL    8
 6085    H4'   DG   2           H4'       DG   2  11.832  -3.197  -9.231
  Start of MODEL    8
 6086    H3'   DG   2           H3'       DG   2  13.084  -1.895 -11.220
  Start of MODEL    8
 6087    H2'   DG   2           H2'       DG   2  14.316  -0.362  -9.788
  Start of MODEL    8
 6088    H1'   DG   2           H1'       DG   2  11.687  -0.074  -8.235
  Start of MODEL    8
 6089    H8    DG   2           H8        DG   2  15.317   0.867  -8.363
  Start of MODEL    8
 6090    H1    DG   2           H1        DG   2  12.582   1.674  -2.606
  Start of MODEL    8
 6091    H22   DG   2           H21       DG   2   9.979  -0.183  -3.984
  Start of MODEL    8
 6092    H21   DG   2           H22       DG   2  10.586   0.693  -2.597
  Start of MODEL    8
 6093   H5''   DG   2          5H''       DG   2  14.383  -3.368 -10.245
  Start of MODEL    8
 6094   H2''   DG   2          2H''       DG   2  12.912   0.589 -10.251
  Start of MODEL    8
 6095    H5'   DT   3           H5'       DT   3   9.905  -3.237  -9.824
  Start of MODEL    8
 6096    H4'   DT   3           H4'       DT   3   7.909  -4.867 -10.135
  Start of MODEL    8
 6097    H3'   DT   3           H3'       DT   3   8.430  -4.854 -12.792
  Start of MODEL    8
 6098    H2'   DT   3           H2'       DT   3   8.037  -2.507 -13.142
  Start of MODEL    8
 6099    H1'   DT   3           H1'       DT   3   5.655  -2.782 -11.226
  Start of MODEL    8
 6100    H3    DT   3           H3        DT   3   5.234   1.569 -12.981
  Start of MODEL    8
 6101    H71   DT   3           H71       DT   3   8.079   2.944  -9.657
  Start of MODEL    8
 6102    H73   DT   3           H72       DT   3   9.133   1.525  -9.441
  Start of MODEL    8
 6103    H72   DT   3           H73       DT   3   7.672   1.708  -8.443
  Start of MODEL    8
 6104    H6    DT   3           H6        DT   3   7.918  -0.762  -9.808
  Start of MODEL    8
 6105   H5''   DT   3          5H''       DT   3  10.133  -4.850 -10.520
  Start of MODEL    8
 6106   H2''   DT   3          2H''       DT   3   6.449  -3.178 -13.502
  Start of MODEL    8
 6107    H5'   DG   4           H5'       DG   4   4.047  -7.142  -9.850
  Start of MODEL    8
 6108    H4'   DG   4           H4'       DG   4   5.515  -5.942  -8.027
  Start of MODEL    8
 6109    H3'   DG   4           H3'       DG   4   2.670  -5.943  -8.515
  Start of MODEL    8
 6110    H2'   DG   4           H2'       DG   4   2.353  -3.639  -8.417
  Start of MODEL    8
 6111    H1'   DG   4           H1'       DG   4   5.124  -3.218  -7.230
  Start of MODEL    8
 6112    H8    DG   4           H8        DG   4   5.641  -0.756  -7.445
  Start of MODEL    8
 6113    H1    DG   4           H1        DG   4   1.617  -0.057 -12.405
  Start of MODEL    8
 6114    H22   DG   4           H21       DG   4   1.150  -3.485 -12.092
  Start of MODEL    8
 6115    H21   DG   4           H22       DG   4   0.750  -2.017 -12.955
  Start of MODEL    8
 6116   H5''   DG   4          5H''       DG   4   4.493  -5.718 -10.814
  Start of MODEL    8
 6117   H2''   DG   4          2H''       DG   4   2.872  -3.745  -6.740
  Start of MODEL    8
 6118    H5'   DT   5           H5'       DT   5   3.177  -9.129  -4.326
  Start of MODEL    8
 6119    H4'   DT   5           H4'       DT   5   2.731  -7.924  -2.539
  Start of MODEL    8
 6120    H3'   DT   5           H3'       DT   5   0.650  -9.628  -2.498
  Start of MODEL    8
 6121    H2'   DT   5           H2'       DT   5  -0.908  -8.280  -3.736
  Start of MODEL    8
 6122    H1'   DT   5           H1'       DT   5   0.068  -5.851  -2.163
  Start of MODEL    8
 6123    H3    DT   5           H3        DT   5  -3.451  -4.058  -4.552
  Start of MODEL    8
 6124    H71   DT   5           H71       DT   5  -0.868  -4.407  -8.396
  Start of MODEL    8
 6125    H72   DT   5           H72       DT   5   0.379  -3.418  -7.604
  Start of MODEL    8
 6126    H73   DT   5           H73       DT   5   0.644  -5.163  -7.837
  Start of MODEL    8
 6127    H6    DT   5           H6        DT   5   0.864  -5.809  -5.544
  Start of MODEL    8
 6128   H5''   DT   5          5H''       DT   5   1.456  -9.500  -4.566
  Start of MODEL    8
 6129   H2''   DT   5          2H''       DT   5  -1.307  -7.827  -2.082
  Start of MODEL    8
 6130    H5'   DG   6           H5'       DG   6   2.893  -7.309   1.794
  Start of MODEL    8
 6131    H4'   DG   6           H4'       DG   6   3.344  -8.142   4.156
  Start of MODEL    8
 6132    H3'   DG   6           H3'       DG   6   1.786 -10.312   3.622
  Start of MODEL    8
 6133    H2'   DG   6           H2'       DG   6  -0.314  -9.209   3.436
  Start of MODEL    8
 6134    H1'   DG   6           H1'       DG   6   0.494  -7.272   5.657
  Start of MODEL    8
 6135    H8    DG   6           H8        DG   6  -1.051  -7.586   2.129
  Start of MODEL    8
 6136    H1    DG   6           H1        DG   6  -3.566  -3.029   5.890
  Start of MODEL    8
 6137    H22   DG   6           H21       DG   6  -1.095  -3.971   8.137
  Start of MODEL    8
 6138    H21   DG   6           H22       DG   6  -2.448  -2.920   7.792
  Start of MODEL    8
 6139   H5''   DG   6          5H''       DG   6   3.521  -8.954   2.012
  Start of MODEL    8
 6140   H2''   DG   6          2H''       DG   6  -0.292  -9.492   5.169
  Start of MODEL    8
 6141    H5'   DC   7           H5'       DC   7   4.266 -11.310   4.748
  Start of MODEL    8
 6142    H4'   DC   7           H4'       DC   7   5.450 -13.133   5.123
  Start of MODEL    8
 6143    H3'   DC   7           H3'       DC   7   4.691 -13.911   2.673
  Start of MODEL    8
 6144   HO3'   DC   7           H3T       DC   7   6.016 -15.723   3.056
  Start of MODEL    8
 6145    H2'   DC   7           H2'       DC   7   2.622 -14.958   3.250
  Start of MODEL    8
 6146    H1'   DC   7           H1'       DC   7   3.928 -16.191   5.714
  Start of MODEL    8
 6147    H42   DC   7           H41       DC   7  -2.598 -15.668   6.800
  Start of MODEL    8
 6148    H41   DC   7           H42       DC   7  -2.148 -17.320   7.161
  Start of MODEL    8
 6149    H5    DC   7           H5        DC   7  -1.023 -14.034   5.941
  Start of MODEL    8
 6150    H6    DC   7           H6        DC   7   1.278 -13.672   5.228
  Start of MODEL    8
 6151   H5''   DC   7          5H''       DC   7   3.617 -12.131   3.316
  Start of MODEL    8
 6152   H2''   DC   7          2H''       DC   7   3.712 -16.336   3.333
  Start of MODEL    9
 6153    H1   GLY  25           HT1      GLY  25 -10.993 -10.534  -8.697
  Start of MODEL    9
 6154    H2   GLY  25           HT2      GLY  25 -10.346 -10.293 -10.244
  Start of MODEL    9
 6155    H3   GLY  25           HT3      GLY  25  -9.361 -10.100  -8.875
  Start of MODEL    9
 6156    HA3  GLY  25           HA2      GLY  25  -8.942 -12.210 -10.034
  Start of MODEL    9
 6157    HA2  GLY  25           HA3      GLY  25 -10.612 -12.657  -9.719
  Start of MODEL    9
 6158    H    ALA  26           H        ALA  26 -10.236 -11.122  -7.042
  Start of MODEL    9
 6159    HA   ALA  26           HA       ALA  26  -8.962 -13.362  -5.641
  Start of MODEL    9
 6160    HB2  ALA  26           HB1      ALA  26  -7.825 -11.838  -4.138
  Start of MODEL    9
 6161    HB1  ALA  26           HB2      ALA  26  -8.500 -10.454  -4.997
  Start of MODEL    9
 6162    HB3  ALA  26           HB3      ALA  26  -7.352 -11.521  -5.807
  Start of MODEL    9
 6163    H    MET  27           H        MET  27  -9.489 -13.322  -3.262
  Start of MODEL    9
 6164    HA   MET  27           HA       MET  27 -12.033 -12.033  -2.652
  Start of MODEL    9
 6165    HB2  MET  27           HB2      MET  27 -12.649 -14.227  -3.557
  Start of MODEL    9
 6166    HB3  MET  27           HB3      MET  27 -11.580 -15.013  -2.404
  Start of MODEL    9
 6167    HG2  MET  27           HG2      MET  27 -12.941 -14.232  -0.561
  Start of MODEL    9
 6168    HG3  MET  27           HG3      MET  27 -13.987 -13.361  -1.678
  Start of MODEL    9
 6169    HE3  MET  27           HE1      MET  27 -15.012 -15.428   0.528
  Start of MODEL    9
 6170    HE2  MET  27           HE2      MET  27 -16.243 -16.303  -0.386
  Start of MODEL    9
 6171    HE1  MET  27           HE3      MET  27 -16.089 -14.554  -0.558
  Start of MODEL    9
 6172    H    GLY  28           H        GLY  28 -12.309 -11.557  -0.515
  Start of MODEL    9
 6173    HA2  GLY  28           HA2      GLY  28 -10.882 -12.790   1.603
  Start of MODEL    9
 6174    HA3  GLY  28           HA3      GLY  28 -10.134 -11.257   1.162
  Start of MODEL    9
 6175    H    SER  29           H        SER  29 -10.698  -9.938   2.814
  Start of MODEL    9
 6176    HA   SER  29           HA       SER  29 -13.307  -9.874   3.952
  Start of MODEL    9
 6177    HB2  SER  29           HB2      SER  29 -11.129  -7.764   4.023
  Start of MODEL    9
 6178    HB3  SER  29           HB3      SER  29 -12.543  -7.836   5.078
  Start of MODEL    9
 6179    HG   SER  29           HG       SER  29 -11.599 -10.107   5.495
  Start of MODEL    9
 6180    H    ARG  30           H        ARG  30 -15.087  -8.795   3.290
  Start of MODEL    9
 6181    HA   ARG  30           HA       ARG  30 -15.070  -7.671   0.645
  Start of MODEL    9
 6182    HB2  ARG  30           HB2      ARG  30 -17.315  -7.604   2.663
  Start of MODEL    9
 6183    HB3  ARG  30           HB3      ARG  30 -17.461  -7.326   0.938
  Start of MODEL    9
 6184    HG2  ARG  30           HG2      ARG  30 -18.198  -9.463   1.052
  Start of MODEL    9
 6185    HG3  ARG  30           HG3      ARG  30 -16.472  -9.769   0.826
  Start of MODEL    9
 6186    HD2  ARG  30           HD2      ARG  30 -16.187 -10.017   3.229
  Start of MODEL    9
 6187    HD3  ARG  30           HD3      ARG  30 -17.896  -9.656   3.481
  Start of MODEL    9
 6188    HE   ARG  30           HE       ARG  30 -17.636 -11.815   1.685
  Start of MODEL    9
 6189   HH11  ARG  30          HH11      ARG  30 -17.368 -11.082   5.117
  Start of MODEL    9
 6190   HH12  ARG  30          HH12      ARG  30 -17.626 -12.730   5.599
  Start of MODEL    9
 6191   HH21  ARG  30          HH21      ARG  30 -18.010 -13.943   2.326
  Start of MODEL    9
 6192   HH22  ARG  30          HH22      ARG  30 -17.986 -14.371   4.012
  Start of MODEL    9
 6193    H    ASP  31           H        ASP  31 -15.175  -6.463   3.893
  Start of MODEL    9
 6194    HA   ASP  31           HA       ASP  31 -16.185  -3.887   3.242
  Start of MODEL    9
 6195    HB2  ASP  31           HB2      ASP  31 -16.407  -5.144   5.443
  Start of MODEL    9
 6196    HB3  ASP  31           HB3      ASP  31 -14.738  -4.679   5.769
  Start of MODEL    9
 6197    H    THR  32           H        THR  32 -13.120  -5.254   2.882
  Start of MODEL    9
 6198    HA   THR  32           HA       THR  32 -11.756  -2.674   3.131
  Start of MODEL    9
 6199    HB   THR  32           HB       THR  32  -9.673  -4.121   2.728
  Start of MODEL    9
 6200    HG1  THR  32           HG1      THR  32 -10.014  -6.341   3.295
  Start of MODEL    9
 6201   HG21  THR  32          HG21      THR  32 -11.353  -4.468   5.217
  Start of MODEL    9
 6202   HG23  THR  32          HG22      THR  32 -10.178  -3.190   4.904
  Start of MODEL    9
 6203   HG22  THR  32          HG23      THR  32  -9.635  -4.855   5.102
  Start of MODEL    9
 6204    H    MET  33           H        MET  33 -13.333  -4.395   0.799
  Start of MODEL    9
 6205    HA   MET  33           HA       MET  33 -11.717  -4.587  -1.392
  Start of MODEL    9
 6206    HB2  MET  33           HB2      MET  33 -14.147  -5.230  -1.163
  Start of MODEL    9
 6207    HB3  MET  33           HB3      MET  33 -14.549  -3.563  -1.508
  Start of MODEL    9
 6208    HG2  MET  33           HG2      MET  33 -13.474  -3.740  -3.681
  Start of MODEL    9
 6209    HG3  MET  33           HG3      MET  33 -13.049  -5.419  -3.342
  Start of MODEL    9
 6210    HE1  MET  33           HE1      MET  33 -14.186  -6.243  -5.573
  Start of MODEL    9
 6211    HE3  MET  33           HE2      MET  33 -14.569  -4.567  -5.970
  Start of MODEL    9
 6212    HE2  MET  33           HE3      MET  33 -15.822  -5.805  -6.060
  Start of MODEL    9
 6213    H    PHE  34           H        PHE  34 -13.603  -1.693  -0.470
  Start of MODEL    9
 6214    HA   PHE  34           HA       PHE  34 -12.182  -0.217  -2.575
  Start of MODEL    9
 6215    HB2  PHE  34           HB2      PHE  34 -14.734   0.375  -1.076
  Start of MODEL    9
 6216    HB3  PHE  34           HB3      PHE  34 -13.965   1.519  -2.169
  Start of MODEL    9
 6217    HD1  PHE  34           HD1      PHE  34 -15.942  -1.515  -1.890
  Start of MODEL    9
 6218    HD2  PHE  34           HD2      PHE  34 -13.893   1.083  -4.565
  Start of MODEL    9
 6219    HE1  PHE  34           HE1      PHE  34 -17.137  -2.528  -3.786
  Start of MODEL    9
 6220    HE2  PHE  34           HE2      PHE  34 -15.082   0.076  -6.465
  Start of MODEL    9
 6221    HZ   PHE  34           HZ       PHE  34 -16.709  -1.735  -6.079
  Start of MODEL    9
 6222    H    THR  35           H        THR  35 -11.675  -0.832   0.560
  Start of MODEL    9
 6223    HA   THR  35           HA       THR  35 -10.969   1.945   1.227
  Start of MODEL    9
 6224    HB   THR  35           HB       THR  35 -10.975   1.068   3.627
  Start of MODEL    9
 6225    HG1  THR  35           HG1      THR  35 -12.748  -0.820   3.412
  Start of MODEL    9
 6226   HG23  THR  35          HG21      THR  35 -12.740   2.513   2.738
  Start of MODEL    9
 6227   HG22  THR  35          HG22      THR  35 -13.411   1.301   3.831
  Start of MODEL    9
 6228   HG21  THR  35          HG23      THR  35 -13.573   1.103   2.084
  Start of MODEL    9
 6229    H    LYS  36           H        LYS  36  -9.654  -1.112   0.493
  Start of MODEL    9
 6230    HA   LYS  36           HA       LYS  36  -7.244  -0.745   2.057
  Start of MODEL    9
 6231    HB2  LYS  36           HB2      LYS  36  -8.268  -2.966   1.813
  Start of MODEL    9
 6232    HB3  LYS  36           HB3      LYS  36  -8.106  -2.864   0.072
  Start of MODEL    9
 6233    HG2  LYS  36           HG2      LYS  36  -5.665  -2.875   0.315
  Start of MODEL    9
 6234    HG3  LYS  36           HG3      LYS  36  -5.855  -3.014   2.066
  Start of MODEL    9
 6235    HD2  LYS  36           HD2      LYS  36  -7.179  -5.101   1.677
  Start of MODEL    9
 6236    HD3  LYS  36           HD3      LYS  36  -6.766  -4.984  -0.031
  Start of MODEL    9
 6237    HE2  LYS  36           HE2      LYS  36  -4.737  -5.137   2.180
  Start of MODEL    9
 6238    HE3  LYS  36           HE3      LYS  36  -5.333  -6.546   1.313
  Start of MODEL    9
 6239    HZ3  LYS  36           HZ1      LYS  36  -4.485  -5.535  -0.738
  Start of MODEL    9
 6240    HZ2  LYS  36           HZ2      LYS  36  -3.262  -5.815   0.396
  Start of MODEL    9
 6241    HZ1  LYS  36           HZ3      LYS  36  -3.851  -4.250   0.162
  Start of MODEL    9
 6242    H    ILE  37           H        ILE  37  -5.748   0.595   1.316
  Start of MODEL    9
 6243    HA   ILE  37           HA       ILE  37  -5.464   1.068  -1.561
  Start of MODEL    9
 6244    HB   ILE  37           HB       ILE  37  -4.474   2.570   0.864
  Start of MODEL    9
 6245   HD13  ILE  37          HD11      ILE  37  -5.601   4.887   1.116
  Start of MODEL    9
 6246   HD12  ILE  37          HD12      ILE  37  -6.885   5.319  -0.009
  Start of MODEL    9
 6247   HD11  ILE  37          HD13      ILE  37  -5.209   5.302  -0.553
  Start of MODEL    9
 6248    H    PHE  38           H        PHE  38  -3.696   0.419  -2.670
  Start of MODEL    9
 6249    HA   PHE  38           HA       PHE  38  -1.456  -0.744  -1.165
  Start of MODEL    9
 6250    HB2  PHE  38           HB2      PHE  38  -2.253  -2.281  -2.809
  Start of MODEL    9
 6251    HB3  PHE  38           HB3      PHE  38  -2.340  -1.030  -4.038
  Start of MODEL    9
 6252    HD1  PHE  38           HD1      PHE  38  -0.532  -0.625  -5.466
  Start of MODEL    9
 6253    HD2  PHE  38           HD2      PHE  38   0.038  -2.978  -1.970
  Start of MODEL    9
 6254    HE1  PHE  38           HE1      PHE  38   1.727  -1.224  -6.241
  Start of MODEL    9
 6255    HE2  PHE  38           HE2      PHE  38   2.293  -3.579  -2.734
  Start of MODEL    9
 6256    HZ   PHE  38           HZ       PHE  38   3.144  -2.702  -4.871
  Start of MODEL    9
 6257    H    VAL  39           H        VAL  39   0.366   0.388  -0.954
  Start of MODEL    9
 6258    HA   VAL  39           HA       VAL  39   0.776   2.694  -2.733
  Start of MODEL    9
 6259    HB   VAL  39           HB       VAL  39   2.122   2.278  -0.067
  Start of MODEL    9
 6260    H    GLY  40           H        GLY  40   2.516   2.717  -3.993
  Start of MODEL    9
 6261    HA2  GLY  40           HA2      GLY  40   4.442   0.491  -3.701
  Start of MODEL    9
 6262    HA3  GLY  40           HA3      GLY  40   3.677   0.822  -5.248
  Start of MODEL    9
 6263    H    GLY  41           H        GLY  41   6.487   0.790  -4.773
  Start of MODEL    9
 6264    HA2  GLY  41           HA2      GLY  41   8.259   1.996  -5.640
  Start of MODEL    9
 6265    HA3  GLY  41           HA3      GLY  41   7.125   3.270  -6.059
  Start of MODEL    9
 6266    H    LEU  42           H        LEU  42   7.182   2.174  -2.809
  Start of MODEL    9
 6267    HA   LEU  42           HA       LEU  42   7.884   4.771  -1.844
  Start of MODEL    9
 6268    HB2  LEU  42           HB2      LEU  42   7.342   2.140  -0.490
  Start of MODEL    9
 6269    HB3  LEU  42           HB3      LEU  42   7.749   3.590   0.399
  Start of MODEL    9
 6270    HG   LEU  42           HG       LEU  42   5.338   3.250  -1.379
  Start of MODEL    9
 6271   HD13  LEU  42          HD11      LEU  42   5.207   1.909   0.658
  Start of MODEL    9
 6272   HD12  LEU  42          HD12      LEU  42   4.077   3.263   0.707
  Start of MODEL    9
 6273   HD11  LEU  42          HD13      LEU  42   5.582   3.340   1.624
  Start of MODEL    9
 6274   HD21  LEU  42          HD21      LEU  42   6.134   5.555  -1.318
  Start of MODEL    9
 6275   HD23  LEU  42          HD22      LEU  42   6.151   5.510   0.447
  Start of MODEL    9
 6276   HD22  LEU  42          HD23      LEU  42   4.623   5.383  -0.426
  Start of MODEL    9
 6277    HA   PRO  43           HA       PRO  43  12.304   4.151  -1.470
  Start of MODEL    9
 6278    HB2  PRO  43           HB2      PRO  43  12.570   6.032   0.577
  Start of MODEL    9
 6279    HB3  PRO  43           HB3      PRO  43  12.727   6.355  -1.151
  Start of MODEL    9
 6280    HG2  PRO  43           HG2      PRO  43  10.436   6.840   0.665
  Start of MODEL    9
 6281    HG3  PRO  43           HG3      PRO  43  10.954   7.754  -0.758
  Start of MODEL    9
 6282    HD2  PRO  43           HD2      PRO  43   8.810   6.101  -0.775
  Start of MODEL    9
 6283    HD3  PRO  43           HD3      PRO  43   9.819   6.381  -2.210
  Start of MODEL    9
 6284    H    TYR  44           H        TYR  44  13.540   2.934  -0.084
  Start of MODEL    9
 6285    HA   TYR  44           HA       TYR  44  12.065   1.162   1.493
  Start of MODEL    9
 6286    HB2  TYR  44           HB2      TYR  44  15.047   1.564   1.306
  Start of MODEL    9
 6287    HB3  TYR  44           HB3      TYR  44  14.283   0.210   2.127
  Start of MODEL    9
 6288    HD1  TYR  44           HD1      TYR  44  12.279  -0.809   0.464
  Start of MODEL    9
 6289    HD2  TYR  44           HD2      TYR  44  15.956   0.968  -0.723
  Start of MODEL    9
 6290    HE1  TYR  44           HE1      TYR  44  12.183  -2.039  -1.660
  Start of MODEL    9
 6291    HE2  TYR  44           HE2      TYR  44  15.875  -0.260  -2.856
  Start of MODEL    9
 6292    HH   TYR  44           HH       TYR  44  14.825  -2.292  -3.775
  Start of MODEL    9
 6293    H    HIS  45           H        HIS  45  13.820   4.046   2.434
  Start of MODEL    9
 6294    HA   HIS  45           HA       HIS  45  13.761   3.336   5.220
  Start of MODEL    9
 6295    HB2  HIS  45           HB2      HIS  45  14.970   5.285   5.692
  Start of MODEL    9
 6296    HB3  HIS  45           HB3      HIS  45  15.580   4.731   4.142
  Start of MODEL    9
 6297    HD1  HIS  45           HD1      HIS  45  13.922   7.586   5.811
  Start of MODEL    9
 6298    HD2  HIS  45           HD2      HIS  45  14.857   6.407   1.932
  Start of MODEL    9
 6299    HE1  HIS  45           HE1      HIS  45  13.743   9.661   4.410
  Start of MODEL    9
 6300    HE2  HIS  45           HE2      HIS  45  14.086   8.872   2.039
  Start of MODEL    9
 6301    H    THR  46           H        THR  46  11.323   4.596   3.243
  Start of MODEL    9
 6302    HA   THR  46           HA       THR  46   9.999   6.356   4.925
  Start of MODEL    9
 6303    HB   THR  46           HB       THR  46   8.743   4.233   3.165
  Start of MODEL    9
 6304    HG1  THR  46           HG1      THR  46  10.077   6.646   2.625
  Start of MODEL    9
 6305   HG22  THR  46          HG21      THR  46   6.875   5.792   2.981
  Start of MODEL    9
 6306   HG21  THR  46          HG22      THR  46   7.698   6.931   4.047
  Start of MODEL    9
 6307   HG23  THR  46          HG23      THR  46   7.157   5.373   4.674
  Start of MODEL    9
 6308    H    SER  47           H        SER  47   8.595   6.130   6.676
  Start of MODEL    9
 6309    HA   SER  47           HA       SER  47   8.465   3.444   7.855
  Start of MODEL    9
 6310    HB2  SER  47           HB2      SER  47   8.194   4.629  10.026
  Start of MODEL    9
 6311    HB3  SER  47           HB3      SER  47   9.722   5.013   9.228
  Start of MODEL    9
 6312    HG   SER  47           HG       SER  47   9.135   7.019   9.285
  Start of MODEL    9
 6313    H    ASP  48           H        ASP  48   6.535   2.967   9.114
  Start of MODEL    9
 6314    HA   ASP  48           HA       ASP  48   4.129   3.249   7.840
  Start of MODEL    9
 6315    HB2  ASP  48           HB2      ASP  48   4.273   3.102  10.845
  Start of MODEL    9
 6316    HB3  ASP  48           HB3      ASP  48   3.059   2.406   9.784
  Start of MODEL    9
 6317    H    LYS  49           H        LYS  49   5.580   5.357  10.227
  Start of MODEL    9
 6318    HA   LYS  49           HA       LYS  49   3.334   6.926  10.832
  Start of MODEL    9
 6319    HB2  LYS  49           HB2      LYS  49   5.473   6.930  12.126
  Start of MODEL    9
 6320    HB3  LYS  49           HB3      LYS  49   6.215   7.831  10.809
  Start of MODEL    9
 6321    HG2  LYS  49           HG2      LYS  49   4.483   9.603  11.158
  Start of MODEL    9
 6322    HG3  LYS  49           HG3      LYS  49   3.971   8.723  12.599
  Start of MODEL    9
 6323    HD2  LYS  49           HD2      LYS  49   6.717   9.860  12.089
  Start of MODEL    9
 6324    HD3  LYS  49           HD3      LYS  49   5.498  10.528  13.177
  Start of MODEL    9
 6325    HE2  LYS  49           HE2      LYS  49   5.581   8.468  14.504
  Start of MODEL    9
 6326    HE3  LYS  49           HE3      LYS  49   6.831   7.838  13.428
  Start of MODEL    9
 6327    HZ2  LYS  49           HZ1      LYS  49   7.020  10.202  15.211
  Start of MODEL    9
 6328    HZ1  LYS  49           HZ2      LYS  49   8.184   9.811  14.039
  Start of MODEL    9
 6329    HZ3  LYS  49           HZ3      LYS  49   7.893   8.750  15.328
  Start of MODEL    9
 6330    H    THR  50           H        THR  50   5.828   7.278   8.323
  Start of MODEL    9
 6331    HA   THR  50           HA       THR  50   4.924   9.775   7.370
  Start of MODEL    9
 6332    HB   THR  50           HB       THR  50   6.370   7.633   5.786
  Start of MODEL    9
 6333    HG1  THR  50           HG1      THR  50   7.858   9.695   6.857
  Start of MODEL    9
 6334   HG21  THR  50          HG21      THR  50   6.247  10.634   5.453
  Start of MODEL    9
 6335   HG23  THR  50          HG22      THR  50   5.524   9.433   4.378
  Start of MODEL    9
 6336   HG22  THR  50          HG23      THR  50   7.281   9.549   4.517
  Start of MODEL    9
 6337    H    LEU  51           H        LEU  51   4.065   6.447   6.539
  Start of MODEL    9
 6338    HA   LEU  51           HA       LEU  51   2.397   7.195   4.329
  Start of MODEL    9
 6339    HB2  LEU  51           HB2      LEU  51   2.446   4.709   6.036
  Start of MODEL    9
 6340    HB3  LEU  51           HB3      LEU  51   1.343   4.924   4.692
  Start of MODEL    9
 6341    HG   LEU  51           HG       LEU  51   4.347   4.742   4.569
  Start of MODEL    9
 6342   HD11  LEU  51          HD11      LEU  51   2.140   3.002   3.475
  Start of MODEL    9
 6343   HD13  LEU  51          HD12      LEU  51   3.227   2.609   4.806
  Start of MODEL    9
 6344   HD12  LEU  51          HD13      LEU  51   3.862   2.772   3.170
  Start of MODEL    9
 6345   HD23  LEU  51          HD21      LEU  51   2.397   5.301   2.335
  Start of MODEL    9
 6346   HD22  LEU  51          HD22      LEU  51   4.129   5.015   2.155
  Start of MODEL    9
 6347   HD21  LEU  51          HD23      LEU  51   3.556   6.450   3.006
  Start of MODEL    9
 6348    H    HIS  52           H        HIS  52   1.760   6.345   7.690
  Start of MODEL    9
 6349    HA   HIS  52           HA       HIS  52  -0.955   6.799   7.794
  Start of MODEL    9
 6350    HB2  HIS  52           HB2      HIS  52   0.572   5.943   9.633
  Start of MODEL    9
 6351    HB3  HIS  52           HB3      HIS  52   0.956   7.624   9.982
  Start of MODEL    9
 6352    HD1  HIS  52           HD1      HIS  52  -1.172   9.139  10.740
  Start of MODEL    9
 6353    HD2  HIS  52           HD2      HIS  52  -1.694   5.007  10.814
  Start of MODEL    9
 6354    HE1  HIS  52           HE1      HIS  52  -3.187   8.732  12.177
  Start of MODEL    9
 6355    HE2  HIS  52           HE2      HIS  52  -3.589   6.247  12.069
  Start of MODEL    9
 6356    H    GLU  53           H        GLU  53   1.576   9.247   8.557
  Start of MODEL    9
 6357    HA   GLU  53           HA       GLU  53  -0.200  11.296   9.052
  Start of MODEL    9
 6358    HB2  GLU  53           HB2      GLU  53   1.651  12.648   9.320
  Start of MODEL    9
 6359    HB3  GLU  53           HB3      GLU  53   2.326  11.039   9.547
  Start of MODEL    9
 6360    HG2  GLU  53           HG2      GLU  53   3.731  11.320   7.931
  Start of MODEL    9
 6361    HG3  GLU  53           HG3      GLU  53   2.448  11.728   6.805
  Start of MODEL    9
 6362    H    TYR  54           H        TYR  54   1.349  10.389   6.037
  Start of MODEL    9
 6363    HA   TYR  54           HA       TYR  54   0.609  12.750   4.630
  Start of MODEL    9
 6364    HB2  TYR  54           HB2      TYR  54   2.467  11.056   4.066
  Start of MODEL    9
 6365    HB3  TYR  54           HB3      TYR  54   1.190  10.091   3.336
  Start of MODEL    9
 6366    HD1  TYR  54           HD1      TYR  54   0.263  10.665   1.231
  Start of MODEL    9
 6367    HD2  TYR  54           HD2      TYR  54   3.039  13.273   3.120
  Start of MODEL    9
 6368    HE1  TYR  54           HE1      TYR  54   0.457  11.951  -0.852
  Start of MODEL    9
 6369    HE2  TYR  54           HE2      TYR  54   3.248  14.570   1.042
  Start of MODEL    9
 6370    HH   TYR  54           HH       TYR  54   1.084  14.233  -1.539
  Start of MODEL    9
 6371    H    PHE  55           H        PHE  55  -0.658   9.425   4.496
  Start of MODEL    9
 6372    HA   PHE  55           HA       PHE  55  -2.793  10.116   2.784
  Start of MODEL    9
 6373    HB2  PHE  55           HB2      PHE  55  -2.159   7.684   4.412
  Start of MODEL    9
 6374    HB3  PHE  55           HB3      PHE  55  -3.668   7.812   3.515
  Start of MODEL    9
 6375    HD1  PHE  55           HD1      PHE  55  -0.067   7.379   3.296
  Start of MODEL    9
 6376    HD2  PHE  55           HD2      PHE  55  -3.664   7.880   1.081
  Start of MODEL    9
 6377    HE1  PHE  55           HE1      PHE  55   1.082   6.596   1.263
  Start of MODEL    9
 6378    HE2  PHE  55           HE2      PHE  55  -2.529   7.100  -0.952
  Start of MODEL    9
 6379    HZ   PHE  55           HZ       PHE  55  -0.150   6.458  -0.864
  Start of MODEL    9
 6380    H    GLU  56           H        GLU  56  -2.506  10.209   6.264
  Start of MODEL    9
 6381    HA   GLU  56           HA       GLU  56  -5.285   9.925   6.779
  Start of MODEL    9
 6382    HB2  GLU  56           HB2      GLU  56  -4.857  10.510   9.028
  Start of MODEL    9
 6383    HB3  GLU  56           HB3      GLU  56  -3.463   9.585   8.492
  Start of MODEL    9
 6384    HG2  GLU  56           HG2      GLU  56  -2.149  11.583   8.284
  Start of MODEL    9
 6385    HG3  GLU  56           HG3      GLU  56  -3.561  12.591   8.611
  Start of MODEL    9
 6386    H    GLN  57           H        GLN  57  -3.414  12.514   5.576
  Start of MODEL    9
 6387    HA   GLN  57           HA       GLN  57  -4.981  14.701   6.451
  Start of MODEL    9
 6388    HB2  GLN  57           HB2      GLN  57  -3.457  14.466   3.855
  Start of MODEL    9
 6389    HB3  GLN  57           HB3      GLN  57  -3.981  15.955   4.628
  Start of MODEL    9
 6390    HG2  GLN  57           HG2      GLN  57  -2.494  15.374   6.553
  Start of MODEL    9
 6391    HG3  GLN  57           HG3      GLN  57  -1.873  14.035   5.586
  Start of MODEL    9
 6392   HE21  GLN  57          HE21      GLN  57  -0.362  16.232   6.586
  Start of MODEL    9
 6393   HE22  GLN  57          HE22      GLN  57   0.269  17.087   5.220
  Start of MODEL    9
 6394    H    PHE  58           H        PHE  58  -5.758  12.160   4.398
  Start of MODEL    9
 6395    HA   PHE  58           HA       PHE  58  -7.631  13.685   2.772
  Start of MODEL    9
 6396    HB2  PHE  58           HB2      PHE  58  -6.912  10.748   2.806
  Start of MODEL    9
 6397    HB3  PHE  58           HB3      PHE  58  -8.093  11.459   1.715
  Start of MODEL    9
 6398    HD1  PHE  58           HD1      PHE  58  -4.522  11.695   2.720
  Start of MODEL    9
 6399    HD2  PHE  58           HD2      PHE  58  -7.422  12.305  -0.329
  Start of MODEL    9
 6400    HE1  PHE  58           HE1      PHE  58  -2.723  12.218   1.126
  Start of MODEL    9
 6401    HE2  PHE  58           HE2      PHE  58  -5.629  12.841  -1.934
  Start of MODEL    9
 6402    HZ   PHE  58           HZ       PHE  58  -3.275  12.788  -1.203
  Start of MODEL    9
 6403    H    GLY  59           H        GLY  59  -7.589  11.854   5.672
  Start of MODEL    9
 6404    HA2  GLY  59           HA2      GLY  59 -10.093  12.531   6.538
  Start of MODEL    9
 6405    HA3  GLY  59           HA3      GLY  59 -10.347  11.066   5.606
  Start of MODEL    9
 6406    H    ASP  60           H        ASP  60 -10.172   9.198   6.633
  Start of MODEL    9
 6407    HA   ASP  60           HA       ASP  60  -8.738   9.154   9.208
  Start of MODEL    9
 6408    HB2  ASP  60           HB2      ASP  60 -11.437   8.002   8.528
  Start of MODEL    9
 6409    HB3  ASP  60           HB3      ASP  60 -10.496   7.429   9.899
  Start of MODEL    9
 6410    H    ILE  61           H        ILE  61  -7.145   7.710   9.239
  Start of MODEL    9
 6411    HA   ILE  61           HA       ILE  61  -7.241   5.443   7.430
  Start of MODEL    9
 6412    HB   ILE  61           HB       ILE  61  -5.064   6.716   9.039
  Start of MODEL    9
 6413   HD11  ILE  61          HD11      ILE  61  -2.917   6.190   6.959
  Start of MODEL    9
 6414   HD13  ILE  61          HD12      ILE  61  -3.366   7.797   7.539
  Start of MODEL    9
 6415   HD12  ILE  61          HD13      ILE  61  -3.398   7.439   5.813
  Start of MODEL    9
 6416    H    GLU  62           H        GLU  62  -7.579   3.464   8.012
  Start of MODEL    9
 6417    HA   GLU  62           HA       GLU  62  -8.347   2.820  10.720
  Start of MODEL    9
 6418    HB2  GLU  62           HB2      GLU  62  -9.420   2.034   8.519
  Start of MODEL    9
 6419    HB3  GLU  62           HB3      GLU  62  -8.048   0.948   8.372
  Start of MODEL    9
 6420    HG2  GLU  62           HG2      GLU  62  -9.902  -0.235   9.267
  Start of MODEL    9
 6421    HG3  GLU  62           HG3      GLU  62  -8.680  -0.074  10.525
  Start of MODEL    9
 6422    H    GLU  63           H        GLU  63  -5.796   1.996   8.418
  Start of MODEL    9
 6423    HA   GLU  63           HA       GLU  63  -3.898   1.444  10.518
  Start of MODEL    9
 6424    HB2  GLU  63           HB2      GLU  63  -5.311  -0.685  10.181
  Start of MODEL    9
 6425    HB3  GLU  63           HB3      GLU  63  -4.495  -0.832   8.632
  Start of MODEL    9
 6426    HG2  GLU  63           HG2      GLU  63  -2.366  -1.032   9.710
  Start of MODEL    9
 6427    HG3  GLU  63           HG3      GLU  63  -3.089  -0.704  11.286
  Start of MODEL    9
 6428    H    ALA  64           H        ALA  64  -1.783   1.815   9.764
  Start of MODEL    9
 6429    HA   ALA  64           HA       ALA  64  -1.393   1.894   6.862
  Start of MODEL    9
 6430    HB2  ALA  64           HB1      ALA  64  -0.294   4.052   6.957
  Start of MODEL    9
 6431    HB1  ALA  64           HB2      ALA  64  -0.612   4.162   8.686
  Start of MODEL    9
 6432    HB3  ALA  64           HB3      ALA  64  -1.950   4.186   7.542
  Start of MODEL    9
 6433    H    VAL  65           H        VAL  65   0.296   0.652   6.424
  Start of MODEL    9
 6434    HA   VAL  65           HA       VAL  65   2.630   0.711   8.214
  Start of MODEL    9
 6435    HB   VAL  65           HB       VAL  65   2.889  -1.762   8.020
  Start of MODEL    9
 6436    H    VAL  66           H        VAL  66   4.619   0.315   7.282
  Start of MODEL    9
 6437    HA   VAL  66           HA       VAL  66   4.738   0.131   4.361
  Start of MODEL    9
 6438    HB   VAL  66           HB       VAL  66   6.989   0.413   6.376
  Start of MODEL    9
 6439    H    ILE  67           H        ILE  67   5.543  -1.696   3.275
  Start of MODEL    9
 6440    HA   ILE  67           HA       ILE  67   5.151  -4.077   4.904
  Start of MODEL    9
 6441    HB   ILE  67           HB       ILE  67   5.180  -3.748   1.905
  Start of MODEL    9
 6442   HD11  ILE  67          HD11      ILE  67   3.275  -3.818   5.093
  Start of MODEL    9
 6443   HD13  ILE  67          HD12      ILE  67   2.742  -5.321   4.342
  Start of MODEL    9
 6444   HD12  ILE  67          HD13      ILE  67   1.687  -3.911   4.335
  Start of MODEL    9
 6445    H    THR  68           H        THR  68   6.712  -5.314   5.491
  Start of MODEL    9
 6446    HA   THR  68           HA       THR  68   9.267  -5.267   4.048
  Start of MODEL    9
 6447    HB   THR  68           HB       THR  68  10.369  -5.667   6.247
  Start of MODEL    9
 6448    HG1  THR  68           HG1      THR  68   8.086  -4.724   7.579
  Start of MODEL    9
 6449   HG21  THR  68          HG21      THR  68   8.761  -3.120   6.041
  Start of MODEL    9
 6450   HG23  THR  68          HG22      THR  68  10.359  -3.416   5.356
  Start of MODEL    9
 6451   HG22  THR  68          HG23      THR  68  10.146  -3.355   7.105
  Start of MODEL    9
 6452    H    ASP  69           H        ASP  69  10.372  -7.334   4.033
  Start of MODEL    9
 6453    HA   ASP  69           HA       ASP  69   8.790  -9.575   3.780
  Start of MODEL    9
 6454    HB2  ASP  69           HB2      ASP  69  10.986  -9.480   2.816
  Start of MODEL    9
 6455    HB3  ASP  69           HB3      ASP  69  11.733  -9.352   4.403
  Start of MODEL    9
 6456    H    ARG  70           H        ARG  70   8.024 -11.094   5.090
  Start of MODEL    9
 6457    HA   ARG  70           HA       ARG  70   7.697 -10.618   7.786
  Start of MODEL    9
 6458    HB2  ARG  70           HB2      ARG  70   6.226 -12.041   6.436
  Start of MODEL    9
 6459    HB3  ARG  70           HB3      ARG  70   7.489 -13.258   6.339
  Start of MODEL    9
 6460    HG2  ARG  70           HG2      ARG  70   5.892 -13.962   7.960
  Start of MODEL    9
 6461    HG3  ARG  70           HG3      ARG  70   7.364 -13.500   8.814
  Start of MODEL    9
 6462    HD2  ARG  70           HD2      ARG  70   5.030 -11.634   8.449
  Start of MODEL    9
 6463    HD3  ARG  70           HD3      ARG  70   5.164 -12.730   9.821
  Start of MODEL    9
 6464    HE   ARG  70           HE       ARG  70   7.506 -11.409   9.920
  Start of MODEL    9
 6465   HH11  ARG  70          HH11      ARG  70   4.222 -10.292   9.537
  Start of MODEL    9
 6466   HH12  ARG  70          HH12      ARG  70   4.462  -8.821  10.432
  Start of MODEL    9
 6467   HH21  ARG  70          HH21      ARG  70   7.856  -9.446  11.074
  Start of MODEL    9
 6468   HH22  ARG  70          HH22      ARG  70   6.544  -8.328  11.277
  Start of MODEL    9
 6469    H    ASN  71           H        ASN  71  10.358 -12.252   6.221
  Start of MODEL    9
 6470    HA   ASN  71           HA       ASN  71  11.191 -13.471   8.746
  Start of MODEL    9
 6471    HB2  ASN  71           HB2      ASN  71  12.293 -13.795   5.949
  Start of MODEL    9
 6472    HB3  ASN  71           HB3      ASN  71  12.892 -14.644   7.369
  Start of MODEL    9
 6473   HD21  ASN  71          HD21      ASN  71  10.219 -14.957   8.503
  Start of MODEL    9
 6474   HD22  ASN  71          HD22      ASN  71   9.440 -16.190   7.573
  Start of MODEL    9
 6475    H    THR  72           H        THR  72  12.625 -11.419   6.194
  Start of MODEL    9
 6476    HA   THR  72           HA       THR  72  14.881 -10.830   7.955
  Start of MODEL    9
 6477    HB   THR  72           HB       THR  72  15.774  -9.629   5.946
  Start of MODEL    9
 6478    HG1  THR  72           HG1      THR  72  13.583 -10.771   4.538
  Start of MODEL    9
 6479   HG23  THR  72          HG21      THR  72  16.333 -11.982   6.301
  Start of MODEL    9
 6480   HG22  THR  72          HG22      THR  72  16.121 -11.651   4.582
  Start of MODEL    9
 6481   HG21  THR  72          HG23      THR  72  14.847 -12.469   5.484
  Start of MODEL    9
 6482    H    GLN  73           H        GLN  73  12.001  -9.409   6.895
  Start of MODEL    9
 6483    HA   GLN  73           HA       GLN  73  10.872  -7.489   7.458
  Start of MODEL    9
 6484    HB2  GLN  73           HB2      GLN  73  13.186  -6.929   9.324
  Start of MODEL    9
 6485    HB3  GLN  73           HB3      GLN  73  11.631  -6.114   9.329
  Start of MODEL    9
 6486    HG2  GLN  73           HG2      GLN  73  10.545  -8.243   9.912
  Start of MODEL    9
 6487    HG3  GLN  73           HG3      GLN  73  12.136  -9.009   9.966
  Start of MODEL    9
 6488   HE21  GLN  73          HE21      GLN  73  10.181  -8.719  12.097
  Start of MODEL    9
 6489   HE22  GLN  73          HE22      GLN  73  10.954  -7.812  13.354
  Start of MODEL    9
 6490    H    LYS  74           H        LYS  74  13.136  -7.692   5.458
  Start of MODEL    9
 6491    HA   LYS  74           HA       LYS  74  14.142  -5.011   5.217
  Start of MODEL    9
 6492    HB2  LYS  74           HB2      LYS  74  13.947  -7.185   3.110
  Start of MODEL    9
 6493    HB3  LYS  74           HB3      LYS  74  14.887  -5.708   2.976
  Start of MODEL    9
 6494    HG2  LYS  74           HG2      LYS  74  15.361  -7.912   4.974
  Start of MODEL    9
 6495    HG3  LYS  74           HG3      LYS  74  16.283  -7.642   3.494
  Start of MODEL    9
 6496    HD2  LYS  74           HD2      LYS  74  16.028  -5.629   5.719
  Start of MODEL    9
 6497    HD3  LYS  74           HD3      LYS  74  17.366  -6.767   5.568
  Start of MODEL    9
 6498    HE2  LYS  74           HE2      LYS  74  17.986  -5.811   3.436
  Start of MODEL    9
 6499    HE3  LYS  74           HE3      LYS  74  16.588  -4.739   3.477
  Start of MODEL    9
 6500    HZ2  LYS  74           HZ1      LYS  74  18.718  -3.679   4.150
  Start of MODEL    9
 6501    HZ1  LYS  74           HZ2      LYS  74  18.759  -4.695   5.503
  Start of MODEL    9
 6502    HZ3  LYS  74           HZ3      LYS  74  17.497  -3.577   5.324
  Start of MODEL    9
 6503    H    SER  75           H        SER  75  13.072  -3.283   4.382
  Start of MODEL    9
 6504    HA   SER  75           HA       SER  75  10.408  -3.285   3.695
  Start of MODEL    9
 6505    HB2  SER  75           HB2      SER  75  12.467  -1.350   2.608
  Start of MODEL    9
 6506    HB3  SER  75           HB3      SER  75  10.761  -1.037   2.933
  Start of MODEL    9
 6507    HG   SER  75           HG       SER  75  12.007  -0.220   4.623
  Start of MODEL    9
 6508    H    ARG  76           H        ARG  76   9.302  -3.887   1.949
  Start of MODEL    9
 6509    HA   ARG  76           HA       ARG  76  10.780  -4.955  -0.315
  Start of MODEL    9
 6510    HB2  ARG  76           HB2      ARG  76   7.852  -5.017   0.400
  Start of MODEL    9
 6511    HB3  ARG  76           HB3      ARG  76   8.516  -5.755  -1.049
  Start of MODEL    9
 6512    HG2  ARG  76           HG2      ARG  76   9.944  -7.183   0.414
  Start of MODEL    9
 6513    HG3  ARG  76           HG3      ARG  76   9.100  -6.514   1.811
  Start of MODEL    9
 6514    HD2  ARG  76           HD2      ARG  76   7.004  -7.401   1.044
  Start of MODEL    9
 6515    HD3  ARG  76           HD3      ARG  76   7.722  -7.909  -0.481
  Start of MODEL    9
 6516    HE   ARG  76           HE       ARG  76   9.164  -9.254   1.401
  Start of MODEL    9
 6517   HH11  ARG  76          HH11      ARG  76   5.755  -8.979   0.651
  Start of MODEL    9
 6518   HH12  ARG  76          HH12      ARG  76   5.366 -10.576   1.207
  Start of MODEL    9
 6519   HH21  ARG  76          HH21      ARG  76   8.651 -11.383   2.150
  Start of MODEL    9
 6520   HH22  ARG  76          HH22      ARG  76   7.000 -11.939   2.061
  Start of MODEL    9
 6521    H    GLY  77           H        GLY  77  10.160  -2.009   0.383
  Start of MODEL    9
 6522    HA2  GLY  77           HA2      GLY  77  10.108  -0.092  -0.874
  Start of MODEL    9
 6523    HA3  GLY  77           HA3      GLY  77  10.075  -1.103  -2.308
  Start of MODEL    9
 6524    H    TYR  78           H        TYR  78   7.553  -1.667  -0.039
  Start of MODEL    9
 6525    HA   TYR  78           HA       TYR  78   5.818   0.354  -1.108
  Start of MODEL    9
 6526    HB2  TYR  78           HB2      TYR  78   4.118  -1.245  -1.960
  Start of MODEL    9
 6527    HB3  TYR  78           HB3      TYR  78   5.602  -1.251  -2.895
  Start of MODEL    9
 6528    HD1  TYR  78           HD1      TYR  78   3.478  -3.177  -0.607
  Start of MODEL    9
 6529    HD2  TYR  78           HD2      TYR  78   7.028  -3.186  -2.947
  Start of MODEL    9
 6530    HE1  TYR  78           HE1      TYR  78   3.596  -5.624  -0.412
  Start of MODEL    9
 6531    HE2  TYR  78           HE2      TYR  78   7.168  -5.624  -2.754
  Start of MODEL    9
 6532    HH   TYR  78           HH       TYR  78   4.609  -7.532  -1.699
  Start of MODEL    9
 6533    H    GLY  79           H        GLY  79   3.544   0.081  -0.161
  Start of MODEL    9
 6534    HA2  GLY  79           HA2      GLY  79   3.555  -1.283   2.412
  Start of MODEL    9
 6535    HA3  GLY  79           HA3      GLY  79   3.507   0.474   2.464
  Start of MODEL    9
 6536    H    PHE  80           H        PHE  80   1.456  -0.406   3.650
  Start of MODEL    9
 6537    HA   PHE  80           HA       PHE  80  -0.699  -0.238   1.683
  Start of MODEL    9
 6538    HB2  PHE  80           HB2      PHE  80  -0.439  -2.300   3.855
  Start of MODEL    9
 6539    HB3  PHE  80           HB3      PHE  80  -2.015  -1.837   3.218
  Start of MODEL    9
 6540    HD1  PHE  80           HD1      PHE  80   0.830  -3.888   2.788
  Start of MODEL    9
 6541    HD2  PHE  80           HD2      PHE  80  -2.340  -2.004   0.685
  Start of MODEL    9
 6542    HE1  PHE  80           HE1      PHE  80   1.140  -5.464   0.935
  Start of MODEL    9
 6543    HE2  PHE  80           HE2      PHE  80  -2.043  -3.571  -1.184
  Start of MODEL    9
 6544    HZ   PHE  80           HZ       PHE  80  -0.309  -5.262  -1.103
  Start of MODEL    9
 6545    H    VAL  81           H        VAL  81  -2.325   0.969   2.146
  Start of MODEL    9
 6546    HA   VAL  81           HA       VAL  81  -2.612   2.002   4.889
  Start of MODEL    9
 6547    HB   VAL  81           HB       VAL  81  -2.799   3.570   2.311
  Start of MODEL    9
 6548    H    THR  82           H        THR  82  -4.498   1.475   5.730
  Start of MODEL    9
 6549    HA   THR  82           HA       THR  82  -6.685   0.776   3.895
  Start of MODEL    9
 6550    HB   THR  82           HB       THR  82  -6.436  -0.010   6.804
  Start of MODEL    9
 6551    HG1  THR  82           HG1      THR  82  -5.074  -0.927   4.680
  Start of MODEL    9
 6552   HG22  THR  82          HG21      THR  82  -8.110  -1.712   6.187
  Start of MODEL    9
 6553   HG21  THR  82          HG22      THR  82  -8.161  -1.055   4.549
  Start of MODEL    9
 6554   HG23  THR  82          HG23      THR  82  -8.709  -0.074   5.911
  Start of MODEL    9
 6555    H    MET  83           H        MET  83  -8.021   2.443   3.682
  Start of MODEL    9
 6556    HA   MET  83           HA       MET  83  -8.172   4.467   5.727
  Start of MODEL    9
 6557    HB2  MET  83           HB2      MET  83  -9.628   4.266   3.086
  Start of MODEL    9
 6558    HB3  MET  83           HB3      MET  83  -9.568   5.684   4.126
  Start of MODEL    9
 6559    HG2  MET  83           HG2      MET  83  -7.200   4.405   2.779
  Start of MODEL    9
 6560    HG3  MET  83           HG3      MET  83  -8.044   5.847   2.219
  Start of MODEL    9
 6561    HE1  MET  83           HE1      MET  83  -8.658   7.520   4.712
  Start of MODEL    9
 6562    HE3  MET  83           HE2      MET  83  -7.834   8.225   3.320
  Start of MODEL    9
 6563    HE2  MET  83           HE3      MET  83  -7.193   8.478   4.946
  Start of MODEL    9
 6564    H    LYS  84           H        LYS  84  -9.864   4.940   6.959
  Start of MODEL    9
 6565    HA   LYS  84           HA       LYS  84 -11.632   2.858   7.709
  Start of MODEL    9
 6566    HB2  LYS  84           HB2      LYS  84 -10.724   4.565   9.240
  Start of MODEL    9
 6567    HB3  LYS  84           HB3      LYS  84 -11.656   5.804   8.418
  Start of MODEL    9
 6568    HG2  LYS  84           HG2      LYS  84 -13.707   4.908   9.212
  Start of MODEL    9
 6569    HG3  LYS  84           HG3      LYS  84 -12.911   3.446   9.807
  Start of MODEL    9
 6570    HD2  LYS  84           HD2      LYS  84 -12.197   6.187  10.812
  Start of MODEL    9
 6571    HD3  LYS  84           HD3      LYS  84 -13.496   5.233  11.529
  Start of MODEL    9
 6572    HE2  LYS  84           HE2      LYS  84 -10.705   4.149  11.201
  Start of MODEL    9
 6573    HE3  LYS  84           HE3      LYS  84 -11.186   5.084  12.621
  Start of MODEL    9
 6574    HZ1  LYS  84           HZ1      LYS  84 -13.055   3.406  12.836
  Start of MODEL    9
 6575    HZ3  LYS  84           HZ2      LYS  84 -11.498   2.865  13.204
  Start of MODEL    9
 6576    HZ2  LYS  84           HZ3      LYS  84 -12.201   2.455  11.721
  Start of MODEL    9
 6577    H    ASP  85           H        ASP  85 -11.776   5.206   5.256
  Start of MODEL    9
 6578    HA   ASP  85           HA       ASP  85 -14.583   4.617   4.723
  Start of MODEL    9
 6579    HB2  ASP  85           HB2      ASP  85 -15.075   6.644   5.685
  Start of MODEL    9
 6580    HB3  ASP  85           HB3      ASP  85 -13.473   7.301   5.386
  Start of MODEL    9
 6581    H    ARG  86           H        ARG  86 -15.133   4.780   2.500
  Start of MODEL    9
 6582    HA   ARG  86           HA       ARG  86 -13.004   4.156   0.758
  Start of MODEL    9
 6583    HB2  ARG  86           HB2      ARG  86 -15.197   3.213   0.349
  Start of MODEL    9
 6584    HB3  ARG  86           HB3      ARG  86 -15.885   4.821   0.145
  Start of MODEL    9
 6585    HG2  ARG  86           HG2      ARG  86 -14.216   5.095  -1.775
  Start of MODEL    9
 6586    HG3  ARG  86           HG3      ARG  86 -14.002   3.351  -1.668
  Start of MODEL    9
 6587    HD2  ARG  86           HD2      ARG  86 -16.229   2.931  -2.293
  Start of MODEL    9
 6588    HD3  ARG  86           HD3      ARG  86 -16.715   4.603  -1.988
  Start of MODEL    9
 6589    HE   ARG  86           HE       ARG  86 -14.698   4.517  -3.975
  Start of MODEL    9
 6590   HH11  ARG  86          HH11      ARG  86 -18.097   3.733  -3.582
  Start of MODEL    9
 6591   HH12  ARG  86          HH12      ARG  86 -18.487   4.138  -5.224
  Start of MODEL    9
 6592   HH21  ARG  86          HH21      ARG  86 -15.215   5.049  -6.088
  Start of MODEL    9
 6593   HH22  ARG  86          HH22      ARG  86 -16.856   4.866  -6.659
  Start of MODEL    9
 6594    H    ALA  87           H        ALA  87 -14.874   7.136   1.253
  Start of MODEL    9
 6595    HA   ALA  87           HA       ALA  87 -14.088   8.348  -1.184
  Start of MODEL    9
 6596    HB3  ALA  87           HB1      ALA  87 -15.003  10.383  -0.281
  Start of MODEL    9
 6597    HB2  ALA  87           HB2      ALA  87 -14.952   9.728   1.357
  Start of MODEL    9
 6598    HB1  ALA  87           HB3      ALA  87 -16.063   9.042   0.167
  Start of MODEL    9
 6599    H    SER  88           H        SER  88 -12.818   8.447   2.100
  Start of MODEL    9
 6600    HA   SER  88           HA       SER  88 -10.772  10.332   1.673
  Start of MODEL    9
 6601    HB2  SER  88           HB2      SER  88 -10.723   7.958   3.558
  Start of MODEL    9
 6602    HB3  SER  88           HB3      SER  88  -9.782   9.441   3.706
  Start of MODEL    9
 6603    HG   SER  88           HG       SER  88 -12.626   9.302   3.784
  Start of MODEL    9
 6604    H    ALA  89           H        ALA  89 -10.861   6.809   1.374
  Start of MODEL    9
 6605    HA   ALA  89           HA       ALA  89  -8.178   6.406   0.643
  Start of MODEL    9
 6606    HB1  ALA  89           HB1      ALA  89  -9.741   4.617   1.333
  Start of MODEL    9
 6607    HB3  ALA  89           HB2      ALA  89  -8.876   4.245  -0.158
  Start of MODEL    9
 6608    HB2  ALA  89           HB3      ALA  89 -10.560   4.770  -0.223
  Start of MODEL    9
 6609    H    GLU  90           H        GLU  90 -11.050   7.048  -1.292
  Start of MODEL    9
 6610    HA   GLU  90           HA       GLU  90  -9.738   6.624  -3.770
  Start of MODEL    9
 6611    HB2  GLU  90           HB2      GLU  90 -12.274   6.477  -3.213
  Start of MODEL    9
 6612    HB3  GLU  90           HB3      GLU  90 -12.268   8.200  -3.582
  Start of MODEL    9
 6613    HG2  GLU  90           HG2      GLU  90 -11.538   7.832  -5.786
  Start of MODEL    9
 6614    HG3  GLU  90           HG3      GLU  90 -11.115   6.154  -5.445
  Start of MODEL    9
 6615    H    ARG  91           H        ARG  91 -10.450   9.541  -1.854
  Start of MODEL    9
 6616    HA   ARG  91           HA       ARG  91  -9.551  11.444  -3.660
  Start of MODEL    9
 6617    HB2  ARG  91           HB2      ARG  91  -9.082  11.336  -0.673
  Start of MODEL    9
 6618    HB3  ARG  91           HB3      ARG  91  -8.852  12.763  -1.670
  Start of MODEL    9
 6619    HG2  ARG  91           HG2      ARG  91 -11.449  11.338  -1.155
  Start of MODEL    9
 6620    HG3  ARG  91           HG3      ARG  91 -10.939  12.875  -0.457
  Start of MODEL    9
 6621    HD2  ARG  91           HD2      ARG  91 -10.808  13.798  -2.768
  Start of MODEL    9
 6622    HD3  ARG  91           HD3      ARG  91 -11.512  12.289  -3.353
  Start of MODEL    9
 6623    HE   ARG  91           HE       ARG  91 -13.243  13.160  -1.420
  Start of MODEL    9
 6624   HH11  ARG  91          HH11      ARG  91 -11.922  14.487  -4.368
  Start of MODEL    9
 6625   HH12  ARG  91          HH12      ARG  91 -13.304  15.491  -4.689
  Start of MODEL    9
 6626   HH21  ARG  91          HH21      ARG  91 -15.049  14.477  -1.811
  Start of MODEL    9
 6627   HH22  ARG  91          HH22      ARG  91 -15.084  15.509  -3.208
  Start of MODEL    9
 6628    H    ALA  92           H        ALA  92  -7.732   9.469  -1.372
  Start of MODEL    9
 6629    HA   ALA  92           HA       ALA  92  -5.166  10.374  -2.014
  Start of MODEL    9
 6630    HB3  ALA  92           HB1      ALA  92  -5.686   8.991  -0.055
  Start of MODEL    9
 6631    HB2  ALA  92           HB2      ALA  92  -4.355   8.326  -0.999
  Start of MODEL    9
 6632    HB1  ALA  92           HB3      ALA  92  -5.962   7.609  -1.114
  Start of MODEL    9
 6633    H    CYS  93           H        CYS  93  -7.195   7.927  -3.566
  Start of MODEL    9
 6634    HA   CYS  93           HA       CYS  93  -5.057   7.015  -5.253
  Start of MODEL    9
 6635    HB2  CYS  93           HB2      CYS  93  -8.019   6.446  -5.361
  Start of MODEL    9
 6636    HB3  CYS  93           HB3      CYS  93  -6.779   5.592  -6.271
  Start of MODEL    9
 6637    HG   CYS  93           HG       CYS  93  -7.149   5.586  -2.870
  Start of MODEL    9
 6638    H    LYS  94           H        LYS  94  -7.170   9.691  -5.387
  Start of MODEL    9
 6639    HA   LYS  94           HA       LYS  94  -7.629   9.840  -8.152
  Start of MODEL    9
 6640    HB2  LYS  94           HB2      LYS  94  -8.752  11.164  -6.309
  Start of MODEL    9
 6641    HB3  LYS  94           HB3      LYS  94  -7.314  12.168  -6.260
  Start of MODEL    9
 6642    HG2  LYS  94           HG2      LYS  94  -8.619  11.829  -8.895
  Start of MODEL    9
 6643    HG3  LYS  94           HG3      LYS  94  -9.480  12.784  -7.688
  Start of MODEL    9
 6644    HD2  LYS  94           HD2      LYS  94  -7.457  14.173  -7.402
  Start of MODEL    9
 6645    HD3  LYS  94           HD3      LYS  94  -6.678  13.259  -8.695
  Start of MODEL    9
 6646    HE2  LYS  94           HE2      LYS  94  -8.326  14.006 -10.285
  Start of MODEL    9
 6647    HE3  LYS  94           HE3      LYS  94  -9.269  14.776  -9.009
  Start of MODEL    9
 6648    HZ3  LYS  94           HZ1      LYS  94  -7.450  16.307  -8.626
  Start of MODEL    9
 6649    HZ2  LYS  94           HZ2      LYS  94  -7.965  16.391 -10.240
  Start of MODEL    9
 6650    HZ1  LYS  94           HZ3      LYS  94  -6.529  15.570  -9.848
  Start of MODEL    9
 6651    H    ASP  95           H        ASP  95  -4.931  10.901  -6.148
  Start of MODEL    9
 6652    HA   ASP  95           HA       ASP  95  -3.438  11.428  -8.628
  Start of MODEL    9
 6653    HB2  ASP  95           HB2      ASP  95  -3.437  13.338  -7.044
  Start of MODEL    9
 6654    HB3  ASP  95           HB3      ASP  95  -2.727  12.300  -5.812
  Start of MODEL    9
 6655    HA   PRO  96           HA       PRO  96  -2.117   7.304  -7.294
  Start of MODEL    9
 6656    HB2  PRO  96           HB2      PRO  96  -1.266   6.484  -9.734
  Start of MODEL    9
 6657    HB3  PRO  96           HB3      PRO  96  -2.968   6.494  -9.261
  Start of MODEL    9
 6658    HG2  PRO  96           HG2      PRO  96  -1.452   8.489 -10.900
  Start of MODEL    9
 6659    HG3  PRO  96           HG3      PRO  96  -3.070   7.813 -11.173
  Start of MODEL    9
 6660    HD2  PRO  96           HD2      PRO  96  -2.674  10.259 -10.075
  Start of MODEL    9
 6661    HD3  PRO  96           HD3      PRO  96  -4.056   9.231  -9.652
  Start of MODEL    9
 6662    H    ASN  97           H        ASN  97  -0.347   9.983  -8.199
  Start of MODEL    9
 6663    HA   ASN  97           HA       ASN  97   2.159   8.539  -7.691
  Start of MODEL    9
 6664    HB2  ASN  97           HB2      ASN  97   1.586  10.518  -9.876
  Start of MODEL    9
 6665    HB3  ASN  97           HB3      ASN  97   3.225  10.246  -9.298
  Start of MODEL    9
 6666   HD21  ASN  97          HD21      ASN  97   2.821   7.419  -8.797
  Start of MODEL    9
 6667   HD22  ASN  97          HD22      ASN  97   2.778   6.663 -10.349
  Start of MODEL    9
 6668    HA   PRO  98           HA       PRO  98   1.709  12.374  -5.021
  Start of MODEL    9
 6669    HB2  PRO  98           HB2      PRO  98   1.827  10.633  -2.704
  Start of MODEL    9
 6670    HB3  PRO  98           HB3      PRO  98   0.558  11.769  -3.172
  Start of MODEL    9
 6671    HG2  PRO  98           HG2      PRO  98   0.234   9.062  -3.196
  Start of MODEL    9
 6672    HG3  PRO  98           HG3      PRO  98  -0.655  10.160  -4.266
  Start of MODEL    9
 6673    HD2  PRO  98           HD2      PRO  98   1.743   8.471  -4.847
  Start of MODEL    9
 6674    HD3  PRO  98           HD3      PRO  98   0.322   8.796  -5.860
  Start of MODEL    9
 6675    H    ILE  99           H        ILE  99   3.464  13.370  -4.062
  Start of MODEL    9
 6676    HA   ILE  99           HA       ILE  99   5.969  11.933  -4.068
  Start of MODEL    9
 6677    HB   ILE  99           HB       ILE  99   5.381  14.751  -3.139
  Start of MODEL    9
 6678   HD11  ILE  99          HD11      ILE  99   6.287  12.518  -6.002
  Start of MODEL    9
 6679   HD13  ILE  99          HD12      ILE  99   7.719  13.536  -5.838
  Start of MODEL    9
 6680   HD12  ILE  99          HD13      ILE  99   6.562  13.844  -7.131
  Start of MODEL    9
 6681    H    ILE 100           H        ILE 100   6.389  10.597  -2.465
  Start of MODEL    9
 6682    HA   ILE 100           HA       ILE 100   5.676  11.387   0.286
  Start of MODEL    9
 6683    HB   ILE 100           HB       ILE 100   5.713   8.566  -0.825
  Start of MODEL    9
 6684   HD11  ILE 100          HD11      ILE 100   2.971   7.916   0.519
  Start of MODEL    9
 6685   HD13  ILE 100          HD12      ILE 100   3.384   7.522  -1.150
  Start of MODEL    9
 6686   HD12  ILE 100          HD13      ILE 100   1.961   8.504  -0.801
  Start of MODEL    9
 6687    H    ASP 101           H        ASP 101   7.368  11.643   1.529
  Start of MODEL    9
 6688    HA   ASP 101           HA       ASP 101   9.447  11.478   2.452
  Start of MODEL    9
 6689    HB2  ASP 101           HB2      ASP 101   8.642   9.097   2.674
  Start of MODEL    9
 6690    HB3  ASP 101           HB3      ASP 101   9.502   8.726   1.185
  Start of MODEL    9
 6691    H    GLY 102           H        GLY 102   9.181  12.703  -0.059
  Start of MODEL    9
 6692    HA2  GLY 102           HA2      GLY 102  10.604  13.755  -1.528
  Start of MODEL    9
 6693    HA3  GLY 102           HA3      GLY 102  11.922  12.822  -0.844
  Start of MODEL    9
 6694    H    ARG 103           H        ARG 103   9.387  10.845  -1.919
  Start of MODEL    9
 6695    HA   ARG 103           HA       ARG 103  10.560  10.620  -4.596
  Start of MODEL    9
 6696    HB2  ARG 103           HB2      ARG 103  11.668   8.874  -3.456
  Start of MODEL    9
 6697    HB3  ARG 103           HB3      ARG 103  10.201   8.375  -2.621
  Start of MODEL    9
 6698    HG2  ARG 103           HG2      ARG 103   9.376   7.268  -4.461
  Start of MODEL    9
 6699    HG3  ARG 103           HG3      ARG 103  10.306   8.247  -5.596
  Start of MODEL    9
 6700    HD2  ARG 103           HD2      ARG 103  12.302   7.086  -5.110
  Start of MODEL    9
 6701    HD3  ARG 103           HD3      ARG 103  11.597   6.329  -3.680
  Start of MODEL    9
 6702    HE   ARG 103           HE       ARG 103  10.017   5.413  -5.663
  Start of MODEL    9
 6703   HH11  ARG 103          HH11      ARG 103  13.506   5.589  -5.431
  Start of MODEL    9
 6704   HH12  ARG 103          HH12      ARG 103  13.759   4.056  -6.207
  Start of MODEL    9
 6705   HH21  ARG 103          HH21      ARG 103  10.345   3.404  -6.695
  Start of MODEL    9
 6706   HH22  ARG 103          HH22      ARG 103  11.952   2.795  -6.909
  Start of MODEL    9
 6707    H    LYS 104           H        LYS 104   9.160  10.158  -6.234
  Start of MODEL    9
 6708    HA   LYS 104           HA       LYS 104   6.356  10.366  -5.758
  Start of MODEL    9
 6709    HB2  LYS 104           HB2      LYS 104   7.223  11.174  -7.847
  Start of MODEL    9
 6710    HB3  LYS 104           HB3      LYS 104   7.942   9.614  -8.219
  Start of MODEL    9
 6711    HG2  LYS 104           HG2      LYS 104   5.693   8.635  -8.378
  Start of MODEL    9
 6712    HG3  LYS 104           HG3      LYS 104   4.996  10.221  -8.060
  Start of MODEL    9
 6713    HD2  LYS 104           HD2      LYS 104   6.934   9.971 -10.298
  Start of MODEL    9
 6714    HD3  LYS 104           HD3      LYS 104   5.323   9.295 -10.525
  Start of MODEL    9
 6715    HE2  LYS 104           HE2      LYS 104   5.352  11.547 -11.363
  Start of MODEL    9
 6716    HE3  LYS 104           HE3      LYS 104   4.359  11.484  -9.908
  Start of MODEL    9
 6717    HZ3  LYS 104           HZ1      LYS 104   6.207  12.402  -8.652
  Start of MODEL    9
 6718    HZ2  LYS 104           HZ2      LYS 104   5.788  13.431  -9.923
  Start of MODEL    9
 6719    HZ1  LYS 104           HZ3      LYS 104   7.168  12.451 -10.048
  Start of MODEL    9
 6720    H    ALA 105           H        ALA 105   4.983   8.834  -5.210
  Start of MODEL    9
 6721    HA   ALA 105           HA       ALA 105   5.812   6.021  -5.441
  Start of MODEL    9
 6722    HB2  ALA 105           HB1      ALA 105   4.259   5.575  -3.609
  Start of MODEL    9
 6723    HB1  ALA 105           HB2      ALA 105   3.791   7.274  -3.581
  Start of MODEL    9
 6724    HB3  ALA 105           HB3      ALA 105   5.436   6.806  -3.154
  Start of MODEL    9
 6725    H    ASN 106           H        ASN 106   4.076   4.462  -5.871
  Start of MODEL    9
 6726    HA   ASN 106           HA       ASN 106   2.051   5.588  -7.701
  Start of MODEL    9
 6727    HB2  ASN 106           HB2      ASN 106   3.469   2.916  -7.765
  Start of MODEL    9
 6728    HB3  ASN 106           HB3      ASN 106   2.027   3.254  -8.710
  Start of MODEL    9
 6729   HD21  ASN 106          HD21      ASN 106   3.099   2.943 -10.641
  Start of MODEL    9
 6730   HD22  ASN 106          HD22      ASN 106   4.228   4.088 -11.267
  Start of MODEL    9
 6731    H    VAL 107           H        VAL 107   0.072   5.564  -6.821
  Start of MODEL    9
 6732    HA   VAL 107           HA       VAL 107  -0.528   3.428  -4.872
  Start of MODEL    9
 6733    HB   VAL 107           HB       VAL 107  -1.511   6.288  -4.892
  Start of MODEL    9
 6734    H    ASN 108           H        ASN 108  -2.313   2.261  -5.116
  Start of MODEL    9
 6735    HA   ASN 108           HA       ASN 108  -4.633   3.314  -6.500
  Start of MODEL    9
 6736    HB2  ASN 108           HB2      ASN 108  -4.858   1.327  -7.978
  Start of MODEL    9
 6737    HB3  ASN 108           HB3      ASN 108  -3.442   2.297  -8.376
  Start of MODEL    9
 6738   HD21  ASN 108          HD21      ASN 108  -4.579  -0.708  -7.046
  Start of MODEL    9
 6739   HD22  ASN 108          HD22      ASN 108  -3.060  -1.533  -7.098
  Start of MODEL    9
 6740    H    LEU 109           H        LEU 109  -6.581   2.126  -5.957
  Start of MODEL    9
 6741    HA   LEU 109           HA       LEU 109  -6.702   0.879  -3.486
  Start of MODEL    9
 6742    HB2  LEU 109           HB2      LEU 109  -8.504   0.574  -5.889
  Start of MODEL    9
 6743    HB3  LEU 109           HB3      LEU 109  -8.876  -0.107  -4.315
  Start of MODEL    9
 6744    HG   LEU 109           HG       LEU 109  -8.520   2.839  -4.897
  Start of MODEL    9
 6745   HD13  LEU 109          HD11      LEU 109 -10.561   1.899  -5.897
  Start of MODEL    9
 6746   HD12  LEU 109          HD12      LEU 109 -10.920   3.010  -4.575
  Start of MODEL    9
 6747   HD11  LEU 109          HD13      LEU 109 -11.033   1.266  -4.317
  Start of MODEL    9
 6748   HD21  LEU 109          HD21      LEU 109  -7.854   2.263  -2.629
  Start of MODEL    9
 6749   HD23  LEU 109          HD22      LEU 109  -9.373   1.400  -2.381
  Start of MODEL    9
 6750   HD22  LEU 109          HD23      LEU 109  -9.379   3.149  -2.617
  Start of MODEL    9
 6751    H    ALA 110           H        ALA 110  -6.310  -1.111  -2.733
  Start of MODEL    9
 6752    HA   ALA 110           HA       ALA 110  -4.391  -2.587  -4.107
  Start of MODEL    9
 6753    HB2  ALA 110           HB1      ALA 110  -4.429  -4.100  -2.200
  Start of MODEL    9
 6754    HB1  ALA 110           HB2      ALA 110  -5.946  -3.390  -1.653
  Start of MODEL    9
 6755    HB3  ALA 110           HB3      ALA 110  -4.475  -2.416  -1.673
  Start of MODEL    9
 6756    H    TYR 111           H        TYR 111  -7.870  -3.158  -3.870
  Start of MODEL    9
 6757    HA   TYR 111           HA       TYR 111  -7.739  -5.886  -4.653
  Start of MODEL    9
 6758    HB2  TYR 111           HB2      TYR 111 -10.087  -5.856  -4.764
  Start of MODEL    9
 6759    HB3  TYR 111           HB3      TYR 111  -9.691  -4.694  -3.504
  Start of MODEL    9
 6760    HD1  TYR 111           HD1      TYR 111  -9.338  -2.210  -4.501
  Start of MODEL    9
 6761    HD2  TYR 111           HD2      TYR 111 -11.770  -5.240  -6.227
  Start of MODEL    9
 6762    HE1  TYR 111           HE1      TYR 111 -10.649  -0.486  -5.651
  Start of MODEL    9
 6763    HE2  TYR 111           HE2      TYR 111 -13.095  -3.523  -7.385
  Start of MODEL    9
 6764    HH   TYR 111           HH       TYR 111 -12.115  -0.301  -7.651
  Start of MODEL    9
 6765    H    LEU 112           H        LEU 112  -7.402  -2.982  -6.382
  Start of MODEL    9
 6766    HA   LEU 112           HA       LEU 112  -8.220  -4.001  -8.941
  Start of MODEL    9
 6767    HB2  LEU 112           HB2      LEU 112  -6.739  -1.521  -8.094
  Start of MODEL    9
 6768    HB3  LEU 112           HB3      LEU 112  -7.088  -1.895  -9.770
  Start of MODEL    9
 6769    HG   LEU 112           HG       LEU 112  -9.122  -1.439  -7.592
  Start of MODEL    9
 6770   HD11  LEU 112          HD11      LEU 112  -8.468   0.193 -10.045
  Start of MODEL    9
 6771   HD13  LEU 112          HD12      LEU 112  -8.001   0.605  -8.392
  Start of MODEL    9
 6772   HD12  LEU 112          HD13      LEU 112  -9.708   0.548  -8.841
  Start of MODEL    9
 6773   HD23  LEU 112          HD21      LEU 112  -9.481  -2.099 -10.510
  Start of MODEL    9
 6774   HD22  LEU 112          HD22      LEU 112 -10.769  -1.638  -9.398
  Start of MODEL    9
 6775   HD21  LEU 112          HD23      LEU 112  -9.879  -3.140  -9.143
  Start of MODEL    9
 6776    H    GLY 113           H        GLY 113  -5.575  -4.667  -7.059
  Start of MODEL    9
 6777    HA2  GLY 113           HA2      GLY 113  -3.976  -5.332  -9.434
  Start of MODEL    9
 6778    HA3  GLY 113           HA3      GLY 113  -3.229  -4.430  -8.122
  Start of MODEL    9
 6779    H    ALA 114           H        ALA 114  -5.569  -6.646  -7.071
  Start of MODEL    9
 6780    HA   ALA 114           HA       ALA 114  -3.608  -8.249  -5.751
  Start of MODEL    9
 6781    HB3  ALA 114           HB1      ALA 114  -5.748  -7.753  -4.700
  Start of MODEL    9
 6782    HB2  ALA 114           HB2      ALA 114  -5.530  -9.493  -4.875
  Start of MODEL    9
 6783    HB1  ALA 114           HB3      ALA 114  -6.594  -8.624  -5.981
  Start of MODEL    9
 6784    H    LYS 115           H        LYS 115  -3.051 -10.390  -6.141
  Start of MODEL    9
 6785    HA   LYS 115           HA       LYS 115  -2.892 -11.127  -8.852
  Start of MODEL    9
 6786    HB2  LYS 115           HB2      LYS 115  -2.430 -12.863  -6.415
  Start of MODEL    9
 6787    HB3  LYS 115           HB3      LYS 115  -1.930 -13.245  -8.053
  Start of MODEL    9
 6788    HG2  LYS 115           HG2      LYS 115  -0.456 -11.263  -8.039
  Start of MODEL    9
 6789    HG3  LYS 115           HG3      LYS 115  -0.916 -10.969  -6.359
  Start of MODEL    9
 6790    HD2  LYS 115           HD2      LYS 115  -0.055 -13.215  -5.773
  Start of MODEL    9
 6791    HD3  LYS 115           HD3      LYS 115   0.485 -13.416  -7.439
  Start of MODEL    9
 6792    HE2  LYS 115           HE2      LYS 115   1.919 -11.436  -7.187
  Start of MODEL    9
 6793    HE3  LYS 115           HE3      LYS 115   1.406 -11.296  -5.508
  Start of MODEL    9
 6794    HZ1  LYS 115           HZ1      LYS 115   2.354 -13.536  -5.127
  Start of MODEL    9
 6795    HZ3  LYS 115           HZ2      LYS 115   3.512 -12.393  -5.592
  Start of MODEL    9
 6796    HZ2  LYS 115           HZ3      LYS 115   2.953 -13.531  -6.717
  Start of MODEL    9
 6797    HA   PRO 116           HA       PRO 116  -6.776 -13.358  -9.215
  Start of MODEL    9
 6798    HB2  PRO 116           HB2      PRO 116  -6.551 -13.961 -11.822
  Start of MODEL    9
 6799    HB3  PRO 116           HB3      PRO 116  -6.929 -12.323 -11.277
  Start of MODEL    9
 6800    HG2  PRO 116           HG2      PRO 116  -4.315 -13.457 -12.191
  Start of MODEL    9
 6801    HG3  PRO 116           HG3      PRO 116  -5.043 -11.882 -12.550
  Start of MODEL    9
 6802    HD2  PRO 116           HD2      PRO 116  -3.103 -12.281 -10.648
  Start of MODEL    9
 6803    HD3  PRO 116           HD3      PRO 116  -4.275 -10.949 -10.613
  Start of MODEL    9
 6804    H    ARG 117           H        ARG 117  -3.887 -14.456  -8.719
  Start of MODEL    9
 6805    HA   ARG 117           HA       ARG 117  -4.702 -17.225  -8.746
  Start of MODEL    9
 6806    HB2  ARG 117           HB2      ARG 117  -3.441 -16.767 -10.943
  Start of MODEL    9
 6807    HB3  ARG 117           HB3      ARG 117  -2.012 -16.533  -9.942
  Start of MODEL    9
 6808    HG2  ARG 117           HG2      ARG 117  -2.078 -18.790 -10.819
  Start of MODEL    9
 6809    HG3  ARG 117           HG3      ARG 117  -2.270 -18.815  -9.062
  Start of MODEL    9
 6810    HD2  ARG 117           HD2      ARG 117  -4.751 -18.875  -9.452
  Start of MODEL    9
 6811    HD3  ARG 117           HD3      ARG 117  -4.409 -19.121 -11.159
  Start of MODEL    9
 6812    HE   ARG 117           HE       ARG 117  -3.019 -21.087  -9.776
  Start of MODEL    9
 6813   HH11  ARG 117          HH11      ARG 117  -6.312 -20.080 -10.339
  Start of MODEL    9
 6814   HH12  ARG 117          HH12      ARG 117  -6.993 -21.664 -10.090
  Start of MODEL    9
 6815   HH21  ARG 117          HH21      ARG 117  -3.891 -23.184  -9.410
  Start of MODEL    9
 6816   HH22  ARG 117          HH22      ARG 117  -5.613 -23.426  -9.509
  Start of MODEL    9
 6817    H    THR 118           H        THR 118  -4.642 -17.304  -6.565
  Start of MODEL    9
 6818    HA   THR 118           HA       THR 118  -2.057 -16.795  -5.275
  Start of MODEL    9
 6819    HB   THR 118           HB       THR 118  -3.411 -14.779  -4.947
  Start of MODEL    9
 6820    HG1  THR 118           HG1      THR 118  -3.560 -15.023  -2.497
  Start of MODEL    9
 6821   HG22  THR 118          HG21      THR 118  -5.494 -14.877  -3.619
  Start of MODEL    9
 6822   HG21  THR 118          HG22      THR 118  -5.418 -16.638  -3.670
  Start of MODEL    9
 6823   HG23  THR 118          HG23      THR 118  -5.637 -15.722  -5.161
  Start of MODEL    9
 6824    H    ASN 119           H        ASN 119  -2.332 -17.483  -2.834
  Start of MODEL    9
 6825    HA   ASN 119           HA       ASN 119  -2.896 -20.295  -2.839
  Start of MODEL    9
 6826    HB2  ASN 119           HB2      ASN 119  -1.027 -19.235  -1.552
  Start of MODEL    9
 6827    HB3  ASN 119           HB3      ASN 119  -2.223 -18.463  -0.519
  Start of MODEL    9
 6828   HD21  ASN 119          HD21      ASN 119  -3.482 -19.771   0.874
  Start of MODEL    9
 6829   HD22  ASN 119          HD22      ASN 119  -2.929 -21.335   1.358
  Start of MODEL    9
 6830    H    VAL 120           H        VAL 120  -4.486 -17.385  -1.815
  Start of MODEL    9
 6831    HA   VAL 120           HA       VAL 120  -6.538 -16.917  -0.974
  Start of MODEL    9
 6832    HB   VAL 120           HB       VAL 120  -7.121 -19.872  -1.292
  Start of MODEL    9
 6833    H    GLN 121           H        GLN 121  -7.462 -16.779   1.102
  Start of MODEL    9
 6834    HA   GLN 121           HA       GLN 121  -5.703 -17.791   3.157
  Start of MODEL    9
 6835    HB2  GLN 121           HB2      GLN 121  -7.078 -16.360   4.687
  Start of MODEL    9
 6836    HB3  GLN 121           HB3      GLN 121  -6.269 -15.498   3.391
  Start of MODEL    9
 6837    HG2  GLN 121           HG2      GLN 121  -8.334 -15.302   2.166
  Start of MODEL    9
 6838    HG3  GLN 121           HG3      GLN 121  -9.176 -16.294   3.356
  Start of MODEL    9
 6839   HE21  GLN 121          HE21      GLN 121  -7.766 -15.053   5.602
  Start of MODEL    9
 6840   HE22  GLN 121          HE22      GLN 121  -8.480 -13.494   5.803
  Start of MODEL    9
 6841    H5'   DG   1           H5'       DG   1  21.299  -2.087  -4.568
  Start of MODEL    9
 6842    H4'   DG   1           H4'       DG   1  19.779  -3.236  -6.151
  Start of MODEL    9
 6843    H3'   DG   1           H3'       DG   1  18.307  -0.981  -6.380
  Start of MODEL    9
 6844    H2'   DG   1           H2'       DG   1  17.372  -0.900  -4.186
  Start of MODEL    9
 6845    H1'   DG   1           H1'       DG   1  17.118  -3.938  -4.170
  Start of MODEL    9
 6846    H8    DG   1           H8        DG   1  19.100  -1.456  -1.974
  Start of MODEL    9
 6847    H1    DG   1           H1        DG   1  14.364  -4.633   0.974
  Start of MODEL    9
 6848    H22   DG   1           H21       DG   1  13.696  -5.942  -2.172
  Start of MODEL    9
 6849    H21   DG   1           H22       DG   1  13.250  -5.866  -0.483
  Start of MODEL    9
 6850   HO5'   DG   1           H5T       DG   1  19.175  -0.840  -3.824
  Start of MODEL    9
 6851   H5''   DG   1          5H''       DG   1  20.846  -1.137  -5.993
  Start of MODEL    9
 6852   H2''   DG   1          2H''       DG   1  16.165  -1.899  -4.978
  Start of MODEL    9
 6853    H5'   DG   2           H5'       DG   2  14.373  -3.526  -8.507
  Start of MODEL    9
 6854    H4'   DG   2           H4'       DG   2  12.563  -2.422  -9.477
  Start of MODEL    9
 6855    H3'   DG   2           H3'       DG   2  14.202  -0.906 -10.997
  Start of MODEL    9
 6856    H2'   DG   2           H2'       DG   2  14.944   0.607  -9.292
  Start of MODEL    9
 6857    H1'   DG   2           H1'       DG   2  12.091   0.654  -8.194
  Start of MODEL    9
 6858    H8    DG   2           H8        DG   2  15.733   1.446  -7.612
  Start of MODEL    9
 6859    H1    DG   2           H1        DG   2  12.057   1.887  -2.370
  Start of MODEL    9
 6860    H22   DG   2           H21       DG   2   9.643   0.356  -4.326
  Start of MODEL    9
 6861    H21   DG   2           H22       DG   2  10.071   1.041  -2.774
  Start of MODEL    9
 6862   H5''   DG   2          5H''       DG   2  15.006  -2.845 -10.020
  Start of MODEL    9
 6863   H2''   DG   2          2H''       DG   2  13.555   1.483  -9.921
  Start of MODEL    9
 6864    H5'   DT   3           H5'       DT   3  10.344  -2.909  -9.859
  Start of MODEL    9
 6865    H4'   DT   3           H4'       DT   3   8.135  -3.910 -10.033
  Start of MODEL    9
 6866    H3'   DT   3           H3'       DT   3   8.081  -3.724 -12.690
  Start of MODEL    9
 6867    H2'   DT   3           H2'       DT   3   8.287  -1.287 -12.733
  Start of MODEL    9
 6868    H1'   DT   3           H1'       DT   3   6.023  -1.336 -10.650
  Start of MODEL    9
 6869    H3    DT   3           H3        DT   3   6.178   3.143 -11.999
  Start of MODEL    9
 6870    H72   DT   3           H71       DT   3   9.673   2.117  -8.139
  Start of MODEL    9
 6871    H71   DT   3           H72       DT   3   9.461   3.732  -8.854
  Start of MODEL    9
 6872    H73   DT   3           H73       DT   3  10.602   2.581  -9.587
  Start of MODEL    9
 6873    H6    DT   3           H6        DT   3   8.893   0.134  -9.483
  Start of MODEL    9
 6874   H5''   DT   3          5H''       DT   3  10.192  -3.862 -11.352
  Start of MODEL    9
 6875   H2''   DT   3          2H''       DT   3   6.580  -1.583 -13.052
  Start of MODEL    9
 6876    H5'   DG   4           H5'       DG   4   6.826  -5.876  -9.500
  Start of MODEL    9
 6877    H4'   DG   4           H4'       DG   4   5.998  -4.802  -7.618
  Start of MODEL    9
 6878    H3'   DG   4           H3'       DG   4   3.330  -5.706  -8.413
  Start of MODEL    9
 6879    H2'   DG   4           H2'       DG   4   2.511  -3.550  -8.779
  Start of MODEL    9
 6880    H1'   DG   4           H1'       DG   4   5.035  -2.432  -7.460
  Start of MODEL    9
 6881    H8    DG   4           H8        DG   4   4.978   0.038  -7.776
  Start of MODEL    9
 6882    H1    DG   4           H1        DG   4   1.770  -0.389 -13.319
  Start of MODEL    9
 6883    H22   DG   4           H21       DG   4   1.927  -3.805 -12.793
  Start of MODEL    9
 6884    H21   DG   4           H22       DG   4   1.410  -2.489 -13.822
  Start of MODEL    9
 6885   H5''   DG   4          5H''       DG   4   5.447  -6.863  -8.971
  Start of MODEL    9
 6886   H2''   DG   4          2H''       DG   4   2.814  -3.248  -7.069
  Start of MODEL    9
 6887    H5'   DT   5           H5'       DT   5   3.878  -8.445  -3.462
  Start of MODEL    9
 6888    H4'   DT   5           H4'       DT   5   2.701  -7.625  -1.753
  Start of MODEL    9
 6889    H3'   DT   5           H3'       DT   5   1.324  -9.717  -2.674
  Start of MODEL    9
 6890    H2'   DT   5           H2'       DT   5  -0.080  -8.491  -4.226
  Start of MODEL    9
 6891    H1'   DT   5           H1'       DT   5  -0.502  -6.435  -2.000
  Start of MODEL    9
 6892    H3    DT   5           H3        DT   5  -3.204  -4.034  -4.616
  Start of MODEL    9
 6893    H73   DT   5           H71       DT   5  -0.303  -4.898  -8.281
  Start of MODEL    9
 6894    H71   DT   5           H72       DT   5   0.594  -3.561  -7.517
  Start of MODEL    9
 6895    H72   DT   5           H73       DT   5   1.235  -5.222  -7.450
  Start of MODEL    9
 6896    H6    DT   5           H6        DT   5   1.005  -6.147  -5.328
  Start of MODEL    9
 6897   H5''   DT   5          5H''       DT   5   2.445  -8.685  -4.478
  Start of MODEL    9
 6898   H2''   DT   5          2H''       DT   5  -1.122  -8.628  -2.813
  Start of MODEL    9
 6899    H5'   DG   6           H5'       DG   6   2.730  -7.318   1.648
  Start of MODEL    9
 6900    H4'   DG   6           H4'       DG   6   3.273  -8.001   4.051
  Start of MODEL    9
 6901    H3'   DG   6           H3'       DG   6   1.737 -10.210   3.747
  Start of MODEL    9
 6902    H2'   DG   6           H2'       DG   6  -0.374  -9.112   3.400
  Start of MODEL    9
 6903    H1'   DG   6           H1'       DG   6   0.402  -7.057   5.530
  Start of MODEL    9
 6904    H8    DG   6           H8        DG   6  -1.083  -7.450   1.972
  Start of MODEL    9
 6905    H1    DG   6           H1        DG   6  -3.623  -2.804   5.613
  Start of MODEL    9
 6906    H22   DG   6           H21       DG   6  -1.261  -3.799   7.956
  Start of MODEL    9
 6907    H21   DG   6           H22       DG   6  -2.578  -2.720   7.563
  Start of MODEL    9
 6908   H5''   DG   6          5H''       DG   6   3.409  -8.925   1.952
  Start of MODEL    9
 6909   H2''   DG   6          2H''       DG   6  -0.391  -9.301   5.148
  Start of MODEL    9
 6910    H5'   DC   7           H5'       DC   7   3.698 -13.228   4.642
  Start of MODEL    9
 6911    H4'   DC   7           H4'       DC   7   2.117 -14.529   3.742
  Start of MODEL    9
 6912    H3'   DC   7           H3'       DC   7   1.024 -12.262   2.609
  Start of MODEL    9
 6913   HO3'   DC   7           H3T       DC   7   0.042 -14.929   2.677
  Start of MODEL    9
 6914    H2'   DC   7           H2'       DC   7  -0.563 -11.763   4.306
  Start of MODEL    9
 6915    H1'   DC   7           H1'       DC   7  -0.862 -14.766   4.827
  Start of MODEL    9
 6916    H42   DC   7           H41       DC   7  -2.723 -11.498  10.294
  Start of MODEL    9
 6917    H41   DC   7           H42       DC   7  -3.845 -12.822  10.066
  Start of MODEL    9
 6918    H5    DC   7           H5        DC   7  -0.907 -11.033   8.761
  Start of MODEL    9
 6919    H6    DC   7           H6        DC   7   0.195 -11.741   6.701
  Start of MODEL    9
 6920   H5''   DC   7          5H''       DC   7   2.913 -11.997   3.631
  Start of MODEL    9
 6921   H2''   DC   7          2H''       DC   7  -1.499 -12.935   3.391
  Start of MODEL   10
 6922    H1   GLY  25           HT1      GLY  25  -9.804 -10.643 -13.287
  Start of MODEL   10
 6923    H2   GLY  25           HT2      GLY  25 -11.321 -11.211 -12.791
  Start of MODEL   10
 6924    H3   GLY  25           HT3      GLY  25  -9.925 -12.114 -12.447
  Start of MODEL   10
 6925    HA3  GLY  25           HA2      GLY  25 -10.632  -9.455 -11.334
  Start of MODEL   10
 6926    HA2  GLY  25           HA3      GLY  25  -9.120 -10.298 -11.028
  Start of MODEL   10
 6927    H    ALA  26           H        ALA  26 -11.118  -9.480  -9.091
  Start of MODEL   10
 6928    HA   ALA  26           HA       ALA  26 -12.433 -11.926  -8.259
  Start of MODEL   10
 6929    HB1  ALA  26           HB1      ALA  26 -10.206 -10.707  -6.633
  Start of MODEL   10
 6930    HB3  ALA  26           HB2      ALA  26 -10.204 -12.301  -7.388
  Start of MODEL   10
 6931    HB2  ALA  26           HB3      ALA  26 -11.309 -11.952  -6.058
  Start of MODEL   10
 6932    H    MET  27           H        MET  27 -13.727 -11.584  -6.300
  Start of MODEL   10
 6933    HA   MET  27           HA       MET  27 -14.193  -8.929  -5.339
  Start of MODEL   10
 6934    HB2  MET  27           HB2      MET  27 -16.533  -8.764  -6.103
  Start of MODEL   10
 6935    HB3  MET  27           HB3      MET  27 -15.410  -8.770  -7.455
  Start of MODEL   10
 6936    HG2  MET  27           HG2      MET  27 -15.916 -11.079  -7.929
  Start of MODEL   10
 6937    HG3  MET  27           HG3      MET  27 -16.946 -11.181  -6.503
  Start of MODEL   10
 6938    HE2  MET  27           HE1      MET  27 -17.925  -8.531 -10.157
  Start of MODEL   10
 6939    HE1  MET  27           HE2      MET  27 -16.472  -9.519 -10.037
  Start of MODEL   10
 6940    HE3  MET  27           HE3      MET  27 -16.682  -8.132  -8.970
  Start of MODEL   10
 6941    H    GLY  28           H        GLY  28 -16.366  -9.048  -3.955
  Start of MODEL   10
 6942    HA2  GLY  28           HA2      GLY  28 -17.655 -11.163  -3.019
  Start of MODEL   10
 6943    HA3  GLY  28           HA3      GLY  28 -16.071 -11.430  -2.302
  Start of MODEL   10
 6944    H    SER  29           H        SER  29 -17.255 -11.268  -0.267
  Start of MODEL   10
 6945    HA   SER  29           HA       SER  29 -18.313  -8.681   0.467
  Start of MODEL   10
 6946    HB2  SER  29           HB2      SER  29 -17.794 -11.027   2.296
  Start of MODEL   10
 6947    HB3  SER  29           HB3      SER  29 -18.953  -9.714   2.519
  Start of MODEL   10
 6948    HG   SER  29           HG       SER  29 -20.139 -10.525   0.757
  Start of MODEL   10
 6949    H    ARG  30           H        ARG  30 -15.938  -7.977  -0.217
  Start of MODEL   10
 6950    HA   ARG  30           HA       ARG  30 -14.155  -8.129   2.099
  Start of MODEL   10
 6951    HB2  ARG  30           HB2      ARG  30 -13.736  -7.619  -0.796
  Start of MODEL   10
 6952    HB3  ARG  30           HB3      ARG  30 -12.639  -6.836   0.334
  Start of MODEL   10
 6953    HG2  ARG  30           HG2      ARG  30 -13.183  -9.794   0.255
  Start of MODEL   10
 6954    HG3  ARG  30           HG3      ARG  30 -11.816  -8.999  -0.527
  Start of MODEL   10
 6955    HD2  ARG  30           HD2      ARG  30 -11.111  -8.131   1.695
  Start of MODEL   10
 6956    HD3  ARG  30           HD3      ARG  30 -12.418  -9.052   2.436
  Start of MODEL   10
 6957    HE   ARG  30           HE       ARG  30 -10.935 -10.856   0.944
  Start of MODEL   10
 6958   HH11  ARG  30          HH11      ARG  30 -10.406  -8.770   3.714
  Start of MODEL   10
 6959   HH12  ARG  30          HH12      ARG  30  -9.140  -9.760   4.368
  Start of MODEL   10
 6960   HH21  ARG  30          HH21      ARG  30  -9.276 -12.152   1.800
  Start of MODEL   10
 6961   HH22  ARG  30          HH22      ARG  30  -8.485 -11.677   3.279
  Start of MODEL   10
 6962    H    ASP  31           H        ASP  31 -14.497  -6.636   3.530
  Start of MODEL   10
 6963    HA   ASP  31           HA       ASP  31 -15.635  -4.107   3.147
  Start of MODEL   10
 6964    HB2  ASP  31           HB2      ASP  31 -13.863  -5.241   5.307
  Start of MODEL   10
 6965    HB3  ASP  31           HB3      ASP  31 -14.544  -3.617   5.402
  Start of MODEL   10
 6966    H    THR  32           H        THR  32 -12.533  -5.261   2.444
  Start of MODEL   10
 6967    HA   THR  32           HA       THR  32 -11.250  -2.650   2.615
  Start of MODEL   10
 6968    HB   THR  32           HB       THR  32  -9.288  -4.213   1.712
  Start of MODEL   10
 6969    HG1  THR  32           HG1      THR  32 -10.478  -6.143   3.320
  Start of MODEL   10
 6970   HG21  THR  32          HG21      THR  32 -10.269  -4.251   4.566
  Start of MODEL   10
 6971   HG23  THR  32          HG22      THR  32  -9.308  -2.968   3.829
  Start of MODEL   10
 6972   HG22  THR  32          HG23      THR  32  -8.622  -4.582   4.022
  Start of MODEL   10
 6973    H    MET  33           H        MET  33 -13.102  -4.098   0.307
  Start of MODEL   10
 6974    HA   MET  33           HA       MET  33 -11.631  -4.091  -2.008
  Start of MODEL   10
 6975    HB2  MET  33           HB2      MET  33 -14.512  -3.661  -1.437
  Start of MODEL   10
 6976    HB3  MET  33           HB3      MET  33 -13.934  -3.280  -3.056
  Start of MODEL   10
 6977    HG2  MET  33           HG2      MET  33 -13.028  -5.544  -3.256
  Start of MODEL   10
 6978    HG3  MET  33           HG3      MET  33 -13.638  -5.923  -1.650
  Start of MODEL   10
 6979    HE2  MET  33           HE1      MET  33 -16.358  -4.934  -5.250
  Start of MODEL   10
 6980    HE1  MET  33           HE2      MET  33 -14.595  -5.001  -5.350
  Start of MODEL   10
 6981    HE3  MET  33           HE3      MET  33 -15.380  -3.733  -4.406
  Start of MODEL   10
 6982    H    PHE  34           H        PHE  34 -13.408  -1.185  -0.730
  Start of MODEL   10
 6983    HA   PHE  34           HA       PHE  34 -11.914   0.349  -2.743
  Start of MODEL   10
 6984    HB2  PHE  34           HB2      PHE  34 -14.515   0.873  -1.308
  Start of MODEL   10
 6985    HB3  PHE  34           HB3      PHE  34 -13.655   2.137  -2.179
  Start of MODEL   10
 6986    HD1  PHE  34           HD1      PHE  34 -15.535  -1.001  -2.509
  Start of MODEL   10
 6987    HD2  PHE  34           HD2      PHE  34 -13.619   2.200  -4.553
  Start of MODEL   10
 6988    HE1  PHE  34           HE1      PHE  34 -16.635  -1.687  -4.602
  Start of MODEL   10
 6989    HE2  PHE  34           HE2      PHE  34 -14.709   1.523  -6.650
  Start of MODEL   10
 6990    HZ   PHE  34           HZ       PHE  34 -16.222  -0.422  -6.680
  Start of MODEL   10
 6991    H    THR  35           H        THR  35 -11.664  -0.497   0.406
  Start of MODEL   10
 6992    HA   THR  35           HA       THR  35 -10.900   2.170   1.355
  Start of MODEL   10
 6993    HB   THR  35           HB       THR  35 -10.878   1.060   3.618
  Start of MODEL   10
 6994    HG1  THR  35           HG1      THR  35 -12.423  -0.989   3.189
  Start of MODEL   10
 6995   HG22  THR  35          HG21      THR  35 -13.350   0.937   3.781
  Start of MODEL   10
 6996   HG21  THR  35          HG22      THR  35 -13.443   1.004   2.020
  Start of MODEL   10
 6997   HG23  THR  35          HG23      THR  35 -12.793   2.374   2.923
  Start of MODEL   10
 6998    H    LYS  36           H        LYS  36  -9.567  -0.928   0.530
  Start of MODEL   10
 6999    HA   LYS  36           HA       LYS  36  -7.121  -0.531   2.009
  Start of MODEL   10
 7000    HB2  LYS  36           HB2      LYS  36  -8.139  -2.738   1.834
  Start of MODEL   10
 7001    HB3  LYS  36           HB3      LYS  36  -8.068  -2.660   0.087
  Start of MODEL   10
 7002    HG2  LYS  36           HG2      LYS  36  -5.658  -2.786   0.144
  Start of MODEL   10
 7003    HG3  LYS  36           HG3      LYS  36  -5.683  -2.751   1.913
  Start of MODEL   10
 7004    HD2  LYS  36           HD2      LYS  36  -6.914  -4.844   1.975
  Start of MODEL   10
 7005    HD3  LYS  36           HD3      LYS  36  -7.025  -4.863   0.216
  Start of MODEL   10
 7006    HE2  LYS  36           HE2      LYS  36  -4.430  -4.940   1.739
  Start of MODEL   10
 7007    HE3  LYS  36           HE3      LYS  36  -5.286  -6.377   1.184
  Start of MODEL   10
 7008    HZ2  LYS  36           HZ1      LYS  36  -3.581  -5.785  -0.381
  Start of MODEL   10
 7009    HZ1  LYS  36           HZ2      LYS  36  -4.181  -4.211  -0.517
  Start of MODEL   10
 7010    HZ3  LYS  36           HZ3      LYS  36  -5.092  -5.514  -1.094
  Start of MODEL   10
 7011    H    ILE  37           H        ILE  37  -5.645   0.796   1.244
  Start of MODEL   10
 7012    HA   ILE  37           HA       ILE  37  -5.397   1.184  -1.651
  Start of MODEL   10
 7013    HB   ILE  37           HB       ILE  37  -4.253   2.795   0.640
  Start of MODEL   10
 7014   HD13  ILE  37          HD11      ILE  37  -5.483   5.046   1.012
  Start of MODEL   10
 7015   HD12  ILE  37          HD12      ILE  37  -6.923   5.384   0.056
  Start of MODEL   10
 7016   HD11  ILE  37          HD13      ILE  37  -5.333   5.429  -0.702
  Start of MODEL   10
 7017    H    PHE  38           H        PHE  38  -3.640   0.588  -2.772
  Start of MODEL   10
 7018    HA   PHE  38           HA       PHE  38  -1.411  -0.621  -1.296
  Start of MODEL   10
 7019    HB2  PHE  38           HB2      PHE  38  -2.303  -2.114  -2.970
  Start of MODEL   10
 7020    HB3  PHE  38           HB3      PHE  38  -2.253  -0.854  -4.198
  Start of MODEL   10
 7021    HD1  PHE  38           HD1      PHE  38  -0.415  -0.680  -5.603
  Start of MODEL   10
 7022    HD2  PHE  38           HD2      PHE  38  -0.056  -2.837  -1.951
  Start of MODEL   10
 7023    HE1  PHE  38           HE1      PHE  38   1.845  -1.410  -6.258
  Start of MODEL   10
 7024    HE2  PHE  38           HE2      PHE  38   2.196  -3.568  -2.598
  Start of MODEL   10
 7025    HZ   PHE  38           HZ       PHE  38   3.155  -2.854  -4.754
  Start of MODEL   10
 7026    H    VAL  39           H        VAL  39   0.484   0.434  -1.170
  Start of MODEL   10
 7027    HA   VAL  39           HA       VAL  39   0.885   2.698  -3.006
  Start of MODEL   10
 7028    HB   VAL  39           HB       VAL  39   2.235   2.427  -0.330
  Start of MODEL   10
 7029    H    GLY  40           H        GLY  40   2.685   2.755  -4.192
  Start of MODEL   10
 7030    HA2  GLY  40           HA2      GLY  40   4.644   0.564  -3.821
  Start of MODEL   10
 7031    HA3  GLY  40           HA3      GLY  40   3.944   0.886  -5.402
  Start of MODEL   10
 7032    H    GLY  41           H        GLY  41   6.704   0.916  -4.927
  Start of MODEL   10
 7033    HA2  GLY  41           HA2      GLY  41   8.437   2.199  -5.766
  Start of MODEL   10
 7034    HA3  GLY  41           HA3      GLY  41   7.286   3.495  -6.058
  Start of MODEL   10
 7035    H    LEU  42           H        LEU  42   7.151   2.333  -2.910
  Start of MODEL   10
 7036    HA   LEU  42           HA       LEU  42   7.943   4.822  -1.800
  Start of MODEL   10
 7037    HB2  LEU  42           HB2      LEU  42   7.255   2.151  -0.594
  Start of MODEL   10
 7038    HB3  LEU  42           HB3      LEU  42   7.667   3.541   0.387
  Start of MODEL   10
 7039    HG   LEU  42           HG       LEU  42   5.328   3.372  -1.516
  Start of MODEL   10
 7040   HD11  LEU  42          HD11      LEU  42   5.449   3.270   1.493
  Start of MODEL   10
 7041   HD13  LEU  42          HD12      LEU  42   5.048   1.930   0.421
  Start of MODEL   10
 7042   HD12  LEU  42          HD13      LEU  42   3.977   3.328   0.525
  Start of MODEL   10
 7043   HD21  LEU  42          HD21      LEU  42   6.166   5.643  -1.322
  Start of MODEL   10
 7044   HD23  LEU  42          HD22      LEU  42   6.162   5.517   0.439
  Start of MODEL   10
 7045   HD22  LEU  42          HD23      LEU  42   4.639   5.482  -0.451
  Start of MODEL   10
 7046    HA   PRO  43           HA       PRO  43  12.340   4.095  -1.288
  Start of MODEL   10
 7047    HB2  PRO  43           HB2      PRO  43  12.581   5.888   0.838
  Start of MODEL   10
 7048    HB3  PRO  43           HB3      PRO  43  12.766   6.292  -0.869
  Start of MODEL   10
 7049    HG2  PRO  43           HG2      PRO  43  10.432   6.692   0.928
  Start of MODEL   10
 7050    HG3  PRO  43           HG3      PRO  43  10.998   7.692  -0.420
  Start of MODEL   10
 7051    HD2  PRO  43           HD2      PRO  43   8.843   6.065  -0.613
  Start of MODEL   10
 7052    HD3  PRO  43           HD3      PRO  43   9.908   6.403  -1.994
  Start of MODEL   10
 7053    H    TYR  44           H        TYR  44  13.507   2.796   0.104
  Start of MODEL   10
 7054    HA   TYR  44           HA       TYR  44  11.933   1.027   1.608
  Start of MODEL   10
 7055    HB2  TYR  44           HB2      TYR  44  14.941   1.329   1.596
  Start of MODEL   10
 7056    HB3  TYR  44           HB3      TYR  44  14.055  -0.052   2.230
  Start of MODEL   10
 7057    HD1  TYR  44           HD1      TYR  44  12.331  -1.089   0.467
  Start of MODEL   10
 7058    HD2  TYR  44           HD2      TYR  44  15.829   1.118  -0.522
  Start of MODEL   10
 7059    HE1  TYR  44           HE1      TYR  44  12.349  -2.131  -1.762
  Start of MODEL   10
 7060    HE2  TYR  44           HE2      TYR  44  15.868   0.083  -2.757
  Start of MODEL   10
 7061    HH   TYR  44           HH       TYR  44  15.006  -1.951  -3.860
  Start of MODEL   10
 7062    H    HIS  45           H        HIS  45  13.831   3.801   2.603
  Start of MODEL   10
 7063    HA   HIS  45           HA       HIS  45  13.816   3.073   5.360
  Start of MODEL   10
 7064    HB2  HIS  45           HB2      HIS  45  15.086   4.953   5.778
  Start of MODEL   10
 7065    HB3  HIS  45           HB3      HIS  45  15.465   4.648   4.090
  Start of MODEL   10
 7066    HD1  HIS  45           HD1      HIS  45  14.157   7.191   6.365
  Start of MODEL   10
 7067    HD2  HIS  45           HD2      HIS  45  14.093   6.453   2.271
  Start of MODEL   10
 7068    HE1  HIS  45           HE1      HIS  45  13.454   9.358   5.293
  Start of MODEL   10
 7069    HE2  HIS  45           HE2      HIS  45  13.225   8.828   2.835
  Start of MODEL   10
 7070    H    THR  46           H        THR  46  11.338   4.316   3.423
  Start of MODEL   10
 7071    HA   THR  46           HA       THR  46  10.010   6.112   5.052
  Start of MODEL   10
 7072    HB   THR  46           HB       THR  46   8.681   3.927   3.429
  Start of MODEL   10
 7073    HG1  THR  46           HG1      THR  46   9.808   4.872   1.882
  Start of MODEL   10
 7074   HG23  THR  46          HG21      THR  46   7.145   5.201   4.845
  Start of MODEL   10
 7075   HG22  THR  46          HG22      THR  46   6.889   5.589   3.144
  Start of MODEL   10
 7076   HG21  THR  46          HG23      THR  46   7.768   6.711   4.184
  Start of MODEL   10
 7077    H    SER  47           H        SER  47   8.639   5.959   6.821
  Start of MODEL   10
 7078    HA   SER  47           HA       SER  47   8.437   3.307   8.044
  Start of MODEL   10
 7079    HB2  SER  47           HB2      SER  47   8.078   4.611  10.168
  Start of MODEL   10
 7080    HB3  SER  47           HB3      SER  47   9.672   4.825   9.442
  Start of MODEL   10
 7081    HG   SER  47           HG       SER  47   9.220   6.873   9.498
  Start of MODEL   10
 7082    H    ASP  48           H        ASP  48   6.491   2.843   9.206
  Start of MODEL   10
 7083    HA   ASP  48           HA       ASP  48   4.119   3.132   7.856
  Start of MODEL   10
 7084    HB2  ASP  48           HB2      ASP  48   4.195   2.952  10.864
  Start of MODEL   10
 7085    HB3  ASP  48           HB3      ASP  48   3.045   2.214   9.753
  Start of MODEL   10
 7086    H    LYS  49           H        LYS  49   5.533   5.200  10.282
  Start of MODEL   10
 7087    HA   LYS  49           HA       LYS  49   3.331   6.856  10.820
  Start of MODEL   10
 7088    HB2  LYS  49           HB2      LYS  49   5.326   6.839  12.216
  Start of MODEL   10
 7089    HB3  LYS  49           HB3      LYS  49   6.282   7.489  10.896
  Start of MODEL   10
 7090    HG2  LYS  49           HG2      LYS  49   5.040   9.568  10.972
  Start of MODEL   10
 7091    HG3  LYS  49           HG3      LYS  49   3.990   8.919  12.232
  Start of MODEL   10
 7092    HD2  LYS  49           HD2      LYS  49   5.687  10.362  13.213
  Start of MODEL   10
 7093    HD3  LYS  49           HD3      LYS  49   5.939   8.691  13.717
  Start of MODEL   10
 7094    HE2  LYS  49           HE2      LYS  49   8.057   9.746  13.141
  Start of MODEL   10
 7095    HE3  LYS  49           HE3      LYS  49   7.677   8.441  12.019
  Start of MODEL   10
 7096    HZ2  LYS  49           HZ1      LYS  49   8.511  10.343  10.830
  Start of MODEL   10
 7097    HZ1  LYS  49           HZ2      LYS  49   7.327  11.350  11.511
  Start of MODEL   10
 7098    HZ3  LYS  49           HZ3      LYS  49   6.877  10.116  10.442
  Start of MODEL   10
 7099    H    THR  50           H        THR  50   5.887   7.100   8.363
  Start of MODEL   10
 7100    HA   THR  50           HA       THR  50   5.146   9.627   7.352
  Start of MODEL   10
 7101    HB   THR  50           HB       THR  50   6.489   7.355   5.864
  Start of MODEL   10
 7102    HG1  THR  50           HG1      THR  50   8.029   9.406   6.915
  Start of MODEL   10
 7103   HG23  THR  50          HG21      THR  50   5.713   9.201   4.419
  Start of MODEL   10
 7104   HG22  THR  50          HG22      THR  50   7.472   9.094   4.477
  Start of MODEL   10
 7105   HG21  THR  50          HG23      THR  50   6.634  10.343   5.402
  Start of MODEL   10
 7106    H    LEU  51           H        LEU  51   4.127   6.344   6.538
  Start of MODEL   10
 7107    HA   LEU  51           HA       LEU  51   2.518   7.139   4.299
  Start of MODEL   10
 7108    HB2  LEU  51           HB2      LEU  51   2.534   4.641   5.984
  Start of MODEL   10
 7109    HB3  LEU  51           HB3      LEU  51   1.452   4.869   4.622
  Start of MODEL   10
 7110    HG   LEU  51           HG       LEU  51   4.463   4.719   4.543
  Start of MODEL   10
 7111   HD13  LEU  51          HD11      LEU  51   3.332   2.575   4.773
  Start of MODEL   10
 7112   HD12  LEU  51          HD12      LEU  51   4.040   2.738   3.165
  Start of MODEL   10
 7113   HD11  LEU  51          HD13      LEU  51   2.303   2.955   3.392
  Start of MODEL   10
 7114   HD22  LEU  51          HD21      LEU  51   4.267   4.994   2.130
  Start of MODEL   10
 7115   HD21  LEU  51          HD22      LEU  51   3.646   6.414   2.972
  Start of MODEL   10
 7116   HD23  LEU  51          HD23      LEU  51   2.527   5.236   2.285
  Start of MODEL   10
 7117    H    HIS  52           H        HIS  52   1.850   6.333   7.660
  Start of MODEL   10
 7118    HA   HIS  52           HA       HIS  52  -0.865   6.768   7.758
  Start of MODEL   10
 7119    HB2  HIS  52           HB2      HIS  52   0.358   5.940   9.683
  Start of MODEL   10
 7120    HB3  HIS  52           HB3      HIS  52   1.212   7.468   9.847
  Start of MODEL   10
 7121    HD1  HIS  52           HD1      HIS  52   0.150   9.223  11.298
  Start of MODEL   10
 7122    HD2  HIS  52           HD2      HIS  52  -2.475   6.127  10.343
  Start of MODEL   10
 7123    HE1  HIS  52           HE1      HIS  52  -1.891   9.594  12.714
  Start of MODEL   10
 7124    HE2  HIS  52           HE2      HIS  52  -3.491   7.746  12.098
  Start of MODEL   10
 7125    H    GLU  53           H        GLU  53   1.642   9.270   8.391
  Start of MODEL   10
 7126    HA   GLU  53           HA       GLU  53  -0.176  11.335   8.802
  Start of MODEL   10
 7127    HB2  GLU  53           HB2      GLU  53   2.622  11.590   7.670
  Start of MODEL   10
 7128    HB3  GLU  53           HB3      GLU  53   1.701  12.869   8.438
  Start of MODEL   10
 7129    HG2  GLU  53           HG2      GLU  53   2.818  10.398   9.723
  Start of MODEL   10
 7130    HG3  GLU  53           HG3      GLU  53   3.325  12.065   9.982
  Start of MODEL   10
 7131    H    TYR  54           H        TYR  54   1.367  10.314   5.775
  Start of MODEL   10
 7132    HA   TYR  54           HA       TYR  54   0.668  12.622   4.308
  Start of MODEL   10
 7133    HB2  TYR  54           HB2      TYR  54   2.403  10.774   3.805
  Start of MODEL   10
 7134    HB3  TYR  54           HB3      TYR  54   1.059   9.922   3.057
  Start of MODEL   10
 7135    HD1  TYR  54           HD1      TYR  54  -0.034  10.874   1.031
  Start of MODEL   10
 7136    HD2  TYR  54           HD2      TYR  54   3.422  12.657   2.761
  Start of MODEL   10
 7137    HE1  TYR  54           HE1      TYR  54   0.348  12.142  -1.046
  Start of MODEL   10
 7138    HE2  TYR  54           HE2      TYR  54   3.809  13.928   0.697
  Start of MODEL   10
 7139    HH   TYR  54           HH       TYR  54   3.272  13.726  -1.698
  Start of MODEL   10
 7140    H    PHE  55           H        PHE  55  -0.765   9.365   4.290
  Start of MODEL   10
 7141    HA   PHE  55           HA       PHE  55  -2.943  10.105   2.626
  Start of MODEL   10
 7142    HB2  PHE  55           HB2      PHE  55  -2.394   7.657   4.279
  Start of MODEL   10
 7143    HB3  PHE  55           HB3      PHE  55  -3.847   7.838   3.301
  Start of MODEL   10
 7144    HD1  PHE  55           HD1      PHE  55  -0.333   7.052   3.308
  Start of MODEL   10
 7145    HD2  PHE  55           HD2      PHE  55  -3.618   8.139   0.841
  Start of MODEL   10
 7146    HE1  PHE  55           HE1      PHE  55   0.911   6.282   1.329
  Start of MODEL   10
 7147    HE2  PHE  55           HE2      PHE  55  -2.390   7.366  -1.147
  Start of MODEL   10
 7148    HZ   PHE  55           HZ       PHE  55  -0.120   6.438  -0.907
  Start of MODEL   10
 7149    H    GLU  56           H        GLU  56  -2.421  10.272   6.011
  Start of MODEL   10
 7150    HA   GLU  56           HA       GLU  56  -5.008  10.040   7.041
  Start of MODEL   10
 7151    HB2  GLU  56           HB2      GLU  56  -2.407  10.939   7.887
  Start of MODEL   10
 7152    HB3  GLU  56           HB3      GLU  56  -3.653  11.990   8.561
  Start of MODEL   10
 7153    HG2  GLU  56           HG2      GLU  56  -3.401   9.013   8.883
  Start of MODEL   10
 7154    HG3  GLU  56           HG3      GLU  56  -3.073  10.235  10.099
  Start of MODEL   10
 7155    H    GLN  57           H        GLN  57  -3.455  12.650   5.351
  Start of MODEL   10
 7156    HA   GLN  57           HA       GLN  57  -5.223  14.706   6.213
  Start of MODEL   10
 7157    HB2  GLN  57           HB2      GLN  57  -3.435  14.600   3.780
  Start of MODEL   10
 7158    HB3  GLN  57           HB3      GLN  57  -4.226  16.041   4.404
  Start of MODEL   10
 7159    HG2  GLN  57           HG2      GLN  57  -2.187  14.400   5.891
  Start of MODEL   10
 7160    HG3  GLN  57           HG3      GLN  57  -1.859  15.905   5.037
  Start of MODEL   10
 7161   HE21  GLN  57          HE21      GLN  57  -4.322  17.190   5.846
  Start of MODEL   10
 7162   HE22  GLN  57          HE22      GLN  57  -4.147  17.580   7.523
  Start of MODEL   10
 7163    H    PHE  58           H        PHE  58  -5.691  12.108   4.108
  Start of MODEL   10
 7164    HA   PHE  58           HA       PHE  58  -7.699  13.496   2.502
  Start of MODEL   10
 7165    HB2  PHE  58           HB2      PHE  58  -6.825  10.592   2.458
  Start of MODEL   10
 7166    HB3  PHE  58           HB3      PHE  58  -8.028  11.293   1.392
  Start of MODEL   10
 7167    HD1  PHE  58           HD1      PHE  58  -4.461  11.601   2.377
  Start of MODEL   10
 7168    HD2  PHE  58           HD2      PHE  58  -7.423  12.205  -0.613
  Start of MODEL   10
 7169    HE1  PHE  58           HE1      PHE  58  -2.703  12.210   0.774
  Start of MODEL   10
 7170    HE2  PHE  58           HE2      PHE  58  -5.669  12.831  -2.228
  Start of MODEL   10
 7171    HZ   PHE  58           HZ       PHE  58  -3.307  12.828  -1.534
  Start of MODEL   10
 7172    H    GLY  59           H        GLY  59  -7.398  11.569   5.316
  Start of MODEL   10
 7173    HA2  GLY  59           HA2      GLY  59  -9.825  11.898   6.417
  Start of MODEL   10
 7174    HA3  GLY  59           HA3      GLY  59 -10.120  10.592   5.276
  Start of MODEL   10
 7175    H    ASP  60           H        ASP  60 -10.663   9.537   7.405
  Start of MODEL   10
 7176    HA   ASP  60           HA       ASP  60  -8.646   8.982   9.306
  Start of MODEL   10
 7177    HB2  ASP  60           HB2      ASP  60 -11.334   7.756   8.741
  Start of MODEL   10
 7178    HB3  ASP  60           HB3      ASP  60 -10.280   7.141  10.005
  Start of MODEL   10
 7179    H    ILE  61           H        ILE  61  -7.034   7.601   9.196
  Start of MODEL   10
 7180    HA   ILE  61           HA       ILE  61  -7.203   5.298   7.399
  Start of MODEL   10
 7181    HB   ILE  61           HB       ILE  61  -4.983   6.601   8.929
  Start of MODEL   10
 7182   HD11  ILE  61          HD11      ILE  61  -3.379   7.711   7.500
  Start of MODEL   10
 7183   HD13  ILE  61          HD12      ILE  61  -3.513   7.617   5.746
  Start of MODEL   10
 7184   HD12  ILE  61          HD13      ILE  61  -2.909   6.233   6.659
  Start of MODEL   10
 7185    H    GLU  62           H        GLU  62  -7.473   3.264   8.097
  Start of MODEL   10
 7186    HA   GLU  62           HA       GLU  62  -8.039   2.790  10.898
  Start of MODEL   10
 7187    HB2  GLU  62           HB2      GLU  62  -9.247   1.766   8.822
  Start of MODEL   10
 7188    HB3  GLU  62           HB3      GLU  62  -7.882   0.656   8.787
  Start of MODEL   10
 7189    HG2  GLU  62           HG2      GLU  62  -8.490   0.353  11.324
  Start of MODEL   10
 7190    HG3  GLU  62           HG3      GLU  62 -10.066   0.922  10.770
  Start of MODEL   10
 7191    H    GLU  63           H        GLU  63  -5.699   1.774   8.448
  Start of MODEL   10
 7192    HA   GLU  63           HA       GLU  63  -3.692   1.377  10.507
  Start of MODEL   10
 7193    HB2  GLU  63           HB2      GLU  63  -4.726  -0.844  10.353
  Start of MODEL   10
 7194    HB3  GLU  63           HB3      GLU  63  -4.481  -0.851   8.614
  Start of MODEL   10
 7195    HG2  GLU  63           HG2      GLU  63  -2.820  -2.220   9.685
  Start of MODEL   10
 7196    HG3  GLU  63           HG3      GLU  63  -2.056  -0.801   8.972
  Start of MODEL   10
 7197    H    ALA  64           H        ALA  64  -1.662   1.878   9.756
  Start of MODEL   10
 7198    HA   ALA  64           HA       ALA  64  -1.273   2.024   6.855
  Start of MODEL   10
 7199    HB2  ALA  64           HB1      ALA  64  -0.135   4.179   7.064
  Start of MODEL   10
 7200    HB1  ALA  64           HB2      ALA  64  -0.518   4.219   8.784
  Start of MODEL   10
 7201    HB3  ALA  64           HB3      ALA  64  -1.813   4.294   7.590
  Start of MODEL   10
 7202    H    VAL  65           H        VAL  65   0.395   0.763   6.402
  Start of MODEL   10
 7203    HA   VAL  65           HA       VAL  65   2.659   0.677   8.267
  Start of MODEL   10
 7204    HB   VAL  65           HB       VAL  65   2.792  -1.808   8.007
  Start of MODEL   10
 7205    H    VAL  66           H        VAL  66   4.627   0.250   7.384
  Start of MODEL   10
 7206    HA   VAL  66           HA       VAL  66   4.820   0.098   4.469
  Start of MODEL   10
 7207    HB   VAL  66           HB       VAL  66   6.988   0.302   6.580
  Start of MODEL   10
 7208    H    ILE  67           H        ILE  67   5.552  -1.762   3.386
  Start of MODEL   10
 7209    HA   ILE  67           HA       ILE  67   4.952  -4.120   4.969
  Start of MODEL   10
 7210    HB   ILE  67           HB       ILE  67   5.260  -3.777   1.985
  Start of MODEL   10
 7211   HD13  ILE  67          HD11      ILE  67   2.500  -5.275   4.150
  Start of MODEL   10
 7212   HD12  ILE  67          HD12      ILE  67   1.573  -3.774   4.112
  Start of MODEL   10
 7213   HD11  ILE  67          HD13      ILE  67   3.096  -3.848   4.997
  Start of MODEL   10
 7214    H    THR  68           H        THR  68   6.393  -5.436   5.691
  Start of MODEL   10
 7215    HA   THR  68           HA       THR  68   9.078  -5.458   4.495
  Start of MODEL   10
 7216    HB   THR  68           HB       THR  68   9.862  -6.079   6.841
  Start of MODEL   10
 7217    HG1  THR  68           HG1      THR  68   8.178  -4.932   8.368
  Start of MODEL   10
 7218   HG22  THR  68          HG21      THR  68   9.917  -3.748   7.628
  Start of MODEL   10
 7219   HG21  THR  68          HG22      THR  68   8.678  -3.328   6.444
  Start of MODEL   10
 7220   HG23  THR  68          HG23      THR  68  10.270  -3.859   5.903
  Start of MODEL   10
 7221    H    ASP  69           H        ASP  69  10.019  -7.538   4.236
  Start of MODEL   10
 7222    HA   ASP  69           HA       ASP  69   8.310  -9.669   3.829
  Start of MODEL   10
 7223    HB2  ASP  69           HB2      ASP  69  10.468  -9.604   2.769
  Start of MODEL   10
 7224    HB3  ASP  69           HB3      ASP  69  11.292  -9.643   4.326
  Start of MODEL   10
 7225    H    ARG  70           H        ARG  70   7.617 -11.337   4.981
  Start of MODEL   10
 7226    HA   ARG  70           HA       ARG  70   7.319 -11.048   7.726
  Start of MODEL   10
 7227    HB2  ARG  70           HB2      ARG  70   5.673 -12.175   6.431
  Start of MODEL   10
 7228    HB3  ARG  70           HB3      ARG  70   6.829 -13.418   5.966
  Start of MODEL   10
 7229    HG2  ARG  70           HG2      ARG  70   6.647 -13.168   8.833
  Start of MODEL   10
 7230    HG3  ARG  70           HG3      ARG  70   5.070 -13.502   8.103
  Start of MODEL   10
 7231    HD2  ARG  70           HD2      ARG  70   7.474 -15.012   7.244
  Start of MODEL   10
 7232    HD3  ARG  70           HD3      ARG  70   6.671 -15.442   8.753
  Start of MODEL   10
 7233    HE   ARG  70           HE       ARG  70   4.583 -15.556   7.233
  Start of MODEL   10
 7234   HH11  ARG  70          HH11      ARG  70   7.814 -16.501   6.242
  Start of MODEL   10
 7235   HH12  ARG  70          HH12      ARG  70   7.250 -17.684   5.105
  Start of MODEL   10
 7236   HH21  ARG  70          HH21      ARG  70   3.850 -17.125   5.773
  Start of MODEL   10
 7237   HH22  ARG  70          HH22      ARG  70   4.994 -18.064   4.856
  Start of MODEL   10
 7238    H    ASN  71           H        ASN  71   9.869 -12.752   5.975
  Start of MODEL   10
 7239    HA   ASN  71           HA       ASN  71  10.515 -14.304   8.344
  Start of MODEL   10
 7240    HB2  ASN  71           HB2      ASN  71  11.962 -14.290   5.702
  Start of MODEL   10
 7241    HB3  ASN  71           HB3      ASN  71  11.923 -15.554   6.920
  Start of MODEL   10
 7242   HD21  ASN  71          HD21      ASN  71  10.258 -14.060   4.275
  Start of MODEL   10
 7243   HD22  ASN  71          HD22      ASN  71   9.037 -15.279   4.097
  Start of MODEL   10
 7244    H    THR  72           H        THR  72  11.499 -11.384   6.894
  Start of MODEL   10
 7245    HA   THR  72           HA       THR  72  14.132 -11.521   8.199
  Start of MODEL   10
 7246    HB   THR  72           HB       THR  72  15.044 -10.168   6.278
  Start of MODEL   10
 7247    HG1  THR  72           HG1      THR  72  12.705 -11.113   4.923
  Start of MODEL   10
 7248   HG23  THR  72          HG21      THR  72  15.582 -12.516   6.453
  Start of MODEL   10
 7249   HG22  THR  72          HG22      THR  72  15.283 -12.117   4.762
  Start of MODEL   10
 7250   HG21  THR  72          HG23      THR  72  14.051 -12.961   5.701
  Start of MODEL   10
 7251    H    GLN  73           H        GLN  73  11.408  -9.807   7.273
  Start of MODEL   10
 7252    HA   GLN  73           HA       GLN  73  10.351  -7.904   8.023
  Start of MODEL   10
 7253    HB2  GLN  73           HB2      GLN  73  12.650  -7.669   9.974
  Start of MODEL   10
 7254    HB3  GLN  73           HB3      GLN  73  11.131  -6.784  10.048
  Start of MODEL   10
 7255    HG2  GLN  73           HG2      GLN  73   9.963  -8.981  10.287
  Start of MODEL   10
 7256    HG3  GLN  73           HG3      GLN  73  11.550  -9.740  10.420
  Start of MODEL   10
 7257   HE21  GLN  73          HE21      GLN  73  12.804  -9.351  12.252
  Start of MODEL   10
 7258   HE22  GLN  73          HE22      GLN  73  12.135  -8.688  13.701
  Start of MODEL   10
 7259    H    LYS  74           H        LYS  74  12.478  -8.024   5.989
  Start of MODEL   10
 7260    HA   LYS  74           HA       LYS  74  13.723  -5.403   6.094
  Start of MODEL   10
 7261    HB2  LYS  74           HB2      LYS  74  13.763  -7.554   3.969
  Start of MODEL   10
 7262    HB3  LYS  74           HB3      LYS  74  14.703  -6.068   3.913
  Start of MODEL   10
 7263    HG2  LYS  74           HG2      LYS  74  14.935  -8.177   6.053
  Start of MODEL   10
 7264    HG3  LYS  74           HG3      LYS  74  16.013  -8.012   4.666
  Start of MODEL   10
 7265    HD2  LYS  74           HD2      LYS  74  16.693  -5.807   5.426
  Start of MODEL   10
 7266    HD3  LYS  74           HD3      LYS  74  15.562  -5.904   6.780
  Start of MODEL   10
 7267    HE2  LYS  74           HE2      LYS  74  17.795  -7.882   6.348
  Start of MODEL   10
 7268    HE3  LYS  74           HE3      LYS  74  17.984  -6.419   7.310
  Start of MODEL   10
 7269    HZ3  LYS  74           HZ1      LYS  74  16.633  -7.215   8.956
  Start of MODEL   10
 7270    HZ2  LYS  74           HZ2      LYS  74  17.329  -8.667   8.415
  Start of MODEL   10
 7271    HZ1  LYS  74           HZ3      LYS  74  15.767  -8.243   7.922
  Start of MODEL   10
 7272    H    SER  75           H        SER  75  13.388  -3.832   4.320
  Start of MODEL   10
 7273    HA   SER  75           HA       SER  75  10.508  -3.454   4.166
  Start of MODEL   10
 7274    HB2  SER  75           HB2      SER  75  12.764  -1.637   3.280
  Start of MODEL   10
 7275    HB3  SER  75           HB3      SER  75  11.070  -1.188   3.485
  Start of MODEL   10
 7276    HG   SER  75           HG       SER  75  11.914  -2.318   5.739
  Start of MODEL   10
 7277    H    ARG  76           H        ARG  76   9.335  -3.924   2.392
  Start of MODEL   10
 7278    HA   ARG  76           HA       ARG  76  10.769  -5.039   0.123
  Start of MODEL   10
 7279    HB2  ARG  76           HB2      ARG  76   7.820  -5.006   0.791
  Start of MODEL   10
 7280    HB3  ARG  76           HB3      ARG  76   8.535  -5.874  -0.566
  Start of MODEL   10
 7281    HG2  ARG  76           HG2      ARG  76   9.798  -7.274   0.930
  Start of MODEL   10
 7282    HG3  ARG  76           HG3      ARG  76   9.250  -6.345   2.321
  Start of MODEL   10
 7283    HD2  ARG  76           HD2      ARG  76   8.002  -8.394   2.205
  Start of MODEL   10
 7284    HD3  ARG  76           HD3      ARG  76   6.930  -7.051   1.825
  Start of MODEL   10
 7285    HE   ARG  76           HE       ARG  76   7.040  -7.710  -0.499
  Start of MODEL   10
 7286   HH11  ARG  76          HH11      ARG  76   8.353 -10.010   1.789
  Start of MODEL   10
 7287   HH12  ARG  76          HH12      ARG  76   8.076 -11.385   0.778
  Start of MODEL   10
 7288   HH21  ARG  76          HH21      ARG  76   6.626  -9.526  -1.833
  Start of MODEL   10
 7289   HH22  ARG  76          HH22      ARG  76   7.068 -11.112  -1.287
  Start of MODEL   10
 7290    H    GLY  77           H        GLY  77  10.262  -2.040   0.723
  Start of MODEL   10
 7291    HA2  GLY  77           HA2      GLY  77  10.285  -0.186  -0.639
  Start of MODEL   10
 7292    HA3  GLY  77           HA3      GLY  77  10.213  -1.273  -2.011
  Start of MODEL   10
 7293    H    TYR  78           H        TYR  78   7.642  -1.712   0.167
  Start of MODEL   10
 7294    HA   TYR  78           HA       TYR  78   5.968   0.351  -0.929
  Start of MODEL   10
 7295    HB2  TYR  78           HB2      TYR  78   4.251  -1.223  -1.823
  Start of MODEL   10
 7296    HB3  TYR  78           HB3      TYR  78   5.742  -1.194  -2.748
  Start of MODEL   10
 7297    HD1  TYR  78           HD1      TYR  78   3.669  -3.194  -0.454
  Start of MODEL   10
 7298    HD2  TYR  78           HD2      TYR  78   7.114  -3.138  -2.942
  Start of MODEL   10
 7299    HE1  TYR  78           HE1      TYR  78   3.787  -5.648  -0.334
  Start of MODEL   10
 7300    HE2  TYR  78           HE2      TYR  78   7.256  -5.585  -2.824
  Start of MODEL   10
 7301    HH   TYR  78           HH       TYR  78   4.700  -7.508  -1.580
  Start of MODEL   10
 7302    H    GLY  79           H        GLY  79   3.661   0.077  -0.071
  Start of MODEL   10
 7303    HA2  GLY  79           HA2      GLY  79   3.568  -1.311   2.485
  Start of MODEL   10
 7304    HA3  GLY  79           HA3      GLY  79   3.576   0.447   2.566
  Start of MODEL   10
 7305    H    PHE  80           H        PHE  80   1.468  -0.384   3.695
  Start of MODEL   10
 7306    HA   PHE  80           HA       PHE  80  -0.649  -0.137   1.699
  Start of MODEL   10
 7307    HB2  PHE  80           HB2      PHE  80  -0.446  -2.259   3.809
  Start of MODEL   10
 7308    HB3  PHE  80           HB3      PHE  80  -2.018  -1.732   3.212
  Start of MODEL   10
 7309    HD1  PHE  80           HD1      PHE  80   1.060  -3.505   2.438
  Start of MODEL   10
 7310    HD2  PHE  80           HD2      PHE  80  -2.692  -2.213   0.914
  Start of MODEL   10
 7311    HE1  PHE  80           HE1      PHE  80   1.306  -5.042   0.544
  Start of MODEL   10
 7312    HE2  PHE  80           HE2      PHE  80  -2.454  -3.751  -0.985
  Start of MODEL   10
 7313    HZ   PHE  80           HZ       PHE  80  -0.525  -5.142  -1.208
  Start of MODEL   10
 7314    H    VAL  81           H        VAL  81  -2.270   1.046   2.184
  Start of MODEL   10
 7315    HA   VAL  81           HA       VAL  81  -2.598   2.006   4.951
  Start of MODEL   10
 7316    HB   VAL  81           HB       VAL  81  -2.818   3.641   2.423
  Start of MODEL   10
 7317    H    THR  82           H        THR  82  -4.467   1.431   5.787
  Start of MODEL   10
 7318    HA   THR  82           HA       THR  82  -6.647   0.663   3.973
  Start of MODEL   10
 7319    HB   THR  82           HB       THR  82  -6.290  -0.050   6.899
  Start of MODEL   10
 7320    HG1  THR  82           HG1      THR  82  -5.826  -2.185   5.986
  Start of MODEL   10
 7321   HG22  THR  82          HG21      THR  82  -8.077  -1.664   6.493
  Start of MODEL   10
 7322   HG21  THR  82          HG22      THR  82  -8.197  -1.136   4.812
  Start of MODEL   10
 7323   HG23  THR  82          HG23      THR  82  -8.624  -0.030   6.122
  Start of MODEL   10
 7324    H    MET  83           H        MET  83  -8.048   2.316   3.752
  Start of MODEL   10
 7325    HA   MET  83           HA       MET  83  -8.084   4.417   5.734
  Start of MODEL   10
 7326    HB2  MET  83           HB2      MET  83  -9.681   4.152   3.184
  Start of MODEL   10
 7327    HB3  MET  83           HB3      MET  83  -9.529   5.601   4.169
  Start of MODEL   10
 7328    HG2  MET  83           HG2      MET  83  -7.263   4.234   2.738
  Start of MODEL   10
 7329    HG3  MET  83           HG3      MET  83  -8.135   5.646   2.150
  Start of MODEL   10
 7330    HE3  MET  83           HE1      MET  83  -7.953   8.032   3.150
  Start of MODEL   10
 7331    HE2  MET  83           HE2      MET  83  -7.081   8.430   4.634
  Start of MODEL   10
 7332    HE1  MET  83           HE3      MET  83  -8.544   7.445   4.706
  Start of MODEL   10
 7333    H    LYS  84           H        LYS  84  -9.755   5.026   6.955
  Start of MODEL   10
 7334    HA   LYS  84           HA       LYS  84 -11.471   2.972   7.920
  Start of MODEL   10
 7335    HB2  LYS  84           HB2      LYS  84 -10.396   5.045   9.104
  Start of MODEL   10
 7336    HB3  LYS  84           HB3      LYS  84 -11.831   5.887   8.547
  Start of MODEL   10
 7337    HG2  LYS  84           HG2      LYS  84 -13.248   4.425   9.810
  Start of MODEL   10
 7338    HG3  LYS  84           HG3      LYS  84 -11.874   3.414  10.264
  Start of MODEL   10
 7339    HD2  LYS  84           HD2      LYS  84 -12.252   6.316  11.006
  Start of MODEL   10
 7340    HD3  LYS  84           HD3      LYS  84 -12.504   4.939  12.078
  Start of MODEL   10
 7341    HE2  LYS  84           HE2      LYS  84 -10.191   4.380  12.039
  Start of MODEL   10
 7342    HE3  LYS  84           HE3      LYS  84  -9.875   5.514  10.727
  Start of MODEL   10
 7343    HZ1  LYS  84           HZ1      LYS  84 -10.769   6.314  13.456
  Start of MODEL   10
 7344    HZ3  LYS  84           HZ2      LYS  84 -10.302   7.351  12.197
  Start of MODEL   10
 7345    HZ2  LYS  84           HZ3      LYS  84  -9.156   6.328  12.925
  Start of MODEL   10
 7346    H    ASP  85           H        ASP  85 -11.739   5.273   5.400
  Start of MODEL   10
 7347    HA   ASP  85           HA       ASP  85 -14.534   4.560   5.020
  Start of MODEL   10
 7348    HB2  ASP  85           HB2      ASP  85 -14.636   6.695   6.201
  Start of MODEL   10
 7349    HB3  ASP  85           HB3      ASP  85 -13.565   7.427   5.008
  Start of MODEL   10
 7350    H    ARG  86           H        ARG  86 -15.250   4.625   2.900
  Start of MODEL   10
 7351    HA   ARG  86           HA       ARG  86 -13.444   3.975   0.907
  Start of MODEL   10
 7352    HB2  ARG  86           HB2      ARG  86 -15.729   3.214   0.884
  Start of MODEL   10
 7353    HB3  ARG  86           HB3      ARG  86 -16.329   4.860   0.784
  Start of MODEL   10
 7354    HG2  ARG  86           HG2      ARG  86 -15.335   5.062  -1.464
  Start of MODEL   10
 7355    HG3  ARG  86           HG3      ARG  86 -14.812   3.378  -1.356
  Start of MODEL   10
 7356    HD2  ARG  86           HD2      ARG  86 -17.152   2.684  -1.072
  Start of MODEL   10
 7357    HD3  ARG  86           HD3      ARG  86 -17.665   4.362  -1.222
  Start of MODEL   10
 7358    HE   ARG  86           HE       ARG  86 -16.131   3.481  -3.470
  Start of MODEL   10
 7359   HH11  ARG  86          HH11      ARG  86 -19.324   3.588  -2.051
  Start of MODEL   10
 7360   HH12  ARG  86          HH12      ARG  86 -20.144   3.299  -3.554
  Start of MODEL   10
 7361   HH21  ARG  86          HH21      ARG  86 -17.207   3.112  -5.470
  Start of MODEL   10
 7362   HH22  ARG  86          HH22      ARG  86 -18.941   2.969  -5.490
  Start of MODEL   10
 7363    H    ALA  87           H        ALA  87 -15.043   7.088   1.532
  Start of MODEL   10
 7364    HA   ALA  87           HA       ALA  87 -14.374   8.211  -0.998
  Start of MODEL   10
 7365    HB3  ALA  87           HB1      ALA  87 -16.230   9.082   0.321
  Start of MODEL   10
 7366    HB2  ALA  87           HB2      ALA  87 -15.051  10.355  -0.007
  Start of MODEL   10
 7367    HB1  ALA  87           HB3      ALA  87 -15.110   9.593   1.584
  Start of MODEL   10
 7368    H    SER  88           H        SER  88 -12.884   8.371   2.198
  Start of MODEL   10
 7369    HA   SER  88           HA       SER  88 -10.878  10.228   1.562
  Start of MODEL   10
 7370    HB2  SER  88           HB2      SER  88 -10.696   7.967   3.567
  Start of MODEL   10
 7371    HB3  SER  88           HB3      SER  88  -9.816   9.496   3.600
  Start of MODEL   10
 7372    HG   SER  88           HG       SER  88 -11.749  10.576   3.984
  Start of MODEL   10
 7373    H    ALA  89           H        ALA  89 -11.020   6.709   1.370
  Start of MODEL   10
 7374    HA   ALA  89           HA       ALA  89  -8.353   6.238   0.595
  Start of MODEL   10
 7375    HB3  ALA  89           HB1      ALA  89  -9.785   4.440   1.369
  Start of MODEL   10
 7376    HB2  ALA  89           HB2      ALA  89  -9.195   4.080  -0.253
  Start of MODEL   10
 7377    HB1  ALA  89           HB3      ALA  89 -10.846   4.654  -0.022
  Start of MODEL   10
 7378    H    GLU  90           H        GLU  90 -11.269   6.908  -1.284
  Start of MODEL   10
 7379    HA   GLU  90           HA       GLU  90 -10.079   6.396  -3.790
  Start of MODEL   10
 7380    HB2  GLU  90           HB2      GLU  90 -12.582   6.474  -3.187
  Start of MODEL   10
 7381    HB3  GLU  90           HB3      GLU  90 -12.443   8.211  -3.436
  Start of MODEL   10
 7382    HG2  GLU  90           HG2      GLU  90 -11.296   6.570  -5.573
  Start of MODEL   10
 7383    HG3  GLU  90           HG3      GLU  90 -13.037   6.405  -5.365
  Start of MODEL   10
 7384    H    ARG  91           H        ARG  91 -10.547   9.394  -1.919
  Start of MODEL   10
 7385    HA   ARG  91           HA       ARG  91  -9.669  11.194  -3.849
  Start of MODEL   10
 7386    HB2  ARG  91           HB2      ARG  91  -9.189  11.299  -0.859
  Start of MODEL   10
 7387    HB3  ARG  91           HB3      ARG  91  -9.030  12.660  -1.957
  Start of MODEL   10
 7388    HG2  ARG  91           HG2      ARG  91 -11.571  11.166  -1.350
  Start of MODEL   10
 7389    HG3  ARG  91           HG3      ARG  91 -11.115  12.747  -0.716
  Start of MODEL   10
 7390    HD2  ARG  91           HD2      ARG  91 -11.500  12.102  -3.637
  Start of MODEL   10
 7391    HD3  ARG  91           HD3      ARG  91 -12.685  12.909  -2.612
  Start of MODEL   10
 7392    HE   ARG  91           HE       ARG  91 -10.580  14.513  -2.306
  Start of MODEL   10
 7393   HH11  ARG  91          HH11      ARG  91 -11.915  13.102  -5.243
  Start of MODEL   10
 7394   HH12  ARG  91          HH12      ARG  91 -11.447  14.458  -6.232
  Start of MODEL   10
 7395   HH21  ARG  91          HH21      ARG  91  -9.963  16.269  -3.618
  Start of MODEL   10
 7396   HH22  ARG  91          HH22      ARG  91 -10.346  16.240  -5.319
  Start of MODEL   10
 7397    H    ALA  92           H        ALA  92  -7.858   9.332  -1.466
  Start of MODEL   10
 7398    HA   ALA  92           HA       ALA  92  -5.285  10.211  -2.091
  Start of MODEL   10
 7399    HB1  ALA  92           HB1      ALA  92  -6.118   7.464  -1.183
  Start of MODEL   10
 7400    HB3  ALA  92           HB2      ALA  92  -5.803   8.846  -0.134
  Start of MODEL   10
 7401    HB2  ALA  92           HB3      ALA  92  -4.495   8.145  -1.088
  Start of MODEL   10
 7402    H    CYS  93           H        CYS  93  -7.253   7.707  -3.606
  Start of MODEL   10
 7403    HA   CYS  93           HA       CYS  93  -5.073   6.790  -5.256
  Start of MODEL   10
 7404    HB2  CYS  93           HB2      CYS  93  -7.998   6.045  -5.300
  Start of MODEL   10
 7405    HB3  CYS  93           HB3      CYS  93  -6.704   5.204  -6.150
  Start of MODEL   10
 7406    HG   CYS  93           HG       CYS  93  -7.270   5.331  -2.788
  Start of MODEL   10
 7407    H    LYS  94           H        LYS  94  -7.304   9.345  -5.527
  Start of MODEL   10
 7408    HA   LYS  94           HA       LYS  94  -7.870   9.236  -8.276
  Start of MODEL   10
 7409    HB2  LYS  94           HB2      LYS  94  -9.070  10.655  -6.605
  Start of MODEL   10
 7410    HB3  LYS  94           HB3      LYS  94  -7.665  11.706  -6.537
  Start of MODEL   10
 7411    HG2  LYS  94           HG2      LYS  94  -8.944  11.172  -9.174
  Start of MODEL   10
 7412    HG3  LYS  94           HG3      LYS  94  -9.718  12.289  -8.050
  Start of MODEL   10
 7413    HD2  LYS  94           HD2      LYS  94  -7.798  13.711  -8.031
  Start of MODEL   10
 7414    HD3  LYS  94           HD3      LYS  94  -6.836  12.522  -8.906
  Start of MODEL   10
 7415    HE2  LYS  94           HE2      LYS  94  -9.294  13.848 -10.031
  Start of MODEL   10
 7416    HE3  LYS  94           HE3      LYS  94  -7.655  14.445 -10.289
  Start of MODEL   10
 7417    HZ2  LYS  94           HZ1      LYS  94  -8.559  12.995 -12.096
  Start of MODEL   10
 7418    HZ1  LYS  94           HZ2      LYS  94  -8.507  11.692 -11.007
  Start of MODEL   10
 7419    HZ3  LYS  94           HZ3      LYS  94  -7.077  12.482 -11.451
  Start of MODEL   10
 7420    H    ASP  95           H        ASP  95  -5.189  10.686  -6.477
  Start of MODEL   10
 7421    HA   ASP  95           HA       ASP  95  -3.863  11.185  -9.062
  Start of MODEL   10
 7422    HB2  ASP  95           HB2      ASP  95  -4.094  13.123  -7.385
  Start of MODEL   10
 7423    HB3  ASP  95           HB3      ASP  95  -2.918  12.257  -6.398
  Start of MODEL   10
 7424    HA   PRO  96           HA       PRO  96  -2.187   7.267  -7.671
  Start of MODEL   10
 7425    HB2  PRO  96           HB2      PRO  96  -1.070   6.551 -10.030
  Start of MODEL   10
 7426    HB3  PRO  96           HB3      PRO  96  -2.805   6.443  -9.709
  Start of MODEL   10
 7427    HG2  PRO  96           HG2      PRO  96  -1.276   8.571 -11.164
  Start of MODEL   10
 7428    HG3  PRO  96           HG3      PRO  96  -2.811   7.803 -11.607
  Start of MODEL   10
 7429    HD2  PRO  96           HD2      PRO  96  -2.683  10.239 -10.443
  Start of MODEL   10
 7430    HD3  PRO  96           HD3      PRO  96  -4.025   9.115 -10.152
  Start of MODEL   10
 7431    H    ASN  97           H        ASN  97  -0.399  10.045  -8.392
  Start of MODEL   10
 7432    HA   ASN  97           HA       ASN  97   2.076   8.643  -7.670
  Start of MODEL   10
 7433    HB2  ASN  97           HB2      ASN  97   1.714  10.445 -10.048
  Start of MODEL   10
 7434    HB3  ASN  97           HB3      ASN  97   3.292  10.195  -9.314
  Start of MODEL   10
 7435   HD21  ASN  97          HD21      ASN  97   2.738   7.407  -8.629
  Start of MODEL   10
 7436   HD22  ASN  97          HD22      ASN  97   2.817   6.539 -10.124
  Start of MODEL   10
 7437    HA   PRO  98           HA       PRO  98   1.697  12.611  -5.269
  Start of MODEL   10
 7438    HB2  PRO  98           HB2      PRO  98   1.692  11.525  -2.803
  Start of MODEL   10
 7439    HB3  PRO  98           HB3      PRO  98   0.203  11.791  -3.717
  Start of MODEL   10
 7440    HG2  PRO  98           HG2      PRO  98   1.770   9.272  -3.337
  Start of MODEL   10
 7441    HG3  PRO  98           HG3      PRO  98   0.013   9.508  -3.331
  Start of MODEL   10
 7442    HD2  PRO  98           HD2      PRO  98   1.406   8.536  -5.481
  Start of MODEL   10
 7443    HD3  PRO  98           HD3      PRO  98  -0.123   9.429  -5.627
  Start of MODEL   10
 7444    H    ILE  99           H        ILE  99   3.519  13.585  -4.441
  Start of MODEL   10
 7445    HA   ILE  99           HA       ILE  99   5.956  12.020  -4.475
  Start of MODEL   10
 7446    HB   ILE  99           HB       ILE  99   5.546  14.968  -3.936
  Start of MODEL   10
 7447   HD13  ILE  99          HD11      ILE  99   7.742  13.155  -6.419
  Start of MODEL   10
 7448   HD12  ILE  99          HD12      ILE  99   6.614  13.396  -7.756
  Start of MODEL   10
 7449   HD11  ILE  99          HD13      ILE  99   6.219  12.267  -6.461
  Start of MODEL   10
 7450    H    ILE 100           H        ILE 100   6.471  10.877  -2.770
  Start of MODEL   10
 7451    HA   ILE 100           HA       ILE 100   5.978  12.002  -0.084
  Start of MODEL   10
 7452    HB   ILE 100           HB       ILE 100   6.055   9.073  -0.843
  Start of MODEL   10
 7453   HD12  ILE 100          HD11      ILE 100   2.318   8.882  -0.630
  Start of MODEL   10
 7454   HD11  ILE 100          HD12      ILE 100   3.436   8.459   0.667
  Start of MODEL   10
 7455   HD13  ILE 100          HD13      ILE 100   3.759   7.928  -0.983
  Start of MODEL   10
 7456    H    ASP 101           H        ASP 101   7.786  12.499   0.937
  Start of MODEL   10
 7457    HA   ASP 101           HA       ASP 101   9.963  12.552   1.628
  Start of MODEL   10
 7458    HB2  ASP 101           HB2      ASP 101   9.410  10.185   2.291
  Start of MODEL   10
 7459    HB3  ASP 101           HB3      ASP 101  10.084   9.653   0.758
  Start of MODEL   10
 7460    H    GLY 102           H        GLY 102   9.317  13.344  -1.014
  Start of MODEL   10
 7461    HA2  GLY 102           HA2      GLY 102  10.495  14.183  -2.810
  Start of MODEL   10
 7462    HA3  GLY 102           HA3      GLY 102  11.947  13.463  -2.133
  Start of MODEL   10
 7463    H    ARG 103           H        ARG 103   9.600  11.106  -2.349
  Start of MODEL   10
 7464    HA   ARG 103           HA       ARG 103  10.675  10.213  -4.939
  Start of MODEL   10
 7465    HB2  ARG 103           HB2      ARG 103  11.378   8.781  -3.131
  Start of MODEL   10
 7466    HB3  ARG 103           HB3      ARG 103   9.736   8.664  -2.517
  Start of MODEL   10
 7467    HG2  ARG 103           HG2      ARG 103  10.337   6.624  -3.630
  Start of MODEL   10
 7468    HG3  ARG 103           HG3      ARG 103   9.089   7.451  -4.561
  Start of MODEL   10
 7469    HD2  ARG 103           HD2      ARG 103  10.798   8.308  -6.085
  Start of MODEL   10
 7470    HD3  ARG 103           HD3      ARG 103  12.046   7.491  -5.145
  Start of MODEL   10
 7471    HE   ARG 103           HE       ARG 103  10.204   5.560  -5.894
  Start of MODEL   10
 7472   HH11  ARG 103          HH11      ARG 103  12.315   7.823  -7.530
  Start of MODEL   10
 7473   HH12  ARG 103          HH12      ARG 103  12.668   6.746  -8.843
  Start of MODEL   10
 7474   HH21  ARG 103          HH21      ARG 103  10.657   4.141  -7.657
  Start of MODEL   10
 7475   HH22  ARG 103          HH22      ARG 103  11.749   4.660  -8.903
  Start of MODEL   10
 7476    H    LYS 104           H        LYS 104   9.284   9.601  -6.528
  Start of MODEL   10
 7477    HA   LYS 104           HA       LYS 104   6.483  10.144  -6.283
  Start of MODEL   10
 7478    HB2  LYS 104           HB2      LYS 104   7.559  10.486  -8.431
  Start of MODEL   10
 7479    HB3  LYS 104           HB3      LYS 104   8.098   8.814  -8.470
  Start of MODEL   10
 7480    HG2  LYS 104           HG2      LYS 104   5.725   8.103  -8.530
  Start of MODEL   10
 7481    HG3  LYS 104           HG3      LYS 104   5.262   9.800  -8.644
  Start of MODEL   10
 7482    HD2  LYS 104           HD2      LYS 104   7.079   8.418 -10.614
  Start of MODEL   10
 7483    HD3  LYS 104           HD3      LYS 104   5.336   8.569 -10.824
  Start of MODEL   10
 7484    HE2  LYS 104           HE2      LYS 104   6.091  10.369 -12.032
  Start of MODEL   10
 7485    HE3  LYS 104           HE3      LYS 104   5.792  11.108 -10.462
  Start of MODEL   10
 7486    HZ3  LYS 104           HZ1      LYS 104   8.174  10.864  -9.972
  Start of MODEL   10
 7487    HZ2  LYS 104           HZ2      LYS 104   7.895  11.834 -11.333
  Start of MODEL   10
 7488    HZ1  LYS 104           HZ3      LYS 104   8.428  10.235 -11.527
  Start of MODEL   10
 7489    H    ALA 105           H        ALA 105   5.072   8.806  -5.326
  Start of MODEL   10
 7490    HA   ALA 105           HA       ALA 105   5.673   5.937  -5.313
  Start of MODEL   10
 7491    HB2  ALA 105           HB1      ALA 105   3.708   7.480  -3.630
  Start of MODEL   10
 7492    HB1  ALA 105           HB2      ALA 105   5.340   7.032  -3.136
  Start of MODEL   10
 7493    HB3  ALA 105           HB3      ALA 105   4.138   5.778  -3.449
  Start of MODEL   10
 7494    H    ASN 106           H        ASN 106   3.919   4.450  -5.665
  Start of MODEL   10
 7495    HA   ASN 106           HA       ASN 106   1.962   5.457  -7.623
  Start of MODEL   10
 7496    HB2  ASN 106           HB2      ASN 106   2.950   2.632  -7.115
  Start of MODEL   10
 7497    HB3  ASN 106           HB3      ASN 106   1.792   3.100  -8.353
  Start of MODEL   10
 7498   HD21  ASN 106          HD21      ASN 106   2.514   3.859 -10.267
  Start of MODEL   10
 7499   HD22  ASN 106          HD22      ASN 106   4.178   4.066 -10.667
  Start of MODEL   10
 7500    H    VAL 107           H        VAL 107   0.036   5.843  -6.682
  Start of MODEL   10
 7501    HA   VAL 107           HA       VAL 107  -0.849   3.980  -4.582
  Start of MODEL   10
 7502    HB   VAL 107           HB       VAL 107  -1.689   6.851  -5.003
  Start of MODEL   10
 7503    H    ASN 108           H        ASN 108  -2.550   2.766  -4.963
  Start of MODEL   10
 7504    HA   ASN 108           HA       ASN 108  -4.839   3.765  -6.409
  Start of MODEL   10
 7505    HB2  ASN 108           HB2      ASN 108  -4.940   1.881  -7.996
  Start of MODEL   10
 7506    HB3  ASN 108           HB3      ASN 108  -3.507   2.864  -8.264
  Start of MODEL   10
 7507   HD21  ASN 108          HD21      ASN 108  -4.713  -0.221  -7.202
  Start of MODEL   10
 7508   HD22  ASN 108          HD22      ASN 108  -3.187  -1.033  -7.201
  Start of MODEL   10
 7509    H    LEU 109           H        LEU 109  -6.745   2.483  -6.022
  Start of MODEL   10
 7510    HA   LEU 109           HA       LEU 109  -6.926   1.167  -3.596
  Start of MODEL   10
 7511    HB2  LEU 109           HB2      LEU 109  -8.611   0.815  -6.078
  Start of MODEL   10
 7512    HB3  LEU 109           HB3      LEU 109  -9.027   0.148  -4.508
  Start of MODEL   10
 7513    HG   LEU 109           HG       LEU 109  -8.735   3.089  -5.134
  Start of MODEL   10
 7514   HD12  LEU 109          HD11      LEU 109 -11.156   3.176  -4.794
  Start of MODEL   10
 7515   HD11  LEU 109          HD12      LEU 109 -11.193   1.422  -4.611
  Start of MODEL   10
 7516   HD13  LEU 109          HD13      LEU 109 -10.729   2.139  -6.154
  Start of MODEL   10
 7517   HD21  LEU 109          HD21      LEU 109  -8.104   2.585  -2.846
  Start of MODEL   10
 7518   HD23  LEU 109          HD22      LEU 109  -9.595   1.673  -2.617
  Start of MODEL   10
 7519   HD22  LEU 109          HD23      LEU 109  -9.657   3.414  -2.887
  Start of MODEL   10
 7520    H    ALA 110           H        ALA 110  -6.494  -0.832  -2.884
  Start of MODEL   10
 7521    HA   ALA 110           HA       ALA 110  -4.467  -2.176  -4.302
  Start of MODEL   10
 7522    HB2  ALA 110           HB1      ALA 110  -5.911  -3.064  -1.809
  Start of MODEL   10
 7523    HB1  ALA 110           HB2      ALA 110  -4.512  -1.987  -1.864
  Start of MODEL   10
 7524    HB3  ALA 110           HB3      ALA 110  -4.357  -3.667  -2.390
  Start of MODEL   10
 7525    H    TYR 111           H        TYR 111  -7.897  -2.841  -4.063
  Start of MODEL   10
 7526    HA   TYR 111           HA       TYR 111  -7.734  -5.576  -4.803
  Start of MODEL   10
 7527    HB2  TYR 111           HB2      TYR 111 -10.073  -5.564  -4.951
  Start of MODEL   10
 7528    HB3  TYR 111           HB3      TYR 111  -9.716  -4.360  -3.723
  Start of MODEL   10
 7529    HD1  TYR 111           HD1      TYR 111  -9.209  -1.917  -5.091
  Start of MODEL   10
 7530    HD2  TYR 111           HD2      TYR 111 -11.923  -5.013  -6.156
  Start of MODEL   10
 7531    HE1  TYR 111           HE1      TYR 111 -10.586  -0.284  -6.312
  Start of MODEL   10
 7532    HE2  TYR 111           HE2      TYR 111 -13.303  -3.392  -7.382
  Start of MODEL   10
 7533    HH   TYR 111           HH       TYR 111 -12.226  -0.315  -8.205
  Start of MODEL   10
 7534    H    LEU 112           H        LEU 112  -7.290  -2.729  -6.592
  Start of MODEL   10
 7535    HA   LEU 112           HA       LEU 112  -8.151  -3.627  -9.145
  Start of MODEL   10
 7536    HB2  LEU 112           HB2      LEU 112  -6.231  -1.457  -8.337
  Start of MODEL   10
 7537    HB3  LEU 112           HB3      LEU 112  -6.768  -1.728  -9.985
  Start of MODEL   10
 7538    HG   LEU 112           HG       LEU 112  -8.542  -0.990  -7.656
  Start of MODEL   10
 7539   HD11  LEU 112          HD11      LEU 112  -7.637   0.609 -10.048
  Start of MODEL   10
 7540   HD13  LEU 112          HD12      LEU 112  -7.119   0.851  -8.380
  Start of MODEL   10
 7541   HD12  LEU 112          HD13      LEU 112  -8.798   1.136  -8.832
  Start of MODEL   10
 7542   HD23  LEU 112          HD21      LEU 112  -9.207  -1.257 -10.579
  Start of MODEL   10
 7543   HD22  LEU 112          HD22      LEU 112 -10.320  -0.858  -9.267
  Start of MODEL   10
 7544   HD21  LEU 112          HD23      LEU 112  -9.582  -2.461  -9.347
  Start of MODEL   10
 7545    H    GLY 113           H        GLY 113  -5.588  -4.710  -7.294
  Start of MODEL   10
 7546    HA2  GLY 113           HA2      GLY 113  -4.252  -5.784  -9.653
  Start of MODEL   10
 7547    HA3  GLY 113           HA3      GLY 113  -3.285  -4.740  -8.621
  Start of MODEL   10
 7548    H    ALA 114           H        ALA 114  -5.659  -6.559  -6.982
  Start of MODEL   10
 7549    HA   ALA 114           HA       ALA 114  -3.624  -7.997  -5.558
  Start of MODEL   10
 7550    HB1  ALA 114           HB1      ALA 114  -6.626  -8.097  -5.292
  Start of MODEL   10
 7551    HB3  ALA 114           HB2      ALA 114  -5.533  -7.062  -4.370
  Start of MODEL   10
 7552    HB2  ALA 114           HB3      ALA 114  -5.468  -8.814  -4.172
  Start of MODEL   10
 7553    H    LYS 115           H        LYS 115  -3.000 -10.039  -5.814
  Start of MODEL   10
 7554    HA   LYS 115           HA       LYS 115  -4.000 -11.581  -8.029
  Start of MODEL   10
 7555    HB2  LYS 115           HB2      LYS 115  -1.858 -12.106  -5.961
  Start of MODEL   10
 7556    HB3  LYS 115           HB3      LYS 115  -2.277 -13.263  -7.216
  Start of MODEL   10
 7557    HG2  LYS 115           HG2      LYS 115  -1.553 -11.773  -8.931
  Start of MODEL   10
 7558    HG3  LYS 115           HG3      LYS 115  -1.357 -10.455  -7.773
  Start of MODEL   10
 7559    HD2  LYS 115           HD2      LYS 115   0.450 -11.613  -6.685
  Start of MODEL   10
 7560    HD3  LYS 115           HD3      LYS 115   0.199 -13.040  -7.692
  Start of MODEL   10
 7561    HE2  LYS 115           HE2      LYS 115   0.961 -10.324  -8.762
  Start of MODEL   10
 7562    HE3  LYS 115           HE3      LYS 115   2.124 -11.591  -8.378
  Start of MODEL   10
 7563    HZ3  LYS 115           HZ1      LYS 115   1.657 -11.675 -10.701
  Start of MODEL   10
 7564    HZ2  LYS 115           HZ2      LYS 115  -0.017 -11.690 -10.438
  Start of MODEL   10
 7565    HZ1  LYS 115           HZ3      LYS 115   0.923 -13.027  -9.988
  Start of MODEL   10
 7566    HA   PRO 116           HA       PRO 116  -7.014 -13.815  -5.688
  Start of MODEL   10
 7567    HB2  PRO 116           HB2      PRO 116  -7.630 -15.696  -7.512
  Start of MODEL   10
 7568    HB3  PRO 116           HB3      PRO 116  -8.086 -14.002  -7.721
  Start of MODEL   10
 7569    HG2  PRO 116           HG2      PRO 116  -5.795 -15.506  -8.920
  Start of MODEL   10
 7570    HG3  PRO 116           HG3      PRO 116  -6.897 -14.352  -9.691
  Start of MODEL   10
 7571    HD2  PRO 116           HD2      PRO 116  -4.392 -13.686  -8.837
  Start of MODEL   10
 7572    HD3  PRO 116           HD3      PRO 116  -5.736 -12.531  -8.905
  Start of MODEL   10
 7573    H    ARG 117           H        ARG 117  -4.276 -14.478  -5.089
  Start of MODEL   10
 7574    HA   ARG 117           HA       ARG 117  -4.387 -17.401  -4.790
  Start of MODEL   10
 7575    HB2  ARG 117           HB2      ARG 117  -2.248 -16.538  -5.603
  Start of MODEL   10
 7576    HB3  ARG 117           HB3      ARG 117  -2.151 -15.425  -4.247
  Start of MODEL   10
 7577    HG2  ARG 117           HG2      ARG 117  -0.675 -17.289  -3.878
  Start of MODEL   10
 7578    HG3  ARG 117           HG3      ARG 117  -1.993 -17.329  -2.708
  Start of MODEL   10
 7579    HD2  ARG 117           HD2      ARG 117  -3.148 -18.980  -4.205
  Start of MODEL   10
 7580    HD3  ARG 117           HD3      ARG 117  -1.671 -19.046  -5.168
  Start of MODEL   10
 7581    HE   ARG 117           HE       ARG 117  -1.822 -19.825  -2.313
  Start of MODEL   10
 7582   HH11  ARG 117          HH11      ARG 117  -0.563 -20.272  -5.549
  Start of MODEL   10
 7583   HH12  ARG 117          HH12      ARG 117   0.447 -21.616  -5.107
  Start of MODEL   10
 7584   HH21  ARG 117          HH21      ARG 117  -0.502 -21.629  -1.744
  Start of MODEL   10
 7585   HH22  ARG 117          HH22      ARG 117   0.496 -22.373  -2.952
  Start of MODEL   10
 7586    H    THR 118           H        THR 118  -5.186 -14.548  -3.301
  Start of MODEL   10
 7587    HA   THR 118           HA       THR 118  -5.990 -13.976  -1.271
  Start of MODEL   10
 7588    HB   THR 118           HB       THR 118  -5.631 -16.845  -0.393
  Start of MODEL   10
 7589    HG1  THR 118           HG1      THR 118  -6.980 -17.041  -2.113
  Start of MODEL   10
 7590   HG22  THR 118          HG21      THR 118  -7.453 -16.303   1.147
  Start of MODEL   10
 7591   HG21  THR 118          HG22      THR 118  -7.517 -14.662   0.503
  Start of MODEL   10
 7592   HG23  THR 118          HG23      THR 118  -6.089 -15.207   1.386
  Start of MODEL   10
 7593    H    ASN 119           H        ASN 119  -4.442 -12.638  -0.520
  Start of MODEL   10
 7594    HA   ASN 119           HA       ASN 119  -1.974 -13.726   0.541
  Start of MODEL   10
 7595    HB2  ASN 119           HB2      ASN 119  -1.221 -11.459   0.803
  Start of MODEL   10
 7596    HB3  ASN 119           HB3      ASN 119  -1.980 -11.599  -0.776
  Start of MODEL   10
 7597   HD21  ASN 119          HD21      ASN 119  -1.489  -9.309   1.027
  Start of MODEL   10
 7598   HD22  ASN 119          HD22      ASN 119  -3.030  -8.557   1.230
  Start of MODEL   10
 7599    H    VAL 120           H        VAL 120  -1.260 -12.638   2.705
  Start of MODEL   10
 7600    HA   VAL 120           HA       VAL 120  -1.452 -12.714   4.961
  Start of MODEL   10
 7601    HB   VAL 120           HB       VAL 120  -4.442 -12.548   4.519
  Start of MODEL   10
 7602    H    GLN 121           H        GLN 121  -0.896 -14.548   5.871
  Start of MODEL   10
 7603    HA   GLN 121           HA       GLN 121  -1.934 -17.036   4.857
  Start of MODEL   10
 7604    HB2  GLN 121           HB2      GLN 121  -0.193 -18.054   6.271
  Start of MODEL   10
 7605    HB3  GLN 121           HB3      GLN 121   0.455 -16.798   5.221
  Start of MODEL   10
 7606    HG2  GLN 121           HG2      GLN 121   0.469 -15.228   7.071
  Start of MODEL   10
 7607    HG3  GLN 121           HG3      GLN 121  -0.241 -16.450   8.127
  Start of MODEL   10
 7608   HE21  GLN 121          HE21      GLN 121   1.006 -18.206   8.765
  Start of MODEL   10
 7609   HE22  GLN 121          HE22      GLN 121   2.738 -18.157   8.705
  Start of MODEL   10
 7610    H5'   DG   1           H5'       DG   1  13.509  -8.976  -2.549
  Start of MODEL   10
 7611    H4'   DG   1           H4'       DG   1  13.079  -7.263  -4.259
  Start of MODEL   10
 7612    H3'   DG   1           H3'       DG   1  15.684  -6.772  -4.539
  Start of MODEL   10
 7613    H2'   DG   1           H2'       DG   1  16.163  -5.986  -2.317
  Start of MODEL   10
 7614    H1'   DG   1           H1'       DG   1  13.579  -4.372  -2.329
  Start of MODEL   10
 7615    H8    DG   1           H8        DG   1  13.132  -6.902   0.077
  Start of MODEL   10
 7616    H1    DG   1           H1        DG   1  16.836  -2.245   2.487
  Start of MODEL   10
 7617    H22   DG   1           H21       DG   1  17.312  -1.356  -0.831
  Start of MODEL   10
 7618    H21   DG   1           H22       DG   1  17.675  -1.031   0.851
  Start of MODEL   10
 7619   HO5'   DG   1           H5T       DG   1  15.266  -7.490  -1.613
  Start of MODEL   10
 7620   H5''   DG   1          5H''       DG   1  14.660  -9.012  -3.893
  Start of MODEL   10
 7621   H2''   DG   1          2H''       DG   1  15.821  -4.466  -3.130
  Start of MODEL   10
 7622    H5'   DG   2           H5'       DG   2  15.180  -3.458  -8.751
  Start of MODEL   10
 7623    H4'   DG   2           H4'       DG   2  12.937  -2.557  -8.819
  Start of MODEL   10
 7624    H3'   DG   2           H3'       DG   2  14.894  -1.466 -10.277
  Start of MODEL   10
 7625    H2'   DG   2           H2'       DG   2  15.614   0.166  -8.632
  Start of MODEL   10
 7626    H1'   DG   2           H1'       DG   2  12.651   0.788  -8.157
  Start of MODEL   10
 7627    H8    DG   2           H8        DG   2  16.006   1.805  -7.272
  Start of MODEL   10
 7628    H1    DG   2           H1        DG   2  12.092   1.995  -2.184
  Start of MODEL   10
 7629    H22   DG   2           H21       DG   2   9.975   0.075  -4.160
  Start of MODEL   10
 7630    H21   DG   2           H22       DG   2  10.230   0.874  -2.625
  Start of MODEL   10
 7631   H5''   DG   2          5H''       DG   2  15.682  -2.171  -7.636
  Start of MODEL   10
 7632   H2''   DG   2          2H''       DG   2  14.540   1.113  -9.649
  Start of MODEL   10
 7633    H5'   DT   3           H5'       DT   3  11.066  -2.846  -8.770
  Start of MODEL   10
 7634    H4'   DT   3           H4'       DT   3   9.217  -4.442  -8.939
  Start of MODEL   10
 7635    H3'   DT   3           H3'       DT   3   9.372  -4.464 -11.630
  Start of MODEL   10
 7636    H2'   DT   3           H2'       DT   3   8.649  -2.209 -12.045
  Start of MODEL   10
 7637    H1'   DT   3           H1'       DT   3   6.551  -2.523  -9.844
  Start of MODEL   10
 7638    H3    DT   3           H3        DT   3   5.653   1.693 -11.612
  Start of MODEL   10
 7639    H71   DT   3           H71       DT   3   9.525   3.218  -9.554
  Start of MODEL   10
 7640    H73   DT   3           H72       DT   3  10.236   1.764  -8.815
  Start of MODEL   10
 7641    H72   DT   3           H73       DT   3   8.911   2.623  -7.993
  Start of MODEL   10
 7642    H6    DT   3           H6        DT   3   9.128  -0.351  -9.055
  Start of MODEL   10
 7643   H5''   DT   3          5H''       DT   3  11.313  -4.080 -10.021
  Start of MODEL   10
 7644   H2''   DT   3          2H''       DT   3   7.109  -3.059 -12.109
  Start of MODEL   10
 7645    H5'   DG   4           H5'       DG   4   4.601  -6.712 -10.325
  Start of MODEL   10
 7646    H4'   DG   4           H4'       DG   4   6.100  -5.570  -8.902
  Start of MODEL   10
 7647    H3'   DG   4           H3'       DG   4   3.572  -6.112  -7.993
  Start of MODEL   10
 7648    H2'   DG   4           H2'       DG   4   2.686  -3.901  -8.180
  Start of MODEL   10
 7649    H1'   DG   4           H1'       DG   4   5.433  -2.855  -7.326
  Start of MODEL   10
 7650    H8    DG   4           H8        DG   4   5.697  -0.375  -7.757
  Start of MODEL   10
 7651    H1    DG   4           H1        DG   4   0.207  -0.131 -11.075
  Start of MODEL   10
 7652    H22   DG   4           H21       DG   4   0.204  -3.576 -10.720
  Start of MODEL   10
 7653    H21   DG   4           H22       DG   4  -0.601  -2.160 -11.356
  Start of MODEL   10
 7654   H5''   DG   4          5H''       DG   4   3.527  -5.301 -10.447
  Start of MODEL   10
 7655   H2''   DG   4          2H''       DG   4   3.355  -3.834  -6.554
  Start of MODEL   10
 7656    H5'   DT   5           H5'       DT   5   3.455  -8.731  -4.364
  Start of MODEL   10
 7657    H4'   DT   5           H4'       DT   5   2.795  -7.479  -2.514
  Start of MODEL   10
 7658    H3'   DT   5           H3'       DT   5   1.152  -9.475  -3.231
  Start of MODEL   10
 7659    H2'   DT   5           H2'       DT   5  -0.340  -8.168  -4.610
  Start of MODEL   10
 7660    H1'   DT   5           H1'       DT   5  -0.287  -6.033  -2.424
  Start of MODEL   10
 7661    H3    DT   5           H3        DT   5  -3.285  -3.731  -4.873
  Start of MODEL   10
 7662    H71   DT   5           H71       DT   5  -0.664  -4.149  -8.674
  Start of MODEL   10
 7663    H72   DT   5           H72       DT   5   0.632  -3.266  -7.829
  Start of MODEL   10
 7664    H73   DT   5           H73       DT   5   0.788  -5.017  -8.119
  Start of MODEL   10
 7665    H6    DT   5           H6        DT   5   0.924  -5.739  -5.835
  Start of MODEL   10
 7666   H5''   DT   5          5H''       DT   5   2.072  -8.194  -5.341
  Start of MODEL   10
 7667   H2''   DT   5          2H''       DT   5  -1.188  -8.187  -3.071
  Start of MODEL   10
 7668    H5'   DG   6           H5'       DG   6   2.761  -7.172   1.160
  Start of MODEL   10
 7669    H4'   DG   6           H4'       DG   6   3.381  -7.995   3.523
  Start of MODEL   10
 7670    H3'   DG   6           H3'       DG   6   1.846 -10.195   3.053
  Start of MODEL   10
 7671    H2'   DG   6           H2'       DG   6  -0.287  -9.128   2.943
  Start of MODEL   10
 7672    H1'   DG   6           H1'       DG   6   0.580  -7.166   5.124
  Start of MODEL   10
 7673    H8    DG   6           H8        DG   6  -1.019  -7.410   1.610
  Start of MODEL   10
 7674    H1    DG   6           H1        DG   6  -3.534  -2.970   5.515
  Start of MODEL   10
 7675    H22   DG   6           H21       DG   6  -1.090  -4.025   7.748
  Start of MODEL   10
 7676    H21   DG   6           H22       DG   6  -2.447  -2.964   7.442
  Start of MODEL   10
 7677   H5''   DG   6          5H''       DG   6   3.543  -8.748   1.378
  Start of MODEL   10
 7678   H2''   DG   6          2H''       DG   6  -0.183  -9.405   4.674
  Start of MODEL   10
 7679    H5'   DC   7           H5'       DC   7   5.112 -11.372   3.000
  Start of MODEL   10
 7680    H4'   DC   7           H4'       DC   7   5.400 -13.615   3.430
  Start of MODEL   10
 7681    H3'   DC   7           H3'       DC   7   4.171 -13.239   0.739
  Start of MODEL   10
 7682   HO3'   DC   7           H3T       DC   7   6.171 -14.105   0.183
  Start of MODEL   10
 7683    H2'   DC   7           H2'       DC   7   3.517 -15.462   0.558
  Start of MODEL   10
 7684    H1'   DC   7           H1'       DC   7   3.853 -16.135   3.415
  Start of MODEL   10
 7685    H42   DC   7           H41       DC   7  -2.539 -16.553   1.675
  Start of MODEL   10
 7686    H41   DC   7           H42       DC   7  -2.095 -18.073   2.427
  Start of MODEL   10
 7687    H5    DC   7           H5        DC   7  -0.935 -14.771   1.283
  Start of MODEL   10
 7688    H6    DC   7           H6        DC   7   1.377 -14.060   1.608
  Start of MODEL   10
 7689   H5''   DC   7          5H''       DC   7   3.544 -11.611   2.200
  Start of MODEL   10
 7690   H2''   DC   7          2H''       DC   7   4.949 -16.034   1.396
  Start of MODEL   11
 7691    H1   GLY  25           HT1      GLY  25 -11.774 -20.441  -8.368
  Start of MODEL   11
 7692    H2   GLY  25           HT2      GLY  25 -11.839 -21.853  -7.435
  Start of MODEL   11
 7693    H3   GLY  25           HT3      GLY  25 -10.360 -21.069  -7.668
  Start of MODEL   11
 7694    HA3  GLY  25           HA2      GLY  25 -11.232 -20.639  -5.455
  Start of MODEL   11
 7695    HA2  GLY  25           HA3      GLY  25 -12.687 -19.980  -6.188
  Start of MODEL   11
 7696    H    ALA  26           H        ALA  26 -10.651 -18.761  -4.424
  Start of MODEL   11
 7697    HA   ALA  26           HA       ALA  26  -9.567 -16.794  -4.127
  Start of MODEL   11
 7698    HB3  ALA  26           HB1      ALA  26  -7.971 -17.598  -5.804
  Start of MODEL   11
 7699    HB2  ALA  26           HB2      ALA  26  -8.198 -15.851  -5.912
  Start of MODEL   11
 7700    HB1  ALA  26           HB3      ALA  26  -8.976 -16.916  -7.083
  Start of MODEL   11
 7701    H    MET  27           H        MET  27 -11.647 -15.952  -3.616
  Start of MODEL   11
 7702    HA   MET  27           HA       MET  27 -12.893 -14.330  -5.729
  Start of MODEL   11
 7703    HB2  MET  27           HB2      MET  27 -14.063 -15.252  -3.100
  Start of MODEL   11
 7704    HB3  MET  27           HB3      MET  27 -14.917 -14.388  -4.371
  Start of MODEL   11
 7705    HG2  MET  27           HG2      MET  27 -14.698 -16.259  -5.860
  Start of MODEL   11
 7706    HG3  MET  27           HG3      MET  27 -13.701 -17.122  -4.689
  Start of MODEL   11
 7707    HE2  MET  27           HE1      MET  27 -16.968 -19.239  -4.659
  Start of MODEL   11
 7708    HE1  MET  27           HE2      MET  27 -15.223 -19.230  -4.910
  Start of MODEL   11
 7709    HE3  MET  27           HE3      MET  27 -16.282 -18.420  -6.062
  Start of MODEL   11
 7710    H    GLY  28           H        GLY  28 -12.096 -14.269  -2.260
  Start of MODEL   11
 7711    HA2  GLY  28           HA2      GLY  28 -11.557 -12.528  -0.862
  Start of MODEL   11
 7712    HA3  GLY  28           HA3      GLY  28 -11.073 -11.642  -2.303
  Start of MODEL   11
 7713    H    SER  29           H        SER  29 -12.136  -9.828  -2.648
  Start of MODEL   11
 7714    HA   SER  29           HA       SER  29 -13.737  -8.231  -2.681
  Start of MODEL   11
 7715    HB2  SER  29           HB2      SER  29 -15.590 -10.620  -2.708
  Start of MODEL   11
 7716    HB3  SER  29           HB3      SER  29 -16.037  -8.971  -3.153
  Start of MODEL   11
 7717    HG   SER  29           HG       SER  29 -14.264 -10.745  -4.469
  Start of MODEL   11
 7718    H    ARG  30           H        ARG  30 -12.751  -9.074  -0.101
  Start of MODEL   11
 7719    HA   ARG  30           HA       ARG  30 -15.003  -8.832   1.682
  Start of MODEL   11
 7720    HB2  ARG  30           HB2      ARG  30 -12.838  -8.551   3.312
  Start of MODEL   11
 7721    HB3  ARG  30           HB3      ARG  30 -13.624 -10.072   2.926
  Start of MODEL   11
 7722    HG2  ARG  30           HG2      ARG  30 -11.243 -10.300   2.701
  Start of MODEL   11
 7723    HG3  ARG  30           HG3      ARG  30 -12.001 -10.419   1.114
  Start of MODEL   11
 7724    HD2  ARG  30           HD2      ARG  30 -11.361  -8.190   0.563
  Start of MODEL   11
 7725    HD3  ARG  30           HD3      ARG  30 -10.795  -7.891   2.207
  Start of MODEL   11
 7726    HE   ARG  30           HE       ARG  30  -9.044  -9.578   1.766
  Start of MODEL   11
 7727   HH11  ARG  30          HH11      ARG  30 -10.575  -7.946  -0.922
  Start of MODEL   11
 7728   HH12  ARG  30          HH12      ARG  30  -9.282  -8.268  -2.025
  Start of MODEL   11
 7729   HH21  ARG  30          HH21      ARG  30  -7.326  -9.975   0.372
  Start of MODEL   11
 7730   HH22  ARG  30          HH22      ARG  30  -7.404  -9.435  -1.279
  Start of MODEL   11
 7731    H    ASP  31           H        ASP  31 -13.943  -7.287   3.726
  Start of MODEL   11
 7732    HA   ASP  31           HA       ASP  31 -15.213  -4.898   3.043
  Start of MODEL   11
 7733    HB2  ASP  31           HB2      ASP  31 -13.414  -5.571   5.373
  Start of MODEL   11
 7734    HB3  ASP  31           HB3      ASP  31 -14.319  -4.066   5.249
  Start of MODEL   11
 7735    H    THR  32           H        THR  32 -11.974  -5.763   2.515
  Start of MODEL   11
 7736    HA   THR  32           HA       THR  32 -11.021  -3.022   2.741
  Start of MODEL   11
 7737    HB   THR  32           HB       THR  32  -8.767  -4.096   2.320
  Start of MODEL   11
 7738    HG1  THR  32           HG1      THR  32  -9.642  -6.580   3.054
  Start of MODEL   11
 7739   HG21  THR  32          HG21      THR  32 -10.389  -5.119   4.653
  Start of MODEL   11
 7740   HG23  THR  32          HG22      THR  32  -9.562  -3.562   4.575
  Start of MODEL   11
 7741   HG22  THR  32          HG23      THR  32  -8.628  -5.058   4.569
  Start of MODEL   11
 7742    H    MET  33           H        MET  33 -12.602  -4.510   0.360
  Start of MODEL   11
 7743    HA   MET  33           HA       MET  33 -11.010  -4.417  -1.887
  Start of MODEL   11
 7744    HB2  MET  33           HB2      MET  33 -13.892  -4.268  -1.391
  Start of MODEL   11
 7745    HB3  MET  33           HB3      MET  33 -13.377  -3.540  -2.908
  Start of MODEL   11
 7746    HG2  MET  33           HG2      MET  33 -12.219  -5.619  -3.487
  Start of MODEL   11
 7747    HG3  MET  33           HG3      MET  33 -12.804  -6.342  -1.995
  Start of MODEL   11
 7748    HE3  MET  33           HE1      MET  33 -14.720  -3.915  -4.487
  Start of MODEL   11
 7749    HE2  MET  33           HE2      MET  33 -15.510  -5.098  -5.528
  Start of MODEL   11
 7750    HE1  MET  33           HE3      MET  33 -13.753  -4.956  -5.528
  Start of MODEL   11
 7751    H    PHE  34           H        PHE  34 -12.897  -1.621  -0.545
  Start of MODEL   11
 7752    HA   PHE  34           HA       PHE  34 -11.567   0.034  -2.570
  Start of MODEL   11
 7753    HB2  PHE  34           HB2      PHE  34 -14.107   0.506  -0.991
  Start of MODEL   11
 7754    HB3  PHE  34           HB3      PHE  34 -13.377   1.682  -2.072
  Start of MODEL   11
 7755    HD1  PHE  34           HD1      PHE  34 -15.203  -1.491  -1.875
  Start of MODEL   11
 7756    HD2  PHE  34           HD2      PHE  34 -13.528   1.450  -4.457
  Start of MODEL   11
 7757    HE1  PHE  34           HE1      PHE  34 -16.457  -2.441  -3.771
  Start of MODEL   11
 7758    HE2  PHE  34           HE2      PHE  34 -14.776   0.503  -6.351
  Start of MODEL   11
 7759    HZ   PHE  34           HZ       PHE  34 -16.241  -1.446  -6.009
  Start of MODEL   11
 7760    H    THR  35           H        THR  35 -11.249  -0.815   0.590
  Start of MODEL   11
 7761    HA   THR  35           HA       THR  35 -10.599   1.895   1.508
  Start of MODEL   11
 7762    HB   THR  35           HB       THR  35 -10.590   0.757   3.803
  Start of MODEL   11
 7763    HG1  THR  35           HG1      THR  35 -12.118  -1.173   3.631
  Start of MODEL   11
 7764   HG22  THR  35          HG21      THR  35 -13.033   0.899   3.991
  Start of MODEL   11
 7765   HG21  THR  35          HG22      THR  35 -13.170   0.881   2.234
  Start of MODEL   11
 7766   HG23  THR  35          HG23      THR  35 -12.386   2.238   3.042
  Start of MODEL   11
 7767    H    LYS  36           H        LYS  36  -9.184  -1.128   0.656
  Start of MODEL   11
 7768    HA   LYS  36           HA       LYS  36  -6.760  -0.659   2.175
  Start of MODEL   11
 7769    HB2  LYS  36           HB2      LYS  36  -7.632  -2.902   2.093
  Start of MODEL   11
 7770    HB3  LYS  36           HB3      LYS  36  -7.708  -2.869   0.343
  Start of MODEL   11
 7771    HG2  LYS  36           HG2      LYS  36  -5.278  -2.889   0.227
  Start of MODEL   11
 7772    HG3  LYS  36           HG3      LYS  36  -5.189  -2.863   1.996
  Start of MODEL   11
 7773    HD2  LYS  36           HD2      LYS  36  -6.360  -4.979   2.124
  Start of MODEL   11
 7774    HD3  LYS  36           HD3      LYS  36  -6.586  -4.996   0.377
  Start of MODEL   11
 7775    HE2  LYS  36           HE2      LYS  36  -3.896  -5.029   1.736
  Start of MODEL   11
 7776    HE3  LYS  36           HE3      LYS  36  -4.756  -6.475   1.222
  Start of MODEL   11
 7777    HZ2  LYS  36           HZ1      LYS  36  -3.116  -5.792  -0.396
  Start of MODEL   11
 7778    HZ1  LYS  36           HZ2      LYS  36  -3.850  -4.276  -0.542
  Start of MODEL   11
 7779    HZ3  LYS  36           HZ3      LYS  36  -4.672  -5.665  -1.046
  Start of MODEL   11
 7780    H    ILE  37           H        ILE  37  -5.331   0.665   1.375
  Start of MODEL   11
 7781    HA   ILE  37           HA       ILE  37  -5.174   1.141  -1.510
  Start of MODEL   11
 7782    HB   ILE  37           HB       ILE  37  -3.945   2.655   0.804
  Start of MODEL   11
 7783   HD12  ILE  37          HD11      ILE  37  -6.608   5.296   0.347
  Start of MODEL   11
 7784   HD11  ILE  37          HD12      ILE  37  -4.996   5.336  -0.367
  Start of MODEL   11
 7785   HD13  ILE  37          HD13      ILE  37  -5.200   4.901   1.331
  Start of MODEL   11
 7786    H    PHE  38           H        PHE  38  -3.497   0.421  -2.680
  Start of MODEL   11
 7787    HA   PHE  38           HA       PHE  38  -1.193  -0.688  -1.236
  Start of MODEL   11
 7788    HB2  PHE  38           HB2      PHE  38  -2.146  -2.286  -2.775
  Start of MODEL   11
 7789    HB3  PHE  38           HB3      PHE  38  -2.131  -1.111  -4.084
  Start of MODEL   11
 7790    HD1  PHE  38           HD1      PHE  38  -0.428  -1.229  -5.616
  Start of MODEL   11
 7791    HD2  PHE  38           HD2      PHE  38   0.241  -2.727  -1.690
  Start of MODEL   11
 7792    HE1  PHE  38           HE1      PHE  38   1.800  -2.013  -6.302
  Start of MODEL   11
 7793    HE2  PHE  38           HE2      PHE  38   2.474  -3.512  -2.366
  Start of MODEL   11
 7794    HZ   PHE  38           HZ       PHE  38   3.269  -3.137  -4.643
  Start of MODEL   11
 7795    H    VAL  39           H        VAL  39   0.606   0.459  -1.162
  Start of MODEL   11
 7796    HA   VAL  39           HA       VAL  39   0.909   2.705  -3.031
  Start of MODEL   11
 7797    HB   VAL  39           HB       VAL  39   2.434   2.379  -0.456
  Start of MODEL   11
 7798    H    GLY  40           H        GLY  40   2.643   2.761  -4.338
  Start of MODEL   11
 7799    HA2  GLY  40           HA2      GLY  40   4.529   0.503  -4.133
  Start of MODEL   11
 7800    HA3  GLY  40           HA3      GLY  40   3.746   0.900  -5.654
  Start of MODEL   11
 7801    H    GLY  41           H        GLY  41   6.598   0.848  -4.879
  Start of MODEL   11
 7802    HA2  GLY  41           HA2      GLY  41   8.405   2.016  -5.734
  Start of MODEL   11
 7803    HA3  GLY  41           HA3      GLY  41   7.307   3.305  -6.207
  Start of MODEL   11
 7804    H    LEU  42           H        LEU  42   7.018   2.289  -2.979
  Start of MODEL   11
 7805    HA   LEU  42           HA       LEU  42   7.785   4.797  -1.926
  Start of MODEL   11
 7806    HB2  LEU  42           HB2      LEU  42   7.219   2.139  -0.613
  Start of MODEL   11
 7807    HB3  LEU  42           HB3      LEU  42   7.640   3.575   0.297
  Start of MODEL   11
 7808    HG   LEU  42           HG       LEU  42   5.226   3.286  -1.491
  Start of MODEL   11
 7809   HD13  LEU  42          HD11      LEU  42   5.088   1.930   0.548
  Start of MODEL   11
 7810   HD12  LEU  42          HD12      LEU  42   3.961   3.288   0.595
  Start of MODEL   11
 7811   HD11  LEU  42          HD13      LEU  42   5.465   3.357   1.518
  Start of MODEL   11
 7812   HD22  LEU  42          HD21      LEU  42   4.560   5.434  -0.552
  Start of MODEL   11
 7813   HD21  LEU  42          HD22      LEU  42   6.105   5.574  -1.389
  Start of MODEL   11
 7814   HD23  LEU  42          HD23      LEU  42   6.062   5.508   0.372
  Start of MODEL   11
 7815    HA   PRO  43           HA       PRO  43  12.175   4.218  -1.650
  Start of MODEL   11
 7816    HB2  PRO  43           HB2      PRO  43  12.526   6.164   0.286
  Start of MODEL   11
 7817    HB3  PRO  43           HB3      PRO  43  12.488   6.472  -1.452
  Start of MODEL   11
 7818    HG2  PRO  43           HG2      PRO  43  10.331   6.814   0.580
  Start of MODEL   11
 7819    HG3  PRO  43           HG3      PRO  43  10.717   7.820  -0.826
  Start of MODEL   11
 7820    HD2  PRO  43           HD2      PRO  43   8.649   6.092  -0.832
  Start of MODEL   11
 7821    HD3  PRO  43           HD3      PRO  43   9.605   6.426  -2.293
  Start of MODEL   11
 7822    H    TYR  44           H        TYR  44  13.423   3.021  -0.263
  Start of MODEL   11
 7823    HA   TYR  44           HA       TYR  44  12.039   1.352   1.477
  Start of MODEL   11
 7824    HB2  TYR  44           HB2      TYR  44  15.011   1.805   1.225
  Start of MODEL   11
 7825    HB3  TYR  44           HB3      TYR  44  14.280   0.474   2.112
  Start of MODEL   11
 7826    HD1  TYR  44           HD1      TYR  44  12.260  -0.622   0.496
  Start of MODEL   11
 7827    HD2  TYR  44           HD2      TYR  44  15.936   1.107  -0.759
  Start of MODEL   11
 7828    HE1  TYR  44           HE1      TYR  44  12.175  -1.972  -1.558
  Start of MODEL   11
 7829    HE2  TYR  44           HE2      TYR  44  15.868  -0.229  -2.822
  Start of MODEL   11
 7830    HH   TYR  44           HH       TYR  44  13.098  -1.863  -3.871
  Start of MODEL   11
 7831    H    HIS  45           H        HIS  45  13.529   4.395   2.144
  Start of MODEL   11
 7832    HA   HIS  45           HA       HIS  45  13.764   3.968   4.962
  Start of MODEL   11
 7833    HB2  HIS  45           HB2      HIS  45  14.307   6.325   5.161
  Start of MODEL   11
 7834    HB3  HIS  45           HB3      HIS  45  15.212   5.592   3.848
  Start of MODEL   11
 7835    HD1  HIS  45           HD1      HIS  45  12.658   8.217   4.577
  Start of MODEL   11
 7836    HD2  HIS  45           HD2      HIS  45  14.511   6.518   1.269
  Start of MODEL   11
 7837    HE1  HIS  45           HE1      HIS  45  12.253   9.809   2.680
  Start of MODEL   11
 7838    HE2  HIS  45           HE2      HIS  45  13.368   8.760   0.686
  Start of MODEL   11
 7839    H    THR  46           H        THR  46  11.069   4.818   2.969
  Start of MODEL   11
 7840    HA   THR  46           HA       THR  46   9.497   6.307   4.647
  Start of MODEL   11
 7841    HB   THR  46           HB       THR  46   8.650   4.045   2.828
  Start of MODEL   11
 7842    HG1  THR  46           HG1      THR  46   8.875   6.867   2.464
  Start of MODEL   11
 7843   HG23  THR  46          HG21      THR  46   6.830   4.577   4.346
  Start of MODEL   11
 7844   HG22  THR  46          HG22      THR  46   6.466   5.224   2.745
  Start of MODEL   11
 7845   HG21  THR  46          HG23      THR  46   7.029   6.298   4.024
  Start of MODEL   11
 7846    H    SER  47           H        SER  47   8.184   5.953   6.401
  Start of MODEL   11
 7847    HA   SER  47           HA       SER  47   8.322   3.269   7.596
  Start of MODEL   11
 7848    HB2  SER  47           HB2      SER  47   8.181   4.398   9.790
  Start of MODEL   11
 7849    HB3  SER  47           HB3      SER  47   9.596   4.924   8.881
  Start of MODEL   11
 7850    HG   SER  47           HG       SER  47   8.345   6.780   8.241
  Start of MODEL   11
 7851    H    ASP  48           H        ASP  48   6.497   2.732   9.021
  Start of MODEL   11
 7852    HA   ASP  48           HA       ASP  48   3.989   2.933   7.924
  Start of MODEL   11
 7853    HB2  ASP  48           HB2      ASP  48   4.527   2.755  10.895
  Start of MODEL   11
 7854    HB3  ASP  48           HB3      ASP  48   3.107   2.165  10.042
  Start of MODEL   11
 7855    H    LYS  49           H        LYS  49   5.561   5.119  10.173
  Start of MODEL   11
 7856    HA   LYS  49           HA       LYS  49   3.285   6.687  10.768
  Start of MODEL   11
 7857    HB2  LYS  49           HB2      LYS  49   5.373   6.694  12.120
  Start of MODEL   11
 7858    HB3  LYS  49           HB3      LYS  49   6.184   7.547  10.813
  Start of MODEL   11
 7859    HG2  LYS  49           HG2      LYS  49   4.524   9.375  11.048
  Start of MODEL   11
 7860    HG3  LYS  49           HG3      LYS  49   3.863   8.532  12.452
  Start of MODEL   11
 7861    HD2  LYS  49           HD2      LYS  49   5.400  10.250  13.187
  Start of MODEL   11
 7862    HD3  LYS  49           HD3      LYS  49   6.076   8.656  13.531
  Start of MODEL   11
 7863    HE2  LYS  49           HE2      LYS  49   7.491   8.800  11.570
  Start of MODEL   11
 7864    HE3  LYS  49           HE3      LYS  49   6.774  10.352  11.141
  Start of MODEL   11
 7865    HZ3  LYS  49           HZ1      LYS  49   7.687  11.320  13.131
  Start of MODEL   11
 7866    HZ2  LYS  49           HZ2      LYS  49   8.931  10.574  12.259
  Start of MODEL   11
 7867    HZ1  LYS  49           HZ3      LYS  49   8.300   9.820  13.636
  Start of MODEL   11
 7868    H    THR  50           H        THR  50   5.710   6.834   8.210
  Start of MODEL   11
 7869    HA   THR  50           HA       THR  50   5.041   9.361   7.170
  Start of MODEL   11
 7870    HB   THR  50           HB       THR  50   5.979   7.004   5.524
  Start of MODEL   11
 7871    HG1  THR  50           HG1      THR  50   8.101   8.249   5.992
  Start of MODEL   11
 7872   HG22  THR  50          HG21      THR  50   6.975   8.722   4.098
  Start of MODEL   11
 7873   HG21  THR  50          HG22      THR  50   6.338   9.977   5.158
  Start of MODEL   11
 7874   HG23  THR  50          HG23      THR  50   5.234   8.952   4.244
  Start of MODEL   11
 7875    H    LEU  51           H        LEU  51   3.754   6.130   6.565
  Start of MODEL   11
 7876    HA   LEU  51           HA       LEU  51   1.987   6.984   4.471
  Start of MODEL   11
 7877    HB2  LEU  51           HB2      LEU  51   1.974   4.501   6.181
  Start of MODEL   11
 7878    HB3  LEU  51           HB3      LEU  51   0.842   4.788   4.873
  Start of MODEL   11
 7879    HG   LEU  51           HG       LEU  51   3.829   4.420   4.643
  Start of MODEL   11
 7880   HD11  LEU  51          HD11      LEU  51   1.491   2.814   3.615
  Start of MODEL   11
 7881   HD13  LEU  51          HD12      LEU  51   2.562   2.363   4.946
  Start of MODEL   11
 7882   HD12  LEU  51          HD13      LEU  51   3.193   2.473   3.300
  Start of MODEL   11
 7883   HD21  LEU  51          HD21      LEU  51   3.090   6.154   3.092
  Start of MODEL   11
 7884   HD23  LEU  51          HD22      LEU  51   1.822   5.088   2.490
  Start of MODEL   11
 7885   HD22  LEU  51          HD23      LEU  51   3.518   4.678   2.230
  Start of MODEL   11
 7886    H    HIS  52           H        HIS  52   1.683   6.371   7.918
  Start of MODEL   11
 7887    HA   HIS  52           HA       HIS  52  -1.002   6.924   8.299
  Start of MODEL   11
 7888    HB2  HIS  52           HB2      HIS  52   0.445   6.075  10.079
  Start of MODEL   11
 7889    HB3  HIS  52           HB3      HIS  52   1.339   7.587  10.103
  Start of MODEL   11
 7890    HD1  HIS  52           HD1      HIS  52   0.501   9.393  11.631
  Start of MODEL   11
 7891    HD2  HIS  52           HD2      HIS  52  -2.264   6.319  11.098
  Start of MODEL   11
 7892    HE1  HIS  52           HE1      HIS  52  -1.312   9.797  13.324
  Start of MODEL   11
 7893    HE2  HIS  52           HE2      HIS  52  -3.073   8.073  12.814
  Start of MODEL   11
 7894    H    GLU  53           H        GLU  53   1.675   9.303   8.651
  Start of MODEL   11
 7895    HA   GLU  53           HA       GLU  53   0.083  11.520   9.086
  Start of MODEL   11
 7896    HB2  GLU  53           HB2      GLU  53   2.736  11.554   7.647
  Start of MODEL   11
 7897    HB3  GLU  53           HB3      GLU  53   2.013  12.867   8.556
  Start of MODEL   11
 7898    HG2  GLU  53           HG2      GLU  53   3.064  10.279   9.666
  Start of MODEL   11
 7899    HG3  GLU  53           HG3      GLU  53   3.811  11.869   9.799
  Start of MODEL   11
 7900    H    TYR  54           H        TYR  54   1.322  10.290   5.978
  Start of MODEL   11
 7901    HA   TYR  54           HA       TYR  54   0.506  12.631   4.572
  Start of MODEL   11
 7902    HB2  TYR  54           HB2      TYR  54   2.336  11.199   3.751
  Start of MODEL   11
 7903    HB3  TYR  54           HB3      TYR  54   1.183   9.897   3.463
  Start of MODEL   11
 7904    HD1  TYR  54           HD1      TYR  54  -0.079   9.812   1.459
  Start of MODEL   11
 7905    HD2  TYR  54           HD2      TYR  54   2.105  13.331   2.434
  Start of MODEL   11
 7906    HE1  TYR  54           HE1      TYR  54  -0.524  10.708  -0.789
  Start of MODEL   11
 7907    HE2  TYR  54           HE2      TYR  54   1.669  14.231   0.193
  Start of MODEL   11
 7908    HH   TYR  54           HH       TYR  54  -0.633  12.893  -1.914
  Start of MODEL   11
 7909    H    PHE  55           H        PHE  55  -0.778   9.304   4.539
  Start of MODEL   11
 7910    HA   PHE  55           HA       PHE  55  -2.901   9.991   2.841
  Start of MODEL   11
 7911    HB2  PHE  55           HB2      PHE  55  -2.278   7.570   4.485
  Start of MODEL   11
 7912    HB3  PHE  55           HB3      PHE  55  -3.785   7.687   3.580
  Start of MODEL   11
 7913    HD1  PHE  55           HD1      PHE  55  -0.186   7.246   3.398
  Start of MODEL   11
 7914    HD2  PHE  55           HD2      PHE  55  -3.750   7.783   1.139
  Start of MODEL   11
 7915    HE1  PHE  55           HE1      PHE  55   0.979   6.473   1.375
  Start of MODEL   11
 7916    HE2  PHE  55           HE2      PHE  55  -2.591   7.009  -0.884
  Start of MODEL   11
 7917    HZ   PHE  55           HZ       PHE  55  -0.221   6.352  -0.767
  Start of MODEL   11
 7918    H    GLU  56           H        GLU  56  -2.706  10.096   6.359
  Start of MODEL   11
 7919    HA   GLU  56           HA       GLU  56  -5.534   9.853   6.675
  Start of MODEL   11
 7920    HB2  GLU  56           HB2      GLU  56  -5.261  10.405   8.986
  Start of MODEL   11
 7921    HB3  GLU  56           HB3      GLU  56  -3.967   9.317   8.517
  Start of MODEL   11
 7922    HG2  GLU  56           HG2      GLU  56  -2.357  10.999   8.619
  Start of MODEL   11
 7923    HG3  GLU  56           HG3      GLU  56  -3.567  12.285   8.587
  Start of MODEL   11
 7924    H    GLN  57           H        GLN  57  -3.551  12.383   5.647
  Start of MODEL   11
 7925    HA   GLN  57           HA       GLN  57  -5.075  14.606   6.516
  Start of MODEL   11
 7926    HB2  GLN  57           HB2      GLN  57  -3.261  14.254   4.123
  Start of MODEL   11
 7927    HB3  GLN  57           HB3      GLN  57  -3.977  15.790   4.585
  Start of MODEL   11
 7928    HG2  GLN  57           HG2      GLN  57  -2.781  15.777   6.672
  Start of MODEL   11
 7929    HG3  GLN  57           HG3      GLN  57  -2.160  14.162   6.343
  Start of MODEL   11
 7930   HE21  GLN  57          HE21      GLN  57  -0.553  13.891   4.826
  Start of MODEL   11
 7931   HE22  GLN  57          HE22      GLN  57   0.415  15.204   4.244
  Start of MODEL   11
 7932    H    PHE  58           H        PHE  58  -5.878  12.115   4.398
  Start of MODEL   11
 7933    HA   PHE  58           HA       PHE  58  -7.718  13.729   2.816
  Start of MODEL   11
 7934    HB2  PHE  58           HB2      PHE  58  -7.061  10.777   2.763
  Start of MODEL   11
 7935    HB3  PHE  58           HB3      PHE  58  -8.257  11.532   1.720
  Start of MODEL   11
 7936    HD1  PHE  58           HD1      PHE  58  -4.652  11.675   2.624
  Start of MODEL   11
 7937    HD2  PHE  58           HD2      PHE  58  -7.635  12.427  -0.312
  Start of MODEL   11
 7938    HE1  PHE  58           HE1      PHE  58  -2.895  12.216   0.984
  Start of MODEL   11
 7939    HE2  PHE  58           HE2      PHE  58  -5.889  12.977  -1.959
  Start of MODEL   11
 7940    HZ   PHE  58           HZ       PHE  58  -3.508  12.865  -1.307
  Start of MODEL   11
 7941    H    GLY  59           H        GLY  59  -7.705  11.894   5.686
  Start of MODEL   11
 7942    HA2  GLY  59           HA2      GLY  59 -10.215  12.630   6.548
  Start of MODEL   11
 7943    HA3  GLY  59           HA3      GLY  59 -10.460  11.121   5.684
  Start of MODEL   11
 7944    H    ASP  60           H        ASP  60 -10.231   9.300   6.791
  Start of MODEL   11
 7945    HA   ASP  60           HA       ASP  60  -8.674   9.374   9.292
  Start of MODEL   11
 7946    HB2  ASP  60           HB2      ASP  60 -11.362   8.117   8.784
  Start of MODEL   11
 7947    HB3  ASP  60           HB3      ASP  60 -10.328   7.598  10.107
  Start of MODEL   11
 7948    H    ILE  61           H        ILE  61  -7.141   7.852   9.465
  Start of MODEL   11
 7949    HA   ILE  61           HA       ILE  61  -7.302   5.515   7.717
  Start of MODEL   11
 7950    HB   ILE  61           HB       ILE  61  -5.049   6.829   9.199
  Start of MODEL   11
 7951   HD11  ILE  61          HD11      ILE  61  -2.987   6.102   7.017
  Start of MODEL   11
 7952   HD13  ILE  61          HD12      ILE  61  -3.314   7.698   7.688
  Start of MODEL   11
 7953   HD12  ILE  61          HD13      ILE  61  -3.436   7.432   5.952
  Start of MODEL   11
 7954    H    GLU  62           H        GLU  62  -7.686   3.548   8.502
  Start of MODEL   11
 7955    HA   GLU  62           HA       GLU  62  -8.058   3.150  11.343
  Start of MODEL   11
 7956    HB2  GLU  62           HB2      GLU  62  -8.678   1.667   8.859
  Start of MODEL   11
 7957    HB3  GLU  62           HB3      GLU  62  -8.334   0.685  10.267
  Start of MODEL   11
 7958    HG2  GLU  62           HG2      GLU  62 -10.049   2.109  11.483
  Start of MODEL   11
 7959    HG3  GLU  62           HG3      GLU  62 -10.501   2.710   9.890
  Start of MODEL   11
 7960    H    GLU  63           H        GLU  63  -5.801   2.258   8.814
  Start of MODEL   11
 7961    HA   GLU  63           HA       GLU  63  -3.836   1.369  10.748
  Start of MODEL   11
 7962    HB2  GLU  63           HB2      GLU  63  -5.267  -0.602  10.414
  Start of MODEL   11
 7963    HB3  GLU  63           HB3      GLU  63  -5.038  -0.483   8.681
  Start of MODEL   11
 7964    HG2  GLU  63           HG2      GLU  63  -2.671  -0.983   8.957
  Start of MODEL   11
 7965    HG3  GLU  63           HG3      GLU  63  -2.906  -1.115  10.705
  Start of MODEL   11
 7966    H    ALA  64           H        ALA  64  -1.793   1.809   9.967
  Start of MODEL   11
 7967    HA   ALA  64           HA       ALA  64  -1.458   2.059   7.060
  Start of MODEL   11
 7968    HB1  ALA  64           HB1      ALA  64  -0.463   4.082   9.068
  Start of MODEL   11
 7969    HB3  ALA  64           HB2      ALA  64  -1.819   4.319   7.966
  Start of MODEL   11
 7970    HB2  ALA  64           HB3      ALA  64  -0.188   4.120   7.325
  Start of MODEL   11
 7971    H    VAL  65           H        VAL  65   0.155   0.698   6.460
  Start of MODEL   11
 7972    HA   VAL  65           HA       VAL  65   2.406   0.345   8.306
  Start of MODEL   11
 7973    HB   VAL  65           HB       VAL  65   2.398  -2.072   7.983
  Start of MODEL   11
 7974    H    VAL  66           H        VAL  66   4.378   0.113   7.322
  Start of MODEL   11
 7975    HA   VAL  66           HA       VAL  66   4.438   0.011   4.376
  Start of MODEL   11
 7976    HB   VAL  66           HB       VAL  66   6.694   0.519   6.345
  Start of MODEL   11
 7977    H    ILE  67           H        ILE  67   5.326  -1.760   3.294
  Start of MODEL   11
 7978    HA   ILE  67           HA       ILE  67   5.048  -4.152   4.918
  Start of MODEL   11
 7979    HB   ILE  67           HB       ILE  67   5.173  -3.830   1.916
  Start of MODEL   11
 7980   HD11  ILE  67          HD11      ILE  67   3.219  -3.915   5.031
  Start of MODEL   11
 7981   HD13  ILE  67          HD12      ILE  67   2.683  -5.442   4.331
  Start of MODEL   11
 7982   HD12  ILE  67          HD13      ILE  67   1.636  -4.026   4.264
  Start of MODEL   11
 7983    H    THR  68           H        THR  68   6.629  -5.305   5.566
  Start of MODEL   11
 7984    HA   THR  68           HA       THR  68   9.263  -5.077   4.272
  Start of MODEL   11
 7985    HB   THR  68           HB       THR  68  10.217  -5.595   6.526
  Start of MODEL   11
 7986    HG1  THR  68           HG1      THR  68   8.093  -6.439   7.314
  Start of MODEL   11
 7987   HG22  THR  68          HG21      THR  68   9.869  -3.353   7.488
  Start of MODEL   11
 7988   HG21  THR  68          HG22      THR  68   8.519  -3.101   6.382
  Start of MODEL   11
 7989   HG23  THR  68          HG23      THR  68  10.153  -3.287   5.749
  Start of MODEL   11
 7990    H    ASP  69           H        ASP  69  10.354  -7.086   3.914
  Start of MODEL   11
 7991    HA   ASP  69           HA       ASP  69   8.859  -9.390   3.673
  Start of MODEL   11
 7992    HB2  ASP  69           HB2      ASP  69  10.984  -9.173   2.558
  Start of MODEL   11
 7993    HB3  ASP  69           HB3      ASP  69  11.832  -9.062   4.099
  Start of MODEL   11
 7994    H    ARG  70           H        ARG  70   8.233 -10.975   4.989
  Start of MODEL   11
 7995    HA   ARG  70           HA       ARG  70   8.217 -10.473   7.731
  Start of MODEL   11
 7996    HB2  ARG  70           HB2      ARG  70   7.302 -12.932   7.819
  Start of MODEL   11
 7997    HB3  ARG  70           HB3      ARG  70   6.338 -11.587   7.237
  Start of MODEL   11
 7998    HG2  ARG  70           HG2      ARG  70   6.119 -13.566   5.839
  Start of MODEL   11
 7999    HG3  ARG  70           HG3      ARG  70   6.792 -12.209   4.950
  Start of MODEL   11
 8000    HD2  ARG  70           HD2      ARG  70   9.013 -13.135   5.166
  Start of MODEL   11
 8001    HD3  ARG  70           HD3      ARG  70   8.392 -14.462   6.143
  Start of MODEL   11
 8002    HE   ARG  70           HE       ARG  70   7.575 -14.059   3.335
  Start of MODEL   11
 8003   HH11  ARG  70          HH11      ARG  70   8.804 -16.095   5.891
  Start of MODEL   11
 8004   HH12  ARG  70          HH12      ARG  70   8.614 -17.571   4.991
  Start of MODEL   11
 8005   HH21  ARG  70          HH21      ARG  70   7.312 -15.999   2.141
  Start of MODEL   11
 8006   HH22  ARG  70          HH22      ARG  70   7.743 -17.518   2.865
  Start of MODEL   11
 8007    H    ASN  71           H        ASN  71  10.660 -12.131   5.959
  Start of MODEL   11
 8008    HA   ASN  71           HA       ASN  71  11.550 -13.556   8.334
  Start of MODEL   11
 8009    HB2  ASN  71           HB2      ASN  71  12.487 -13.475   5.477
  Start of MODEL   11
 8010    HB3  ASN  71           HB3      ASN  71  13.468 -14.211   6.737
  Start of MODEL   11
 8011   HD21  ASN  71          HD21      ASN  71  13.260 -16.168   5.537
  Start of MODEL   11
 8012   HD22  ASN  71          HD22      ASN  71  11.832 -17.137   5.690
  Start of MODEL   11
 8013    H    THR  72           H        THR  72  12.855 -11.092   6.119
  Start of MODEL   11
 8014    HA   THR  72           HA       THR  72  15.080 -10.602   7.922
  Start of MODEL   11
 8015    HB   THR  72           HB       THR  72  15.801  -8.997   6.142
  Start of MODEL   11
 8016    HG1  THR  72           HG1      THR  72  13.789 -10.035   4.473
  Start of MODEL   11
 8017   HG22  THR  72          HG21      THR  72  16.275 -10.697   4.441
  Start of MODEL   11
 8018   HG21  THR  72          HG22      THR  72  15.067 -11.760   5.165
  Start of MODEL   11
 8019   HG23  THR  72          HG23      THR  72  16.522 -11.337   6.067
  Start of MODEL   11
 8020    H    GLN  73           H        GLN  73  12.058  -9.239   7.206
  Start of MODEL   11
 8021    HA   GLN  73           HA       GLN  73  10.855  -7.495   8.081
  Start of MODEL   11
 8022    HB2  GLN  73           HB2      GLN  73  13.163  -7.218  10.019
  Start of MODEL   11
 8023    HB3  GLN  73           HB3      GLN  73  11.572  -6.493  10.202
  Start of MODEL   11
 8024    HG2  GLN  73           HG2      GLN  73  10.558  -8.676  10.408
  Start of MODEL   11
 8025    HG3  GLN  73           HG3      GLN  73  12.110  -9.455  10.106
  Start of MODEL   11
 8026   HE21  GLN  73          HE21      GLN  73  13.570  -7.512  11.724
  Start of MODEL   11
 8027   HE22  GLN  73          HE22      GLN  73  13.233  -7.913  13.371
  Start of MODEL   11
 8028    H    LYS  74           H        LYS  74  12.716  -7.163   5.921
  Start of MODEL   11
 8029    HA   LYS  74           HA       LYS  74  13.592  -4.375   6.278
  Start of MODEL   11
 8030    HB2  LYS  74           HB2      LYS  74  14.428  -6.397   4.179
  Start of MODEL   11
 8031    HB3  LYS  74           HB3      LYS  74  15.020  -4.746   4.289
  Start of MODEL   11
 8032    HG2  LYS  74           HG2      LYS  74  15.395  -6.862   6.404
  Start of MODEL   11
 8033    HG3  LYS  74           HG3      LYS  74  16.604  -6.385   5.211
  Start of MODEL   11
 8034    HD2  LYS  74           HD2      LYS  74  16.800  -4.218   6.135
  Start of MODEL   11
 8035    HD3  LYS  74           HD3      LYS  74  15.346  -4.425   7.114
  Start of MODEL   11
 8036    HE2  LYS  74           HE2      LYS  74  17.331  -4.586   8.495
  Start of MODEL   11
 8037    HE3  LYS  74           HE3      LYS  74  16.497  -6.136   8.438
  Start of MODEL   11
 8038    HZ3  LYS  74           HZ1      LYS  74  18.125  -7.016   7.004
  Start of MODEL   11
 8039    HZ2  LYS  74           HZ2      LYS  74  18.979  -6.205   8.219
  Start of MODEL   11
 8040    HZ1  LYS  74           HZ3      LYS  74  18.802  -5.495   6.689
  Start of MODEL   11
 8041    H    SER  75           H        SER  75  12.882  -2.781   4.847
  Start of MODEL   11
 8042    HA   SER  75           HA       SER  75  10.227  -3.055   4.019
  Start of MODEL   11
 8043    HB2  SER  75           HB2      SER  75  10.766  -0.808   2.809
  Start of MODEL   11
 8044    HB3  SER  75           HB3      SER  75  10.844  -0.881   4.571
  Start of MODEL   11
 8045    HG   SER  75           HG       SER  75  12.696   0.121   3.825
  Start of MODEL   11
 8046    H    ARG  76           H        ARG  76   9.256  -3.520   2.169
  Start of MODEL   11
 8047    HA   ARG  76           HA       ARG  76  10.920  -4.558   0.002
  Start of MODEL   11
 8048    HB2  ARG  76           HB2      ARG  76   7.985  -4.834   0.631
  Start of MODEL   11
 8049    HB3  ARG  76           HB3      ARG  76   8.720  -5.475  -0.831
  Start of MODEL   11
 8050    HG2  ARG  76           HG2      ARG  76  10.249  -6.816   0.621
  Start of MODEL   11
 8051    HG3  ARG  76           HG3      ARG  76   9.306  -6.276   2.010
  Start of MODEL   11
 8052    HD2  ARG  76           HD2      ARG  76   7.405  -7.423   1.327
  Start of MODEL   11
 8053    HD3  ARG  76           HD3      ARG  76   7.966  -7.554  -0.339
  Start of MODEL   11
 8054    HE   ARG  76           HE       ARG  76   9.177  -9.064   1.891
  Start of MODEL   11
 8055   HH11  ARG  76          HH11      ARG  76   8.015  -8.819  -1.389
  Start of MODEL   11
 8056   HH12  ARG  76          HH12      ARG  76   8.466 -10.442  -1.819
  Start of MODEL   11
 8057   HH21  ARG  76          HH21      ARG  76   9.765 -11.233   1.358
  Start of MODEL   11
 8058   HH22  ARG  76          HH22      ARG  76   9.428 -11.824  -0.250
  Start of MODEL   11
 8059    H    GLY  77           H        GLY  77  10.179  -1.656   0.581
  Start of MODEL   11
 8060    HA2  GLY  77           HA2      GLY  77   9.906   0.236  -0.704
  Start of MODEL   11
 8061    HA3  GLY  77           HA3      GLY  77   9.972  -0.804  -2.109
  Start of MODEL   11
 8062    H    TYR  78           H        TYR  78   7.462  -1.647   0.056
  Start of MODEL   11
 8063    HA   TYR  78           HA       TYR  78   5.579   0.234  -1.051
  Start of MODEL   11
 8064    HB2  TYR  78           HB2      TYR  78   4.022  -1.535  -1.864
  Start of MODEL   11
 8065    HB3  TYR  78           HB3      TYR  78   5.484  -1.367  -2.820
  Start of MODEL   11
 8066    HD1  TYR  78           HD1      TYR  78   3.733  -3.494  -0.360
  Start of MODEL   11
 8067    HD2  TYR  78           HD2      TYR  78   6.984  -3.205  -3.087
  Start of MODEL   11
 8068    HE1  TYR  78           HE1      TYR  78   4.138  -5.902  -0.118
  Start of MODEL   11
 8069    HE2  TYR  78           HE2      TYR  78   7.400  -5.620  -2.858
  Start of MODEL   11
 8070    HH   TYR  78           HH       TYR  78   6.970  -7.405  -1.185
  Start of MODEL   11
 8071    H    GLY  79           H        GLY  79   3.292  -0.267  -0.155
  Start of MODEL   11
 8072    HA2  GLY  79           HA2      GLY  79   3.293  -1.616   2.400
  Start of MODEL   11
 8073    HA3  GLY  79           HA3      GLY  79   3.314   0.133   2.525
  Start of MODEL   11
 8074    H    PHE  80           H        PHE  80   1.261  -0.632   3.710
  Start of MODEL   11
 8075    HA   PHE  80           HA       PHE  80  -0.973  -0.426   1.828
  Start of MODEL   11
 8076    HB2  PHE  80           HB2      PHE  80  -0.668  -2.509   3.982
  Start of MODEL   11
 8077    HB3  PHE  80           HB3      PHE  80  -2.235  -2.073   3.303
  Start of MODEL   11
 8078    HD1  PHE  80           HD1      PHE  80   0.342  -4.356   3.080
  Start of MODEL   11
 8079    HD2  PHE  80           HD2      PHE  80  -2.187  -1.989   0.621
  Start of MODEL   11
 8080    HE1  PHE  80           HE1      PHE  80   0.728  -5.902   1.213
  Start of MODEL   11
 8081    HE2  PHE  80           HE2      PHE  80  -1.810  -3.529  -1.255
  Start of MODEL   11
 8082    HZ   PHE  80           HZ       PHE  80  -0.352  -5.488  -0.963
  Start of MODEL   11
 8083    H    VAL  81           H        VAL  81  -2.553   0.785   2.414
  Start of MODEL   11
 8084    HA   VAL  81           HA       VAL  81  -2.793   1.614   5.237
  Start of MODEL   11
 8085    HB   VAL  81           HB       VAL  81  -3.329   3.363   2.820
  Start of MODEL   11
 8086    H    THR  82           H        THR  82  -4.700   1.260   6.147
  Start of MODEL   11
 8087    HA   THR  82           HA       THR  82  -6.978   0.617   4.409
  Start of MODEL   11
 8088    HB   THR  82           HB       THR  82  -6.761   0.087   7.382
  Start of MODEL   11
 8089    HG1  THR  82           HG1      THR  82  -5.419  -1.470   6.850
  Start of MODEL   11
 8090   HG22  THR  82          HG21      THR  82  -8.551  -1.540   6.920
  Start of MODEL   11
 8091   HG21  THR  82          HG22      THR  82  -8.544  -1.057   5.221
  Start of MODEL   11
 8092   HG23  THR  82          HG23      THR  82  -9.024   0.097   6.470
  Start of MODEL   11
 8093    H    MET  83           H        MET  83  -8.087   2.476   4.069
  Start of MODEL   11
 8094    HA   MET  83           HA       MET  83  -8.082   4.501   6.146
  Start of MODEL   11
 8095    HB2  MET  83           HB2      MET  83  -9.409   4.628   3.431
  Start of MODEL   11
 8096    HB3  MET  83           HB3      MET  83  -9.150   5.970   4.543
  Start of MODEL   11
 8097    HG2  MET  83           HG2      MET  83  -6.625   5.198   4.295
  Start of MODEL   11
 8098    HG3  MET  83           HG3      MET  83  -7.234   4.586   2.769
  Start of MODEL   11
 8099    HE1  MET  83           HE1      MET  83  -6.392   7.653   4.893
  Start of MODEL   11
 8100    HE3  MET  83           HE2      MET  83  -8.150   7.767   4.849
  Start of MODEL   11
 8101    HE2  MET  83           HE3      MET  83  -7.169   8.977   4.020
  Start of MODEL   11
 8102    H    LYS  84           H        LYS  84  -9.965   5.401   6.998
  Start of MODEL   11
 8103    HA   LYS  84           HA       LYS  84 -11.725   3.355   7.888
  Start of MODEL   11
 8104    HB2  LYS  84           HB2      LYS  84 -10.777   5.313   9.208
  Start of MODEL   11
 8105    HB3  LYS  84           HB3      LYS  84 -11.993   6.304   8.421
  Start of MODEL   11
 8106    HG2  LYS  84           HG2      LYS  84 -13.751   5.200   9.489
  Start of MODEL   11
 8107    HG3  LYS  84           HG3      LYS  84 -12.726   3.839   9.956
  Start of MODEL   11
 8108    HD2  LYS  84           HD2      LYS  84 -12.369   6.653  10.976
  Start of MODEL   11
 8109    HD3  LYS  84           HD3      LYS  84 -13.282   5.406  11.828
  Start of MODEL   11
 8110    HE2  LYS  84           HE2      LYS  84 -11.192   4.005  11.772
  Start of MODEL   11
 8111    HE3  LYS  84           HE3      LYS  84 -10.343   5.421  11.161
  Start of MODEL   11
 8112    HZ1  LYS  84           HZ1      LYS  84 -11.800   5.289  13.745
  Start of MODEL   11
 8113    HZ3  LYS  84           HZ2      LYS  84 -10.895   6.605  13.176
  Start of MODEL   11
 8114    HZ2  LYS  84           HZ3      LYS  84 -10.125   5.150  13.571
  Start of MODEL   11
 8115    H    ASP  85           H        ASP  85 -11.845   5.513   5.248
  Start of MODEL   11
 8116    HA   ASP  85           HA       ASP  85 -14.591   4.733   4.728
  Start of MODEL   11
 8117    HB2  ASP  85           HB2      ASP  85 -14.768   6.940   5.867
  Start of MODEL   11
 8118    HB3  ASP  85           HB3      ASP  85 -13.761   7.641   4.603
  Start of MODEL   11
 8119    H    ARG  86           H        ARG  86 -15.156   4.791   2.548
  Start of MODEL   11
 8120    HA   ARG  86           HA       ARG  86 -13.162   4.111   0.713
  Start of MODEL   11
 8121    HB2  ARG  86           HB2      ARG  86 -15.452   3.343   0.513
  Start of MODEL   11
 8122    HB3  ARG  86           HB3      ARG  86 -16.019   4.989   0.302
  Start of MODEL   11
 8123    HG2  ARG  86           HG2      ARG  86 -14.710   5.096  -1.820
  Start of MODEL   11
 8124    HG3  ARG  86           HG3      ARG  86 -14.363   3.374  -1.621
  Start of MODEL   11
 8125    HD2  ARG  86           HD2      ARG  86 -16.806   2.948  -1.533
  Start of MODEL   11
 8126    HD3  ARG  86           HD3      ARG  86 -17.080   4.655  -1.874
  Start of MODEL   11
 8127    HE   ARG  86           HE       ARG  86 -15.504   3.088  -3.771
  Start of MODEL   11
 8128   HH11  ARG  86          HH11      ARG  86 -18.404   4.876  -2.998
  Start of MODEL   11
 8129   HH12  ARG  86          HH12      ARG  86 -19.050   4.784  -4.613
  Start of MODEL   11
 8130   HH21  ARG  86          HH21      ARG  86 -16.344   2.998  -5.923
  Start of MODEL   11
 8131   HH22  ARG  86          HH22      ARG  86 -17.882   3.733  -6.264
  Start of MODEL   11
 8132    H    ALA  87           H        ALA  87 -14.874   7.158   1.241
  Start of MODEL   11
 8133    HA   ALA  87           HA       ALA  87 -14.041   8.408  -1.157
  Start of MODEL   11
 8134    HB2  ALA  87           HB1      ALA  87 -14.783  10.483  -0.135
  Start of MODEL   11
 8135    HB1  ALA  87           HB2      ALA  87 -14.810   9.708   1.448
  Start of MODEL   11
 8136    HB3  ALA  87           HB3      ALA  87 -15.937   9.189   0.195
  Start of MODEL   11
 8137    H    SER  88           H        SER  88 -12.647   8.355   2.099
  Start of MODEL   11
 8138    HA   SER  88           HA       SER  88 -10.617  10.255   1.605
  Start of MODEL   11
 8139    HB2  SER  88           HB2      SER  88 -10.531   7.930   3.548
  Start of MODEL   11
 8140    HB3  SER  88           HB3      SER  88  -9.545   9.391   3.612
  Start of MODEL   11
 8141    HG   SER  88           HG       SER  88 -11.550  10.571   3.859
  Start of MODEL   11
 8142    H    ALA  89           H        ALA  89 -10.730   6.734   1.357
  Start of MODEL   11
 8143    HA   ALA  89           HA       ALA  89  -8.032   6.325   0.652
  Start of MODEL   11
 8144    HB3  ALA  89           HB1      ALA  89  -9.505   4.527   1.419
  Start of MODEL   11
 8145    HB2  ALA  89           HB2      ALA  89  -8.753   4.131  -0.127
  Start of MODEL   11
 8146    HB1  ALA  89           HB3      ALA  89 -10.439   4.651  -0.072
  Start of MODEL   11
 8147    H    GLU  90           H        GLU  90 -10.930   6.877  -1.290
  Start of MODEL   11
 8148    HA   GLU  90           HA       GLU  90  -9.694   6.345  -3.770
  Start of MODEL   11
 8149    HB2  GLU  90           HB2      GLU  90 -12.171   6.279  -3.259
  Start of MODEL   11
 8150    HB3  GLU  90           HB3      GLU  90 -12.151   8.033  -3.388
  Start of MODEL   11
 8151    HG2  GLU  90           HG2      GLU  90 -10.885   6.619  -5.611
  Start of MODEL   11
 8152    HG3  GLU  90           HG3      GLU  90 -12.616   6.332  -5.437
  Start of MODEL   11
 8153    H    ARG  91           H        ARG  91 -10.243   9.345  -1.965
  Start of MODEL   11
 8154    HA   ARG  91           HA       ARG  91  -9.438  11.067  -4.064
  Start of MODEL   11
 8155    HB2  ARG  91           HB2      ARG  91  -9.206  11.569  -1.090
  Start of MODEL   11
 8156    HB3  ARG  91           HB3      ARG  91  -9.139  12.791  -2.351
  Start of MODEL   11
 8157    HG2  ARG  91           HG2      ARG  91 -11.475  11.224  -1.349
  Start of MODEL   11
 8158    HG3  ARG  91           HG3      ARG  91 -11.296  12.970  -1.523
  Start of MODEL   11
 8159    HD2  ARG  91           HD2      ARG  91 -11.491  11.008  -3.807
  Start of MODEL   11
 8160    HD3  ARG  91           HD3      ARG  91 -12.825  11.980  -3.194
  Start of MODEL   11
 8161    HE   ARG  91           HE       ARG  91 -10.971  13.850  -3.796
  Start of MODEL   11
 8162   HH11  ARG  91          HH11      ARG  91 -12.119  11.070  -5.598
  Start of MODEL   11
 8163   HH12  ARG  91          HH12      ARG  91 -12.127  11.913  -7.127
  Start of MODEL   11
 8164   HH21  ARG  91          HH21      ARG  91 -10.876  14.928  -5.823
  Start of MODEL   11
 8165   HH22  ARG  91          HH22      ARG  91 -11.380  14.088  -7.259
  Start of MODEL   11
 8166    H    ALA  92           H        ALA  92  -7.692   9.434  -1.486
  Start of MODEL   11
 8167    HA   ALA  92           HA       ALA  92  -5.145  10.487  -2.001
  Start of MODEL   11
 8168    HB2  ALA  92           HB1      ALA  92  -4.295   8.553  -0.794
  Start of MODEL   11
 8169    HB1  ALA  92           HB2      ALA  92  -5.852   7.743  -0.966
  Start of MODEL   11
 8170    HB3  ALA  92           HB3      ALA  92  -5.723   9.203   0.017
  Start of MODEL   11
 8171    H    CYS  93           H        CYS  93  -6.912   7.818  -3.453
  Start of MODEL   11
 8172    HA   CYS  93           HA       CYS  93  -4.635   6.950  -5.012
  Start of MODEL   11
 8173    HB2  CYS  93           HB2      CYS  93  -7.507   6.021  -5.078
  Start of MODEL   11
 8174    HB3  CYS  93           HB3      CYS  93  -6.162   5.248  -5.911
  Start of MODEL   11
 8175    HG   CYS  93           HG       CYS  93  -6.600   5.486  -2.529
  Start of MODEL   11
 8176    H    LYS  94           H        LYS  94  -6.869   9.403  -5.351
  Start of MODEL   11
 8177    HA   LYS  94           HA       LYS  94  -7.703   9.043  -8.026
  Start of MODEL   11
 8178    HB2  LYS  94           HB2      LYS  94  -8.678  10.620  -6.212
  Start of MODEL   11
 8179    HB3  LYS  94           HB3      LYS  94  -7.481  11.770  -6.794
  Start of MODEL   11
 8180    HG2  LYS  94           HG2      LYS  94  -9.685  12.075  -7.850
  Start of MODEL   11
 8181    HG3  LYS  94           HG3      LYS  94  -8.416  11.692  -9.018
  Start of MODEL   11
 8182    HD2  LYS  94           HD2      LYS  94  -9.137   9.384  -9.106
  Start of MODEL   11
 8183    HD3  LYS  94           HD3      LYS  94 -10.337   9.680  -7.845
  Start of MODEL   11
 8184    HE2  LYS  94           HE2      LYS  94 -11.449   9.642  -9.961
  Start of MODEL   11
 8185    HE3  LYS  94           HE3      LYS  94 -11.451  11.298  -9.364
  Start of MODEL   11
 8186    HZ1  LYS  94           HZ1      LYS  94  -9.630  10.194 -11.436
  Start of MODEL   11
 8187    HZ3  LYS  94           HZ2      LYS  94  -9.590  11.781 -10.847
  Start of MODEL   11
 8188    HZ2  LYS  94           HZ3      LYS  94 -10.941  11.224 -11.704
  Start of MODEL   11
 8189    H    ASP  95           H        ASP  95  -4.879  10.623  -6.658
  Start of MODEL   11
 8190    HA   ASP  95           HA       ASP  95  -3.856  10.852  -9.412
  Start of MODEL   11
 8191    HB2  ASP  95           HB2      ASP  95  -3.890  12.988  -7.984
  Start of MODEL   11
 8192    HB3  ASP  95           HB3      ASP  95  -2.637  12.224  -7.010
  Start of MODEL   11
 8193    HA   PRO  96           HA       PRO  96  -1.994   7.118  -7.822
  Start of MODEL   11
 8194    HB2  PRO  96           HB2      PRO  96  -0.959   6.259 -10.179
  Start of MODEL   11
 8195    HB3  PRO  96           HB3      PRO  96  -2.668   6.112  -9.763
  Start of MODEL   11
 8196    HG2  PRO  96           HG2      PRO  96  -1.311   8.163 -11.475
  Start of MODEL   11
 8197    HG3  PRO  96           HG3      PRO  96  -2.841   7.307 -11.747
  Start of MODEL   11
 8198    HD2  PRO  96           HD2      PRO  96  -2.727   9.839 -10.796
  Start of MODEL   11
 8199    HD3  PRO  96           HD3      PRO  96  -4.017   8.704 -10.343
  Start of MODEL   11
 8200    H    ASN  97           H        ASN  97  -0.419   9.916  -8.515
  Start of MODEL   11
 8201    HA   ASN  97           HA       ASN  97   2.181   8.645  -7.994
  Start of MODEL   11
 8202    HB2  ASN  97           HB2      ASN  97   1.540  10.726 -10.066
  Start of MODEL   11
 8203    HB3  ASN  97           HB3      ASN  97   3.171  10.538  -9.429
  Start of MODEL   11
 8204   HD21  ASN  97          HD21      ASN  97   2.983   7.666  -9.125
  Start of MODEL   11
 8205   HD22  ASN  97          HD22      ASN  97   3.070   7.007 -10.721
  Start of MODEL   11
 8206    HA   PRO  98           HA       PRO  98   1.432  12.253  -5.085
  Start of MODEL   11
 8207    HB2  PRO  98           HB2      PRO  98   1.299  10.891  -2.762
  Start of MODEL   11
 8208    HB3  PRO  98           HB3      PRO  98  -0.123  11.177  -3.771
  Start of MODEL   11
 8209    HG2  PRO  98           HG2      PRO  98   1.557   8.725  -3.507
  Start of MODEL   11
 8210    HG3  PRO  98           HG3      PRO  98  -0.204   8.870  -3.645
  Start of MODEL   11
 8211    HD2  PRO  98           HD2      PRO  98   1.455   8.223  -5.734
  Start of MODEL   11
 8212    HD3  PRO  98           HD3      PRO  98  -0.131   8.987  -5.929
  Start of MODEL   11
 8213    H    ILE  99           H        ILE  99   3.083  13.211  -3.929
  Start of MODEL   11
 8214    HA   ILE  99           HA       ILE  99   5.664  11.915  -3.913
  Start of MODEL   11
 8215    HB   ILE  99           HB       ILE  99   4.864  14.587  -2.737
  Start of MODEL   11
 8216   HD12  ILE  99          HD11      ILE  99   6.345  14.201  -6.717
  Start of MODEL   11
 8217   HD11  ILE  99          HD12      ILE  99   6.035  12.727  -5.804
  Start of MODEL   11
 8218   HD13  ILE  99          HD13      ILE  99   7.408  13.749  -5.385
  Start of MODEL   11
 8219    H    ILE 100           H        ILE 100   6.110  10.440  -2.404
  Start of MODEL   11
 8220    HA   ILE 100           HA       ILE 100   5.351  11.020   0.387
  Start of MODEL   11
 8221    HB   ILE 100           HB       ILE 100   5.496   8.279  -0.888
  Start of MODEL   11
 8222   HD11  ILE 100          HD11      ILE 100   2.800   7.411   0.320
  Start of MODEL   11
 8223   HD13  ILE 100          HD12      ILE 100   3.202   7.220  -1.385
  Start of MODEL   11
 8224   HD12  ILE 100          HD13      ILE 100   1.752   8.102  -0.915
  Start of MODEL   11
 8225    H    ASP 101           H        ASP 101   7.049  11.307   1.620
  Start of MODEL   11
 8226    HA   ASP 101           HA       ASP 101   9.139  11.270   2.496
  Start of MODEL   11
 8227    HB2  ASP 101           HB2      ASP 101   8.526   8.555   1.831
  Start of MODEL   11
 8228    HB3  ASP 101           HB3      ASP 101  10.239   8.838   1.538
  Start of MODEL   11
 8229    H    GLY 102           H        GLY 102   8.865  12.613   0.096
  Start of MODEL   11
 8230    HA2  GLY 102           HA2      GLY 102  10.251  13.736  -1.356
  Start of MODEL   11
 8231    HA3  GLY 102           HA3      GLY 102  11.596  12.821  -0.706
  Start of MODEL   11
 8232    H    ARG 103           H        ARG 103   9.066  10.868  -1.871
  Start of MODEL   11
 8233    HA   ARG 103           HA       ARG 103  10.346  10.642  -4.507
  Start of MODEL   11
 8234    HB2  ARG 103           HB2      ARG 103  11.270   8.864  -3.145
  Start of MODEL   11
 8235    HB3  ARG 103           HB3      ARG 103   9.665   8.374  -2.632
  Start of MODEL   11
 8236    HG2  ARG 103           HG2      ARG 103  10.434   6.815  -4.248
  Start of MODEL   11
 8237    HG3  ARG 103           HG3      ARG 103   9.157   7.775  -4.996
  Start of MODEL   11
 8238    HD2  ARG 103           HD2      ARG 103  10.891   9.172  -6.072
  Start of MODEL   11
 8239    HD3  ARG 103           HD3      ARG 103  12.132   8.134  -5.368
  Start of MODEL   11
 8240    HE   ARG 103           HE       ARG 103  10.210   6.662  -6.892
  Start of MODEL   11
 8241   HH11  ARG 103          HH11      ARG 103  13.088   8.635  -7.146
  Start of MODEL   11
 8242   HH12  ARG 103          HH12      ARG 103  13.632   7.885  -8.619
  Start of MODEL   11
 8243   HH21  ARG 103          HH21      ARG 103  10.900   5.703  -8.859
  Start of MODEL   11
 8244   HH22  ARG 103          HH22      ARG 103  12.347   6.271  -9.634
  Start of MODEL   11
 8245    H    LYS 104           H        LYS 104   8.939  10.533  -6.172
  Start of MODEL   11
 8246    HA   LYS 104           HA       LYS 104   6.120  10.593  -5.688
  Start of MODEL   11
 8247    HB2  LYS 104           HB2      LYS 104   7.094  11.787  -7.603
  Start of MODEL   11
 8248    HB3  LYS 104           HB3      LYS 104   7.649  10.264  -8.283
  Start of MODEL   11
 8249    HG2  LYS 104           HG2      LYS 104   5.403   9.546  -8.686
  Start of MODEL   11
 8250    HG3  LYS 104           HG3      LYS 104   4.755  10.935  -7.807
  Start of MODEL   11
 8251    HD2  LYS 104           HD2      LYS 104   6.517  11.293 -10.210
  Start of MODEL   11
 8252    HD3  LYS 104           HD3      LYS 104   4.785  11.012 -10.387
  Start of MODEL   11
 8253    HE2  LYS 104           HE2      LYS 104   5.922  13.203  -8.666
  Start of MODEL   11
 8254    HE3  LYS 104           HE3      LYS 104   5.554  13.431 -10.374
  Start of MODEL   11
 8255    HZ1  LYS 104           HZ1      LYS 104   3.576  12.561  -8.331
  Start of MODEL   11
 8256    HZ3  LYS 104           HZ2      LYS 104   3.259  12.939  -9.948
  Start of MODEL   11
 8257    HZ2  LYS 104           HZ3      LYS 104   3.750  14.154  -8.881
  Start of MODEL   11
 8258    H    ALA 105           H        ALA 105   4.778   8.946  -5.494
  Start of MODEL   11
 8259    HA   ALA 105           HA       ALA 105   5.860   6.243  -5.906
  Start of MODEL   11
 8260    HB1  ALA 105           HB1      ALA 105   5.359   6.908  -3.566
  Start of MODEL   11
 8261    HB3  ALA 105           HB2      ALA 105   4.451   5.499  -4.112
  Start of MODEL   11
 8262    HB2  ALA 105           HB3      ALA 105   3.661   7.075  -4.018
  Start of MODEL   11
 8263    H    ASN 106           H        ASN 106   4.281   4.572  -6.413
  Start of MODEL   11
 8264    HA   ASN 106           HA       ASN 106   2.178   5.583  -8.221
  Start of MODEL   11
 8265    HB2  ASN 106           HB2      ASN 106   3.745   2.993  -8.230
  Start of MODEL   11
 8266    HB3  ASN 106           HB3      ASN 106   2.273   3.197  -9.170
  Start of MODEL   11
 8267   HD21  ASN 106          HD21      ASN 106   3.404   2.870 -11.096
  Start of MODEL   11
 8268   HD22  ASN 106          HD22      ASN 106   4.437   4.084 -11.760
  Start of MODEL   11
 8269    H    VAL 107           H        VAL 107   0.220   5.522  -7.293
  Start of MODEL   11
 8270    HA   VAL 107           HA       VAL 107  -0.307   3.365  -5.349
  Start of MODEL   11
 8271    HB   VAL 107           HB       VAL 107  -1.312   6.206  -5.195
  Start of MODEL   11
 8272    H    ASN 108           H        ASN 108  -2.230   2.357  -5.382
  Start of MODEL   11
 8273    HA   ASN 108           HA       ASN 108  -4.547   3.512  -6.630
  Start of MODEL   11
 8274    HB2  ASN 108           HB2      ASN 108  -4.956   1.469  -8.076
  Start of MODEL   11
 8275    HB3  ASN 108           HB3      ASN 108  -3.695   2.553  -8.637
  Start of MODEL   11
 8276   HD21  ASN 108          HD21      ASN 108  -3.226   0.263  -5.998
  Start of MODEL   11
 8277   HD22  ASN 108          HD22      ASN 108  -2.142  -0.767  -6.862
  Start of MODEL   11
 8278    H    LEU 109           H        LEU 109  -6.524   2.340  -6.064
  Start of MODEL   11
 8279    HA   LEU 109           HA       LEU 109  -6.587   1.108  -3.580
  Start of MODEL   11
 8280    HB2  LEU 109           HB2      LEU 109  -8.462   0.701  -5.916
  Start of MODEL   11
 8281    HB3  LEU 109           HB3      LEU 109  -8.796   0.191  -4.271
  Start of MODEL   11
 8282    HG   LEU 109           HG       LEU 109  -8.374   3.053  -5.134
  Start of MODEL   11
 8283   HD13  LEU 109          HD11      LEU 109 -10.428   2.114  -6.071
  Start of MODEL   11
 8284   HD12  LEU 109          HD12      LEU 109 -10.783   3.301  -4.814
  Start of MODEL   11
 8285   HD11  LEU 109          HD13      LEU 109 -10.921   1.576  -4.465
  Start of MODEL   11
 8286   HD23  LEU 109          HD21      LEU 109  -9.275   1.862  -2.511
  Start of MODEL   11
 8287   HD22  LEU 109          HD22      LEU 109  -9.241   3.581  -2.895
  Start of MODEL   11
 8288   HD21  LEU 109          HD23      LEU 109  -7.739   2.665  -2.821
  Start of MODEL   11
 8289    H    ALA 110           H        ALA 110  -6.167  -0.893  -2.830
  Start of MODEL   11
 8290    HA   ALA 110           HA       ALA 110  -4.278  -2.342  -4.251
  Start of MODEL   11
 8291    HB3  ALA 110           HB1      ALA 110  -4.265  -3.871  -2.397
  Start of MODEL   11
 8292    HB2  ALA 110           HB2      ALA 110  -5.829  -3.271  -1.850
  Start of MODEL   11
 8293    HB1  ALA 110           HB3      ALA 110  -4.417  -2.214  -1.811
  Start of MODEL   11
 8294    H    TYR 111           H        TYR 111  -7.740  -2.912  -4.057
  Start of MODEL   11
 8295    HA   TYR 111           HA       TYR 111  -7.628  -5.615  -4.899
  Start of MODEL   11
 8296    HB2  TYR 111           HB2      TYR 111  -9.968  -5.570  -5.045
  Start of MODEL   11
 8297    HB3  TYR 111           HB3      TYR 111  -9.587  -4.420  -3.770
  Start of MODEL   11
 8298    HD1  TYR 111           HD1      TYR 111  -9.117  -1.931  -4.872
  Start of MODEL   11
 8299    HD2  TYR 111           HD2      TYR 111 -11.729  -4.929  -6.392
  Start of MODEL   11
 8300    HE1  TYR 111           HE1      TYR 111 -10.419  -0.204  -6.033
  Start of MODEL   11
 8301    HE2  TYR 111           HE2      TYR 111 -13.035  -3.206  -7.557
  Start of MODEL   11
 8302    HH   TYR 111           HH       TYR 111 -13.474  -0.751  -7.317
  Start of MODEL   11
 8303    H    LEU 112           H        LEU 112  -7.250  -2.683  -6.621
  Start of MODEL   11
 8304    HA   LEU 112           HA       LEU 112  -8.146  -3.590  -9.166
  Start of MODEL   11
 8305    HB2  LEU 112           HB2      LEU 112  -6.377  -1.297  -8.351
  Start of MODEL   11
 8306    HB3  LEU 112           HB3      LEU 112  -6.870  -1.590 -10.009
  Start of MODEL   11
 8307    HG   LEU 112           HG       LEU 112  -8.690  -0.960  -7.686
  Start of MODEL   11
 8308   HD12  LEU 112          HD11      LEU 112  -9.131   1.104  -8.882
  Start of MODEL   11
 8309   HD11  LEU 112          HD12      LEU 112  -8.021   0.621 -10.166
  Start of MODEL   11
 8310   HD13  LEU 112          HD13      LEU 112  -7.404   0.952  -8.545
  Start of MODEL   11
 8311   HD22  LEU 112          HD21      LEU 112 -10.492  -1.008  -9.316
  Start of MODEL   11
 8312   HD21  LEU 112          HD22      LEU 112  -9.673  -2.573  -9.259
  Start of MODEL   11
 8313   HD23  LEU 112          HD23      LEU 112  -9.353  -1.455 -10.584
  Start of MODEL   11
 8314    H    GLY 113           H        GLY 113  -5.444  -4.532  -7.425
  Start of MODEL   11
 8315    HA2  GLY 113           HA2      GLY 113  -4.160  -5.533  -9.829
  Start of MODEL   11
 8316    HA3  GLY 113           HA3      GLY 113  -3.207  -4.408  -8.869
  Start of MODEL   11
 8317    H    ALA 114           H        ALA 114  -5.374  -6.266  -7.049
  Start of MODEL   11
 8318    HA   ALA 114           HA       ALA 114  -3.278  -7.500  -5.601
  Start of MODEL   11
 8319    HB3  ALA 114           HB1      ALA 114  -5.370  -6.826  -4.539
  Start of MODEL   11
 8320    HB2  ALA 114           HB2      ALA 114  -5.051  -8.543  -4.295
  Start of MODEL   11
 8321    HB1  ALA 114           HB3      ALA 114  -6.242  -8.029  -5.489
  Start of MODEL   11
 8322    H    LYS 115           H        LYS 115  -2.384  -9.436  -5.782
  Start of MODEL   11
 8323    HA   LYS 115           HA       LYS 115  -3.026 -11.092  -8.044
  Start of MODEL   11
 8324    HB2  LYS 115           HB2      LYS 115  -1.010 -11.519  -5.824
  Start of MODEL   11
 8325    HB3  LYS 115           HB3      LYS 115  -1.102 -12.436  -7.323
  Start of MODEL   11
 8326    HG2  LYS 115           HG2      LYS 115  -0.446  -9.506  -7.050
  Start of MODEL   11
 8327    HG3  LYS 115           HG3      LYS 115   0.669 -10.810  -7.465
  Start of MODEL   11
 8328    HD2  LYS 115           HD2      LYS 115  -0.535 -11.223  -9.524
  Start of MODEL   11
 8329    HD3  LYS 115           HD3      LYS 115  -1.737 -10.004  -9.098
  Start of MODEL   11
 8330    HE2  LYS 115           HE2      LYS 115  -0.015  -8.281  -9.152
  Start of MODEL   11
 8331    HE3  LYS 115           HE3      LYS 115   1.194  -9.494  -9.573
  Start of MODEL   11
 8332    HZ3  LYS 115           HZ1      LYS 115  -0.085  -9.962 -11.602
  Start of MODEL   11
 8333    HZ2  LYS 115           HZ2      LYS 115   0.473  -8.366 -11.548
  Start of MODEL   11
 8334    HZ1  LYS 115           HZ3      LYS 115  -1.157  -8.710 -11.215
  Start of MODEL   11
 8335    HA   PRO 116           HA       PRO 116  -5.771 -14.040  -6.183
  Start of MODEL   11
 8336    HB2  PRO 116           HB2      PRO 116  -4.006 -16.088  -7.440
  Start of MODEL   11
 8337    HB3  PRO 116           HB3      PRO 116  -5.759 -15.887  -7.556
  Start of MODEL   11
 8338    HG2  PRO 116           HG2      PRO 116  -4.174 -15.190  -9.577
  Start of MODEL   11
 8339    HG3  PRO 116           HG3      PRO 116  -5.599 -14.223  -9.154
  Start of MODEL   11
 8340    HD2  PRO 116           HD2      PRO 116  -2.714 -13.685  -8.631
  Start of MODEL   11
 8341    HD3  PRO 116           HD3      PRO 116  -4.021 -12.551  -9.020
  Start of MODEL   11
 8342    H    ARG 117           H        ARG 117  -5.741 -14.641  -4.146
  Start of MODEL   11
 8343    HA   ARG 117           HA       ARG 117  -3.274 -15.797  -3.027
  Start of MODEL   11
 8344    HB2  ARG 117           HB2      ARG 117  -5.256 -13.977  -1.632
  Start of MODEL   11
 8345    HB3  ARG 117           HB3      ARG 117  -3.913 -14.789  -0.839
  Start of MODEL   11
 8346    HG2  ARG 117           HG2      ARG 117  -3.625 -12.810  -3.091
  Start of MODEL   11
 8347    HG3  ARG 117           HG3      ARG 117  -3.471 -12.419  -1.376
  Start of MODEL   11
 8348    HD2  ARG 117           HD2      ARG 117  -1.800 -14.550  -2.680
  Start of MODEL   11
 8349    HD3  ARG 117           HD3      ARG 117  -1.316 -12.856  -2.693
  Start of MODEL   11
 8350    HE   ARG 117           HE       ARG 117  -1.653 -13.165  -0.111
  Start of MODEL   11
 8351   HH11  ARG 117          HH11      ARG 117  -0.269 -15.471  -2.345
  Start of MODEL   11
 8352   HH12  ARG 117          HH12      ARG 117   0.843 -16.134  -1.195
  Start of MODEL   11
 8353   HH21  ARG 117          HH21      ARG 117  -0.158 -14.001   1.419
  Start of MODEL   11
 8354   HH22  ARG 117          HH22      ARG 117   0.921 -15.276   0.959
  Start of MODEL   11
 8355    H    THR 118           H        THR 118  -4.105 -17.853  -3.603
  Start of MODEL   11
 8356    HA   THR 118           HA       THR 118  -6.560 -18.764  -2.367
  Start of MODEL   11
 8357    HB   THR 118           HB       THR 118  -5.703 -20.991  -3.447
  Start of MODEL   11
 8358    HG1  THR 118           HG1      THR 118  -3.673 -20.517  -4.076
  Start of MODEL   11
 8359   HG21  THR 118          HG21      THR 118  -6.523 -18.644  -5.164
  Start of MODEL   11
 8360   HG23  THR 118          HG22      THR 118  -7.622 -19.687  -4.260
  Start of MODEL   11
 8361   HG22  THR 118          HG23      THR 118  -6.674 -20.349  -5.594
  Start of MODEL   11
 8362    H    ASN 119           H        ASN 119  -6.252 -18.880  -0.193
  Start of MODEL   11
 8363    HA   ASN 119           HA       ASN 119  -5.682 -19.788   1.799
  Start of MODEL   11
 8364    HB2  ASN 119           HB2      ASN 119  -4.342 -21.877   0.073
  Start of MODEL   11
 8365    HB3  ASN 119           HB3      ASN 119  -4.432 -21.973   1.829
  Start of MODEL   11
 8366   HD21  ASN 119          HD21      ASN 119  -5.557 -23.676  -0.306
  Start of MODEL   11
 8367   HD22  ASN 119          HD22      ASN 119  -7.253 -23.765   0.027
  Start of MODEL   11
 8368    H    VAL 120           H        VAL 120  -4.497 -18.158   2.587
  Start of MODEL   11
 8369    HA   VAL 120           HA       VAL 120  -1.724 -17.816   1.874
  Start of MODEL   11
 8370    HB   VAL 120           HB       VAL 120  -3.364 -16.413   3.987
  Start of MODEL   11
 8371    H    GLN 121           H        GLN 121  -0.383 -19.315   2.627
  Start of MODEL   11
 8372    HA   GLN 121           HA       GLN 121   0.084 -19.482   5.441
  Start of MODEL   11
 8373    HB2  GLN 121           HB2      GLN 121  -0.025 -22.033   5.423
  Start of MODEL   11
 8374    HB3  GLN 121           HB3      GLN 121  -1.555 -21.170   5.495
  Start of MODEL   11
 8375    HG2  GLN 121           HG2      GLN 121  -1.898 -21.548   3.119
  Start of MODEL   11
 8376    HG3  GLN 121           HG3      GLN 121  -0.340 -22.367   3.015
  Start of MODEL   11
 8377   HE21  GLN 121          HE21      GLN 121  -0.653 -23.691   5.582
  Start of MODEL   11
 8378   HE22  GLN 121          HE22      GLN 121  -1.816 -24.956   5.347
  Start of MODEL   11
 8379    H5'   DG   1           H5'       DG   1  21.760  -2.102  -4.328
  Start of MODEL   11
 8380    H4'   DG   1           H4'       DG   1  19.970  -3.308  -5.677
  Start of MODEL   11
 8381    H3'   DG   1           H3'       DG   1  18.725  -0.924  -6.017
  Start of MODEL   11
 8382    H2'   DG   1           H2'       DG   1  18.091  -0.507  -3.746
  Start of MODEL   11
 8383    H1'   DG   1           H1'       DG   1  17.535  -3.484  -3.374
  Start of MODEL   11
 8384    H8    DG   1           H8        DG   1  20.005  -1.084  -1.652
  Start of MODEL   11
 8385    H1    DG   1           H1        DG   1  15.252  -3.292   2.054
  Start of MODEL   11
 8386    H22   DG   1           H21       DG   1  14.090  -4.738  -0.878
  Start of MODEL   11
 8387    H21   DG   1           H22       DG   1  13.847  -4.485   0.835
  Start of MODEL   11
 8388   HO5'   DG   1           H5T       DG   1  19.854  -0.435  -3.882
  Start of MODEL   11
 8389   H5''   DG   1          5H''       DG   1  21.363  -1.483  -5.938
  Start of MODEL   11
 8390   H2''   DG   1          2H''       DG   1  16.698  -1.431  -4.283
  Start of MODEL   11
 8391    H5'   DG   2           H5'       DG   2  14.429  -3.662  -7.458
  Start of MODEL   11
 8392    H4'   DG   2           H4'       DG   2  12.824  -2.905  -9.058
  Start of MODEL   11
 8393    H3'   DG   2           H3'       DG   2  14.672  -1.686 -10.553
  Start of MODEL   11
 8394    H2'   DG   2           H2'       DG   2  15.299   0.037  -8.994
  Start of MODEL   11
 8395    H1'   DG   2           H1'       DG   2  12.350   0.484  -8.349
  Start of MODEL   11
 8396    H8    DG   2           H8        DG   2  15.824   1.349  -7.551
  Start of MODEL   11
 8397    H1    DG   2           H1        DG   2  11.952   1.922  -2.456
  Start of MODEL   11
 8398    H22   DG   2           H21       DG   2   9.689   0.130  -4.394
  Start of MODEL   11
 8399    H21   DG   2           H22       DG   2  10.008   0.942  -2.876
  Start of MODEL   11
 8400   H5''   DG   2          5H''       DG   2  15.217  -3.515  -9.042
  Start of MODEL   11
 8401   H2''   DG   2          2H''       DG   2  14.083   0.872  -9.953
  Start of MODEL   11
 8402    H5'   DT   3           H5'       DT   3  10.580  -3.302  -9.273
  Start of MODEL   11
 8403    H4'   DT   3           H4'       DT   3   8.704  -4.811  -9.734
  Start of MODEL   11
 8404    H3'   DT   3           H3'       DT   3   9.260  -4.876 -12.349
  Start of MODEL   11
 8405    H2'   DT   3           H2'       DT   3   8.918  -2.520 -12.781
  Start of MODEL   11
 8406    H1'   DT   3           H1'       DT   3   6.348  -2.723 -11.129
  Start of MODEL   11
 8407    H3    DT   3           H3        DT   3   6.076   1.550 -12.926
  Start of MODEL   11
 8408    H72   DT   3           H71       DT   3   9.404   1.314  -8.687
  Start of MODEL   11
 8409    H71   DT   3           H72       DT   3   8.472   2.780  -9.075
  Start of MODEL   11
 8410    H73   DT   3           H73       DT   3   9.915   2.366 -10.029
  Start of MODEL   11
 8411    H6    DT   3           H6        DT   3   8.774  -0.710  -9.706
  Start of MODEL   11
 8412   H5''   DT   3          5H''       DT   3  10.955  -4.505 -10.524
  Start of MODEL   11
 8413   H2''   DT   3          2H''       DT   3   7.370  -3.215 -13.266
  Start of MODEL   11
 8414    H5'   DG   4           H5'       DG   4   4.819  -7.199  -9.369
  Start of MODEL   11
 8415    H4'   DG   4           H4'       DG   4   6.094  -5.628  -7.728
  Start of MODEL   11
 8416    H3'   DG   4           H3'       DG   4   3.282  -5.907  -8.291
  Start of MODEL   11
 8417    H2'   DG   4           H2'       DG   4   2.799  -3.640  -8.581
  Start of MODEL   11
 8418    H1'   DG   4           H1'       DG   4   5.485  -2.837  -7.383
  Start of MODEL   11
 8419    H8    DG   4           H8        DG   4   5.970  -0.453  -8.047
  Start of MODEL   11
 8420    H1    DG   4           H1        DG   4   1.907  -0.724 -13.017
  Start of MODEL   11
 8421    H22   DG   4           H21       DG   4   1.532  -4.056 -12.112
  Start of MODEL   11
 8422    H21   DG   4           H22       DG   4   1.082  -2.768 -13.206
  Start of MODEL   11
 8423   H5''   DG   4          5H''       DG   4   5.101  -5.884 -10.530
  Start of MODEL   11
 8424   H2''   DG   4          2H''       DG   4   3.258  -3.437  -6.891
  Start of MODEL   11
 8425    H5'   DT   5           H5'       DT   5   3.813  -9.099  -3.535
  Start of MODEL   11
 8426    H4'   DT   5           H4'       DT   5   2.847  -7.866  -1.867
  Start of MODEL   11
 8427    H3'   DT   5           H3'       DT   5   1.302  -9.920  -2.693
  Start of MODEL   11
 8428    H2'   DT   5           H2'       DT   5  -0.076  -8.647  -4.213
  Start of MODEL   11
 8429    H1'   DT   5           H1'       DT   5  -0.170  -6.474  -2.050
  Start of MODEL   11
 8430    H3    DT   5           H3        DT   5  -3.045  -4.155  -4.610
  Start of MODEL   11
 8431    H72   DT   5           H71       DT   5   1.032  -3.962  -7.498
  Start of MODEL   11
 8432    H73   DT   5           H72       DT   5   0.933  -5.709  -7.818
  Start of MODEL   11
 8433    H71   DT   5           H73       DT   5  -0.385  -4.632  -8.337
  Start of MODEL   11
 8434    H6    DT   5           H6        DT   5   1.132  -6.292  -5.449
  Start of MODEL   11
 8435   H5''   DT   5          5H''       DT   5   2.442  -8.882  -4.646
  Start of MODEL   11
 8436   H2''   DT   5          2H''       DT   5  -1.053  -8.651  -2.752
  Start of MODEL   11
 8437    H5'   DG   6           H5'       DG   6   2.623  -7.465   1.424
  Start of MODEL   11
 8438    H4'   DG   6           H4'       DG   6   3.452  -7.987   3.807
  Start of MODEL   11
 8439    H3'   DG   6           H3'       DG   6   2.048 -10.316   3.689
  Start of MODEL   11
 8440    H2'   DG   6           H2'       DG   6  -0.156  -9.402   3.644
  Start of MODEL   11
 8441    H1'   DG   6           H1'       DG   6   0.745  -7.169   5.525
  Start of MODEL   11
 8442    H8    DG   6           H8        DG   6  -1.148  -7.911   2.229
  Start of MODEL   11
 8443    H1    DG   6           H1        DG   6  -3.647  -3.314   5.956
  Start of MODEL   11
 8444    H22   DG   6           H21       DG   6  -0.906  -3.926   7.981
  Start of MODEL   11
 8445    H21   DG   6           H22       DG   6  -2.375  -3.015   7.718
  Start of MODEL   11
 8446   H5''   DG   6          5H''       DG   6   3.525  -8.957   1.746
  Start of MODEL   11
 8447   H2''   DG   6          2H''       DG   6   0.093  -9.473   5.382
  Start of MODEL   11
 8448    H5'   DC   7           H5'       DC   7   0.748 -12.282   4.344
  Start of MODEL   11
 8449    H4'   DC   7           H4'       DC   7   0.752 -14.775   4.997
  Start of MODEL   11
 8450    H3'   DC   7           H3'       DC   7   2.850 -14.293   6.612
  Start of MODEL   11
 8451   HO3'   DC   7           H3T       DC   7   2.272 -16.547   4.987
  Start of MODEL   11
 8452    H2'   DC   7           H2'       DC   7   4.441 -13.563   4.997
  Start of MODEL   11
 8453    H1'   DC   7           H1'       DC   7   3.455 -15.641   2.998
  Start of MODEL   11
 8454    H42   DC   7           H41       DC   7   6.014 -10.449  -0.263
  Start of MODEL   11
 8455    H41   DC   7           H42       DC   7   6.446 -11.893  -1.150
  Start of MODEL   11
 8456    H5    DC   7           H5        DC   7   4.739 -10.505   1.802
  Start of MODEL   11
 8457    H6    DC   7           H6        DC   7   3.604 -11.946   3.409
  Start of MODEL   11
 8458   H5''   DC   7          5H''       DC   7   0.638 -12.740   6.055
  Start of MODEL   11
 8459   H2''   DC   7          2H''       DC   7   4.756 -15.296   4.961
  Start of MODEL   12
 8460    H1   GLY  25           HT1      GLY  25 -14.186 -10.533  -6.150
  Start of MODEL   12
 8461    H2   GLY  25           HT2      GLY  25 -12.840  -9.978  -7.018
  Start of MODEL   12
 8462    H3   GLY  25           HT3      GLY  25 -13.807  -8.877  -6.164
  Start of MODEL   12
 8463    HA3  GLY  25           HA2      GLY  25 -13.161  -9.921  -4.070
  Start of MODEL   12
 8464    HA2  GLY  25           HA3      GLY  25 -11.775  -9.287  -4.950
  Start of MODEL   12
 8465    H    ALA  26           H        ALA  26 -10.151 -10.658  -4.380
  Start of MODEL   12
 8466    HA   ALA  26           HA       ALA  26 -10.110 -13.258  -5.532
  Start of MODEL   12
 8467    HB2  ALA  26           HB1      ALA  26  -7.880 -13.447  -4.559
  Start of MODEL   12
 8468    HB1  ALA  26           HB2      ALA  26  -8.169 -11.999  -3.591
  Start of MODEL   12
 8469    HB3  ALA  26           HB3      ALA  26  -8.097 -11.886  -5.352
  Start of MODEL   12
 8470    H    MET  27           H        MET  27 -10.452 -12.078  -2.209
  Start of MODEL   12
 8471    HA   MET  27           HA       MET  27 -11.543 -14.669  -1.451
  Start of MODEL   12
 8472    HB2  MET  27           HB2      MET  27  -8.989 -14.536  -0.989
  Start of MODEL   12
 8473    HB3  MET  27           HB3      MET  27  -9.421 -13.424   0.300
  Start of MODEL   12
 8474    HG2  MET  27           HG2      MET  27 -10.748 -15.134   1.377
  Start of MODEL   12
 8475    HG3  MET  27           HG3      MET  27 -10.436 -16.250   0.052
  Start of MODEL   12
 8476    HE3  MET  27           HE1      MET  27  -8.063 -17.297  -0.475
  Start of MODEL   12
 8477    HE2  MET  27           HE2      MET  27  -6.598 -16.936   0.439
  Start of MODEL   12
 8478    HE1  MET  27           HE3      MET  27  -7.344 -15.689  -0.560
  Start of MODEL   12
 8479    H    GLY  28           H        GLY  28 -11.661 -14.066   1.371
  Start of MODEL   12
 8480    HA2  GLY  28           HA2      GLY  28 -14.049 -12.493   1.281
  Start of MODEL   12
 8481    HA3  GLY  28           HA3      GLY  28 -13.332 -13.228   2.705
  Start of MODEL   12
 8482    H    SER  29           H        SER  29 -11.070 -11.298   1.101
  Start of MODEL   12
 8483    HA   SER  29           HA       SER  29 -11.175  -9.266   3.136
  Start of MODEL   12
 8484    HB2  SER  29           HB2      SER  29  -9.431  -9.417   0.666
  Start of MODEL   12
 8485    HB3  SER  29           HB3      SER  29  -9.161  -8.397   2.078
  Start of MODEL   12
 8486    HG   SER  29           HG       SER  29  -9.225 -10.573   3.225
  Start of MODEL   12
 8487    H    ARG  30           H        ARG  30 -13.509  -9.390   1.525
  Start of MODEL   12
 8488    HA   ARG  30           HA       ARG  30 -13.458  -7.283  -0.417
  Start of MODEL   12
 8489    HB2  ARG  30           HB2      ARG  30 -14.966  -9.101  -0.801
  Start of MODEL   12
 8490    HB3  ARG  30           HB3      ARG  30 -15.657  -8.957   0.803
  Start of MODEL   12
 8491    HG2  ARG  30           HG2      ARG  30 -15.948  -6.710  -1.150
  Start of MODEL   12
 8492    HG3  ARG  30           HG3      ARG  30 -16.985  -8.133  -1.268
  Start of MODEL   12
 8493    HD2  ARG  30           HD2      ARG  30 -17.608  -7.786   1.129
  Start of MODEL   12
 8494    HD3  ARG  30           HD3      ARG  30 -16.699  -6.277   1.091
  Start of MODEL   12
 8495    HE   ARG  30           HE       ARG  30 -18.654  -6.397  -0.990
  Start of MODEL   12
 8496   HH11  ARG  30          HH11      ARG  30 -18.199  -5.715   2.423
  Start of MODEL   12
 8497   HH12  ARG  30          HH12      ARG  30 -19.629  -4.734   2.551
  Start of MODEL   12
 8498   HH21  ARG  30          HH21      ARG  30 -20.558  -5.129  -0.818
  Start of MODEL   12
 8499   HH22  ARG  30          HH22      ARG  30 -20.987  -4.440   0.726
  Start of MODEL   12
 8500    H    ASP  31           H        ASP  31 -14.112  -7.564   2.954
  Start of MODEL   12
 8501    HA   ASP  31           HA       ASP  31 -15.511  -5.165   3.386
  Start of MODEL   12
 8502    HB2  ASP  31           HB2      ASP  31 -15.256  -6.937   5.071
  Start of MODEL   12
 8503    HB3  ASP  31           HB3      ASP  31 -13.530  -6.616   5.159
  Start of MODEL   12
 8504    H    THR  32           H        THR  32 -12.174  -5.919   2.925
  Start of MODEL   12
 8505    HA   THR  32           HA       THR  32 -11.295  -3.177   3.290
  Start of MODEL   12
 8506    HB   THR  32           HB       THR  32  -9.395  -5.123   2.195
  Start of MODEL   12
 8507    HG1  THR  32           HG1      THR  32 -10.606  -5.560   4.758
  Start of MODEL   12
 8508   HG21  THR  32          HG21      THR  32  -9.487  -3.399   4.662
  Start of MODEL   12
 8509   HG23  THR  32          HG22      THR  32  -8.679  -3.025   3.139
  Start of MODEL   12
 8510   HG22  THR  32          HG23      THR  32  -8.093  -4.350   4.145
  Start of MODEL   12
 8511    H    MET  33           H        MET  33 -12.829  -4.566   0.761
  Start of MODEL   12
 8512    HA   MET  33           HA       MET  33 -11.106  -4.452  -1.393
  Start of MODEL   12
 8513    HB2  MET  33           HB2      MET  33 -14.005  -4.500  -1.070
  Start of MODEL   12
 8514    HB3  MET  33           HB3      MET  33 -13.472  -3.724  -2.557
  Start of MODEL   12
 8515    HG2  MET  33           HG2      MET  33 -12.149  -5.701  -3.111
  Start of MODEL   12
 8516    HG3  MET  33           HG3      MET  33 -12.703  -6.482  -1.634
  Start of MODEL   12
 8517    HE1  MET  33           HE1      MET  33 -13.707  -5.182  -5.209
  Start of MODEL   12
 8518    HE3  MET  33           HE2      MET  33 -14.683  -4.188  -4.130
  Start of MODEL   12
 8519    HE2  MET  33           HE3      MET  33 -15.460  -5.379  -5.172
  Start of MODEL   12
 8520    H    PHE  34           H        PHE  34 -13.140  -1.699  -0.200
  Start of MODEL   12
 8521    HA   PHE  34           HA       PHE  34 -11.924  -0.098  -2.338
  Start of MODEL   12
 8522    HB2  PHE  34           HB2      PHE  34 -14.387   0.478  -0.675
  Start of MODEL   12
 8523    HB3  PHE  34           HB3      PHE  34 -13.810   1.424  -2.041
  Start of MODEL   12
 8524    HD1  PHE  34           HD1      PHE  34 -15.546  -1.613  -1.001
  Start of MODEL   12
 8525    HD2  PHE  34           HD2      PHE  34 -14.086   0.619  -4.321
  Start of MODEL   12
 8526    HE1  PHE  34           HE1      PHE  34 -16.920  -2.974  -2.519
  Start of MODEL   12
 8527    HE2  PHE  34           HE2      PHE  34 -15.461  -0.742  -5.843
  Start of MODEL   12
 8528    HZ   PHE  34           HZ       PHE  34 -16.890  -2.538  -4.929
  Start of MODEL   12
 8529    H    THR  35           H        THR  35 -11.434  -0.805   0.803
  Start of MODEL   12
 8530    HA   THR  35           HA       THR  35 -10.813   1.955   1.585
  Start of MODEL   12
 8531    HB   THR  35           HB       THR  35 -10.655   0.897   3.921
  Start of MODEL   12
 8532    HG1  THR  35           HG1      THR  35 -12.105  -1.039   3.978
  Start of MODEL   12
 8533   HG21  THR  35          HG21      THR  35 -13.301   1.039   2.468
  Start of MODEL   12
 8534   HG23  THR  35          HG22      THR  35 -12.477   2.365   3.292
  Start of MODEL   12
 8535   HG22  THR  35          HG23      THR  35 -13.110   1.005   4.220
  Start of MODEL   12
 8536    H    LYS  36           H        LYS  36  -9.419  -1.045   0.716
  Start of MODEL   12
 8537    HA   LYS  36           HA       LYS  36  -6.920  -0.564   2.099
  Start of MODEL   12
 8538    HB2  LYS  36           HB2      LYS  36  -7.840  -2.808   2.051
  Start of MODEL   12
 8539    HB3  LYS  36           HB3      LYS  36  -7.924  -2.781   0.302
  Start of MODEL   12
 8540    HG2  LYS  36           HG2      LYS  36  -5.471  -2.711   0.215
  Start of MODEL   12
 8541    HG3  LYS  36           HG3      LYS  36  -5.432  -2.816   1.980
  Start of MODEL   12
 8542    HD2  LYS  36           HD2      LYS  36  -6.575  -4.959   1.904
  Start of MODEL   12
 8543    HD3  LYS  36           HD3      LYS  36  -6.719  -4.846   0.149
  Start of MODEL   12
 8544    HE2  LYS  36           HE2      LYS  36  -4.278  -4.896  -0.041
  Start of MODEL   12
 8545    HE3  LYS  36           HE3      LYS  36  -4.148  -5.019   1.713
  Start of MODEL   12
 8546    HZ2  LYS  36           HZ1      LYS  36  -3.933  -7.177   0.608
  Start of MODEL   12
 8547    HZ1  LYS  36           HZ2      LYS  36  -5.490  -7.007  -0.033
  Start of MODEL   12
 8548    HZ3  LYS  36           HZ3      LYS  36  -5.288  -7.137   1.638
  Start of MODEL   12
 8549    H    ILE  37           H        ILE  37  -5.544   0.775   1.217
  Start of MODEL   12
 8550    HA   ILE  37           HA       ILE  37  -5.372   1.072  -1.695
  Start of MODEL   12
 8551    HB   ILE  37           HB       ILE  37  -4.142   2.747   0.505
  Start of MODEL   12
 8552   HD12  ILE  37          HD11      ILE  37  -6.823   5.325   0.039
  Start of MODEL   12
 8553   HD11  ILE  37          HD12      ILE  37  -5.199   5.347  -0.654
  Start of MODEL   12
 8554   HD13  ILE  37          HD13      ILE  37  -5.428   4.918   1.042
  Start of MODEL   12
 8555    H    PHE  38           H        PHE  38  -3.616   0.375  -2.795
  Start of MODEL   12
 8556    HA   PHE  38           HA       PHE  38  -1.389  -0.763  -1.259
  Start of MODEL   12
 8557    HB2  PHE  38           HB2      PHE  38  -2.282  -2.271  -2.932
  Start of MODEL   12
 8558    HB3  PHE  38           HB3      PHE  38  -2.149  -1.037  -4.180
  Start of MODEL   12
 8559    HD1  PHE  38           HD1      PHE  38  -0.357  -1.164  -5.609
  Start of MODEL   12
 8560    HD2  PHE  38           HD2      PHE  38   0.020  -2.784  -1.691
  Start of MODEL   12
 8561    HE1  PHE  38           HE1      PHE  38   1.912  -1.948  -6.152
  Start of MODEL   12
 8562    HE2  PHE  38           HE2      PHE  38   2.285  -3.567  -2.226
  Start of MODEL   12
 8563    HZ   PHE  38           HZ       PHE  38   3.237  -3.149  -4.464
  Start of MODEL   12
 8564    H    VAL  39           H        VAL  39   0.459   0.343  -1.080
  Start of MODEL   12
 8565    HA   VAL  39           HA       VAL  39   0.802   2.674  -2.838
  Start of MODEL   12
 8566    HB   VAL  39           HB       VAL  39   2.316   2.230  -0.275
  Start of MODEL   12
 8567    H    GLY  40           H        GLY  40   2.426   2.720  -4.203
  Start of MODEL   12
 8568    HA2  GLY  40           HA2      GLY  40   4.448   0.573  -4.032
  Start of MODEL   12
 8569    HA3  GLY  40           HA3      GLY  40   3.603   0.912  -5.536
  Start of MODEL   12
 8570    H    GLY  41           H        GLY  41   6.480   1.033  -4.903
  Start of MODEL   12
 8571    HA2  GLY  41           HA2      GLY  41   8.090   2.356  -5.979
  Start of MODEL   12
 8572    HA3  GLY  41           HA3      GLY  41   6.904   3.643  -6.116
  Start of MODEL   12
 8573    H    LEU  42           H        LEU  42   7.070   2.283  -3.030
  Start of MODEL   12
 8574    HA   LEU  42           HA       LEU  42   7.882   4.769  -1.900
  Start of MODEL   12
 8575    HB2  LEU  42           HB2      LEU  42   7.284   2.070  -0.702
  Start of MODEL   12
 8576    HB3  LEU  42           HB3      LEU  42   7.734   3.459   0.265
  Start of MODEL   12
 8577    HG   LEU  42           HG       LEU  42   5.313   3.304  -1.523
  Start of MODEL   12
 8578   HD11  LEU  42          HD11      LEU  42   5.595   3.096   1.472
  Start of MODEL   12
 8579   HD13  LEU  42          HD12      LEU  42   5.099   1.811   0.371
  Start of MODEL   12
 8580   HD12  LEU  42          HD13      LEU  42   4.069   3.224   0.600
  Start of MODEL   12
 8581   HD23  LEU  42          HD21      LEU  42   6.186   5.393   0.472
  Start of MODEL   12
 8582   HD22  LEU  42          HD22      LEU  42   4.664   5.384  -0.413
  Start of MODEL   12
 8583   HD21  LEU  42          HD23      LEU  42   6.185   5.574  -1.281
  Start of MODEL   12
 8584    HA   PRO  43           HA       PRO  43  12.242   3.901  -1.453
  Start of MODEL   12
 8585    HB2  PRO  43           HB2      PRO  43  12.755   5.830   0.408
  Start of MODEL   12
 8586    HB3  PRO  43           HB3      PRO  43  12.622   6.165  -1.320
  Start of MODEL   12
 8587    HG2  PRO  43           HG2      PRO  43  10.630   6.585   0.856
  Start of MODEL   12
 8588    HG3  PRO  43           HG3      PRO  43  10.972   7.586  -0.564
  Start of MODEL   12
 8589    HD2  PRO  43           HD2      PRO  43   8.840   5.893  -0.379
  Start of MODEL   12
 8590    HD3  PRO  43           HD3      PRO  43   9.599   6.351  -1.915
  Start of MODEL   12
 8591    H    TYR  44           H        TYR  44  13.516   2.831   0.103
  Start of MODEL   12
 8592    HA   TYR  44           HA       TYR  44  12.029   1.243   1.892
  Start of MODEL   12
 8593    HB2  TYR  44           HB2      TYR  44  15.027   1.613   1.721
  Start of MODEL   12
 8594    HB3  TYR  44           HB3      TYR  44  14.207   0.315   2.585
  Start of MODEL   12
 8595    HD1  TYR  44           HD1      TYR  44  12.288  -0.811   0.922
  Start of MODEL   12
 8596    HD2  TYR  44           HD2      TYR  44  15.990   0.916  -0.256
  Start of MODEL   12
 8597    HE1  TYR  44           HE1      TYR  44  12.272  -2.180  -1.123
  Start of MODEL   12
 8598    HE2  TYR  44           HE2      TYR  44  15.984  -0.443  -2.310
  Start of MODEL   12
 8599    HH   TYR  44           HH       TYR  44  14.997  -2.534  -3.124
  Start of MODEL   12
 8600    H    HIS  45           H        HIS  45  13.441   4.319   2.299
  Start of MODEL   12
 8601    HA   HIS  45           HA       HIS  45  13.801   4.194   5.135
  Start of MODEL   12
 8602    HB2  HIS  45           HB2      HIS  45  13.353   6.793   3.717
  Start of MODEL   12
 8603    HB3  HIS  45           HB3      HIS  45  14.394   6.447   5.088
  Start of MODEL   12
 8604    HD1  HIS  45           HD1      HIS  45  16.661   5.140   4.516
  Start of MODEL   12
 8605    HD2  HIS  45           HD2      HIS  45  14.538   6.730   1.309
  Start of MODEL   12
 8606    HE1  HIS  45           HE1      HIS  45  18.275   5.173   2.584
  Start of MODEL   12
 8607    HE2  HIS  45           HE2      HIS  45  17.031   6.324   0.714
  Start of MODEL   12
 8608    H    THR  46           H        THR  46  11.057   4.860   3.080
  Start of MODEL   12
 8609    HA   THR  46           HA       THR  46   9.477   6.366   4.726
  Start of MODEL   12
 8610    HB   THR  46           HB       THR  46   8.541   4.086   2.970
  Start of MODEL   12
 8611    HG1  THR  46           HG1      THR  46   9.266   6.778   2.456
  Start of MODEL   12
 8612   HG22  THR  46          HG21      THR  46   6.463   5.377   2.794
  Start of MODEL   12
 8613   HG21  THR  46          HG22      THR  46   7.113   6.576   3.914
  Start of MODEL   12
 8614   HG23  THR  46          HG23      THR  46   6.794   4.932   4.470
  Start of MODEL   12
 8615    H    SER  47           H        SER  47   8.296   6.039   6.540
  Start of MODEL   12
 8616    HA   SER  47           HA       SER  47   8.365   3.334   7.684
  Start of MODEL   12
 8617    HB2  SER  47           HB2      SER  47   8.237   4.393   9.888
  Start of MODEL   12
 8618    HB3  SER  47           HB3      SER  47   9.609   5.036   8.987
  Start of MODEL   12
 8619    HG   SER  47           HG       SER  47   8.167   6.805   8.384
  Start of MODEL   12
 8620    H    ASP  48           H        ASP  48   6.515   2.746   9.025
  Start of MODEL   12
 8621    HA   ASP  48           HA       ASP  48   4.061   2.919   7.807
  Start of MODEL   12
 8622    HB2  ASP  48           HB2      ASP  48   4.345   2.668  10.807
  Start of MODEL   12
 8623    HB3  ASP  48           HB3      ASP  48   3.117   1.951   9.771
  Start of MODEL   12
 8624    H    LYS  49           H        LYS  49   5.452   5.054  10.209
  Start of MODEL   12
 8625    HA   LYS  49           HA       LYS  49   3.112   6.552  10.753
  Start of MODEL   12
 8626    HB2  LYS  49           HB2      LYS  49   5.007   6.574  12.284
  Start of MODEL   12
 8627    HB3  LYS  49           HB3      LYS  49   6.032   7.292  11.051
  Start of MODEL   12
 8628    HG2  LYS  49           HG2      LYS  49   4.711   9.318  11.090
  Start of MODEL   12
 8629    HG3  LYS  49           HG3      LYS  49   3.601   8.597  12.255
  Start of MODEL   12
 8630    HD2  LYS  49           HD2      LYS  49   5.187  10.091  13.362
  Start of MODEL   12
 8631    HD3  LYS  49           HD3      LYS  49   5.421   8.417  13.879
  Start of MODEL   12
 8632    HE2  LYS  49           HE2      LYS  49   7.265   8.232  12.218
  Start of MODEL   12
 8633    HE3  LYS  49           HE3      LYS  49   7.074   9.955  11.885
  Start of MODEL   12
 8634    HZ3  LYS  49           HZ1      LYS  49   7.629  10.448  14.163
  Start of MODEL   12
 8635    HZ2  LYS  49           HZ2      LYS  49   8.853   9.496  13.486
  Start of MODEL   12
 8636    HZ1  LYS  49           HZ3      LYS  49   7.724   8.801  14.542
  Start of MODEL   12
 8637    H    THR  50           H        THR  50   5.691   6.853   8.381
  Start of MODEL   12
 8638    HA   THR  50           HA       THR  50   5.064   9.436   7.444
  Start of MODEL   12
 8639    HB   THR  50           HB       THR  50   6.255   7.194   5.787
  Start of MODEL   12
 8640    HG1  THR  50           HG1      THR  50   7.446   8.877   7.765
  Start of MODEL   12
 8641   HG22  THR  50          HG21      THR  50   7.476   9.003   4.673
  Start of MODEL   12
 8642   HG21  THR  50          HG22      THR  50   6.684  10.187   5.711
  Start of MODEL   12
 8643   HG23  THR  50          HG23      THR  50   5.733   9.254   4.555
  Start of MODEL   12
 8644    H    LEU  51           H        LEU  51   3.927   6.228   6.474
  Start of MODEL   12
 8645    HA   LEU  51           HA       LEU  51   2.400   7.187   4.240
  Start of MODEL   12
 8646    HB2  LEU  51           HB2      LEU  51   2.299   4.590   5.774
  Start of MODEL   12
 8647    HB3  LEU  51           HB3      LEU  51   1.262   4.935   4.403
  Start of MODEL   12
 8648    HG   LEU  51           HG       LEU  51   4.267   4.677   4.376
  Start of MODEL   12
 8649   HD13  LEU  51          HD11      LEU  51   3.044   2.570   4.463
  Start of MODEL   12
 8650   HD12  LEU  51          HD12      LEU  51   3.807   2.794   2.889
  Start of MODEL   12
 8651   HD11  LEU  51          HD13      LEU  51   2.074   3.065   3.077
  Start of MODEL   12
 8652   HD21  LEU  51          HD21      LEU  51   3.578   6.483   2.883
  Start of MODEL   12
 8653   HD23  LEU  51          HD22      LEU  51   2.389   5.416   2.129
  Start of MODEL   12
 8654   HD22  LEU  51          HD23      LEU  51   4.113   5.072   1.966
  Start of MODEL   12
 8655    H    HIS  52           H        HIS  52   1.692   6.242   7.547
  Start of MODEL   12
 8656    HA   HIS  52           HA       HIS  52  -1.032   6.735   7.616
  Start of MODEL   12
 8657    HB2  HIS  52           HB2      HIS  52   0.312   5.764   9.498
  Start of MODEL   12
 8658    HB3  HIS  52           HB3      HIS  52   0.908   7.382   9.852
  Start of MODEL   12
 8659    HD1  HIS  52           HD1      HIS  52  -1.089   9.176  10.512
  Start of MODEL   12
 8660    HD2  HIS  52           HD2      HIS  52  -1.992   5.112  10.772
  Start of MODEL   12
 8661    HE1  HIS  52           HE1      HIS  52  -3.099   9.014  12.005
  Start of MODEL   12
 8662    HE2  HIS  52           HE2      HIS  52  -3.608   6.560  12.186
  Start of MODEL   12
 8663    H    GLU  53           H        GLU  53   1.558   9.053   8.488
  Start of MODEL   12
 8664    HA   GLU  53           HA       GLU  53  -0.139  11.193   8.912
  Start of MODEL   12
 8665    HB2  GLU  53           HB2      GLU  53   1.717  12.388   9.353
  Start of MODEL   12
 8666    HB3  GLU  53           HB3      GLU  53   2.452  10.792   9.347
  Start of MODEL   12
 8667    HG2  GLU  53           HG2      GLU  53   3.155  11.113   7.060
  Start of MODEL   12
 8668    HG3  GLU  53           HG3      GLU  53   2.418  12.711   7.038
  Start of MODEL   12
 8669    H    TYR  54           H        TYR  54   1.369  10.142   5.916
  Start of MODEL   12
 8670    HA   TYR  54           HA       TYR  54   0.774  12.520   4.483
  Start of MODEL   12
 8671    HB2  TYR  54           HB2      TYR  54   2.493  10.665   3.941
  Start of MODEL   12
 8672    HB3  TYR  54           HB3      TYR  54   1.135   9.816   3.210
  Start of MODEL   12
 8673    HD1  TYR  54           HD1      TYR  54   0.223  10.521   1.108
  Start of MODEL   12
 8674    HD2  TYR  54           HD2      TYR  54   3.288  12.789   2.995
  Start of MODEL   12
 8675    HE1  TYR  54           HE1      TYR  54   0.571  11.780  -0.977
  Start of MODEL   12
 8676    HE2  TYR  54           HE2      TYR  54   3.642  14.053   0.921
  Start of MODEL   12
 8677    HH   TYR  54           HH       TYR  54   3.289  13.774  -1.475
  Start of MODEL   12
 8678    H    PHE  55           H        PHE  55  -0.688   9.277   4.405
  Start of MODEL   12
 8679    HA   PHE  55           HA       PHE  55  -2.820  10.070   2.718
  Start of MODEL   12
 8680    HB2  PHE  55           HB2      PHE  55  -2.291   7.591   4.335
  Start of MODEL   12
 8681    HB3  PHE  55           HB3      PHE  55  -3.764   7.791   3.396
  Start of MODEL   12
 8682    HD1  PHE  55           HD1      PHE  55  -0.086   7.559   3.173
  Start of MODEL   12
 8683    HD2  PHE  55           HD2      PHE  55  -3.780   7.500   1.066
  Start of MODEL   12
 8684    HE1  PHE  55           HE1      PHE  55   1.078   6.739   1.171
  Start of MODEL   12
 8685    HE2  PHE  55           HE2      PHE  55  -2.624   6.681  -0.943
  Start of MODEL   12
 8686    HZ   PHE  55           HZ       PHE  55  -0.194   6.298  -0.895
  Start of MODEL   12
 8687    H    GLU  56           H        GLU  56  -2.481  10.079   6.209
  Start of MODEL   12
 8688    HA   GLU  56           HA       GLU  56  -5.222   9.827   6.830
  Start of MODEL   12
 8689    HB2  GLU  56           HB2      GLU  56  -4.685  10.552   9.049
  Start of MODEL   12
 8690    HB3  GLU  56           HB3      GLU  56  -3.348   9.566   8.474
  Start of MODEL   12
 8691    HG2  GLU  56           HG2      GLU  56  -2.058  11.568   7.996
  Start of MODEL   12
 8692    HG3  GLU  56           HG3      GLU  56  -3.403  12.572   8.532
  Start of MODEL   12
 8693    H    GLN  57           H        GLN  57  -3.421  12.445   5.550
  Start of MODEL   12
 8694    HA   GLN  57           HA       GLN  57  -5.009  14.602   6.422
  Start of MODEL   12
 8695    HB2  GLN  57           HB2      GLN  57  -3.313  14.280   3.947
  Start of MODEL   12
 8696    HB3  GLN  57           HB3      GLN  57  -4.076  15.792   4.418
  Start of MODEL   12
 8697    HG2  GLN  57           HG2      GLN  57  -2.813  15.695   6.553
  Start of MODEL   12
 8698    HG3  GLN  57           HG3      GLN  57  -1.973  14.272   5.935
  Start of MODEL   12
 8699   HE21  GLN  57          HE21      GLN  57  -0.969  16.914   6.698
  Start of MODEL   12
 8700   HE22  GLN  57          HE22      GLN  57  -0.134  17.534   5.308
  Start of MODEL   12
 8701    H    PHE  58           H        PHE  58  -5.849  12.064   4.393
  Start of MODEL   12
 8702    HA   PHE  58           HA       PHE  58  -7.775  13.635   2.857
  Start of MODEL   12
 8703    HB2  PHE  58           HB2      PHE  58  -7.162  10.671   2.797
  Start of MODEL   12
 8704    HB3  PHE  58           HB3      PHE  58  -8.354  11.468   1.784
  Start of MODEL   12
 8705    HD1  PHE  58           HD1      PHE  58  -4.749  11.612   2.658
  Start of MODEL   12
 8706    HD2  PHE  58           HD2      PHE  58  -7.735  12.271  -0.297
  Start of MODEL   12
 8707    HE1  PHE  58           HE1      PHE  58  -2.999  12.088   0.995
  Start of MODEL   12
 8708    HE2  PHE  58           HE2      PHE  58  -5.992  12.763  -1.960
  Start of MODEL   12
 8709    HZ   PHE  58           HZ       PHE  58  -3.644  12.728  -1.323
  Start of MODEL   12
 8710    H    GLY  59           H        GLY  59  -7.646  12.121   5.839
  Start of MODEL   12
 8711    HA2  GLY  59           HA2      GLY  59 -10.068  12.774   6.794
  Start of MODEL   12
 8712    HA3  GLY  59           HA3      GLY  59 -10.439  11.307   5.906
  Start of MODEL   12
 8713    H    ASP  60           H        ASP  60 -10.087   9.409   6.837
  Start of MODEL   12
 8714    HA   ASP  60           HA       ASP  60  -8.512   9.328   9.321
  Start of MODEL   12
 8715    HB2  ASP  60           HB2      ASP  60 -11.277   8.254   8.835
  Start of MODEL   12
 8716    HB3  ASP  60           HB3      ASP  60 -10.240   7.557  10.071
  Start of MODEL   12
 8717    H    ILE  61           H        ILE  61  -7.197   7.600   9.571
  Start of MODEL   12
 8718    HA   ILE  61           HA       ILE  61  -7.362   5.447   7.580
  Start of MODEL   12
 8719    HB   ILE  61           HB       ILE  61  -5.045   6.634   9.086
  Start of MODEL   12
 8720   HD12  ILE  61          HD11      ILE  61  -3.532   7.454   5.800
  Start of MODEL   12
 8721   HD11  ILE  61          HD12      ILE  61  -3.057   6.103   6.833
  Start of MODEL   12
 8722   HD13  ILE  61          HD13      ILE  61  -3.372   7.689   7.541
  Start of MODEL   12
 8723    H    GLU  62           H        GLU  62  -7.619   3.394   8.235
  Start of MODEL   12
 8724    HA   GLU  62           HA       GLU  62  -8.269   2.866  10.997
  Start of MODEL   12
 8725    HB2  GLU  62           HB2      GLU  62  -9.299   1.855   8.809
  Start of MODEL   12
 8726    HB3  GLU  62           HB3      GLU  62  -7.928   0.757   8.887
  Start of MODEL   12
 8727    HG2  GLU  62           HG2      GLU  62  -8.653   0.243  11.251
  Start of MODEL   12
 8728    HG3  GLU  62           HG3      GLU  62 -10.150   1.098  10.859
  Start of MODEL   12
 8729    H    GLU  63           H        GLU  63  -5.797   1.954   8.673
  Start of MODEL   12
 8730    HA   GLU  63           HA       GLU  63  -3.774   1.698  10.683
  Start of MODEL   12
 8731    HB2  GLU  63           HB2      GLU  63  -4.761  -0.518  10.915
  Start of MODEL   12
 8732    HB3  GLU  63           HB3      GLU  63  -4.638  -0.785   9.182
  Start of MODEL   12
 8733    HG2  GLU  63           HG2      GLU  63  -2.896  -1.977  10.370
  Start of MODEL   12
 8734    HG3  GLU  63           HG3      GLU  63  -2.202  -0.726   9.341
  Start of MODEL   12
 8735    H    ALA  64           H        ALA  64  -1.730   1.934   9.819
  Start of MODEL   12
 8736    HA   ALA  64           HA       ALA  64  -1.474   1.940   6.894
  Start of MODEL   12
 8737    HB1  ALA  64           HB1      ALA  64  -0.624   4.236   8.655
  Start of MODEL   12
 8738    HB3  ALA  64           HB2      ALA  64  -1.971   4.250   7.516
  Start of MODEL   12
 8739    HB2  ALA  64           HB3      ALA  64  -0.317   4.090   6.922
  Start of MODEL   12
 8740    H    VAL  65           H        VAL  65   0.215   0.726   6.361
  Start of MODEL   12
 8741    HA   VAL  65           HA       VAL  65   2.520   0.626   8.182
  Start of MODEL   12
 8742    HB   VAL  65           HB       VAL  65   2.666  -1.816   7.969
  Start of MODEL   12
 8743    H    VAL  66           H        VAL  66   4.475   0.300   7.232
  Start of MODEL   12
 8744    HA   VAL  66           HA       VAL  66   4.580   0.090   4.302
  Start of MODEL   12
 8745    HB   VAL  66           HB       VAL  66   6.809   0.558   6.311
  Start of MODEL   12
 8746    H    ILE  67           H        ILE  67   5.425  -1.784   3.305
  Start of MODEL   12
 8747    HA   ILE  67           HA       ILE  67   5.008  -4.059   5.052
  Start of MODEL   12
 8748    HB   ILE  67           HB       ILE  67   5.230  -3.919   2.049
  Start of MODEL   12
 8749   HD11  ILE  67          HD11      ILE  67   3.213  -3.769   5.107
  Start of MODEL   12
 8750   HD13  ILE  67          HD12      ILE  67   2.666  -5.336   4.508
  Start of MODEL   12
 8751   HD12  ILE  67          HD13      ILE  67   1.642  -3.913   4.318
  Start of MODEL   12
 8752    H    THR  68           H        THR  68   6.500  -5.302   5.774
  Start of MODEL   12
 8753    HA   THR  68           HA       THR  68   9.193  -5.158   4.616
  Start of MODEL   12
 8754    HB   THR  68           HB       THR  68  10.039  -5.639   6.923
  Start of MODEL   12
 8755    HG1  THR  68           HG1      THR  68   7.936  -4.714   8.303
  Start of MODEL   12
 8756   HG21  THR  68          HG21      THR  68   8.425  -3.095   6.638
  Start of MODEL   12
 8757   HG23  THR  68          HG22      THR  68  10.086  -3.343   6.093
  Start of MODEL   12
 8758   HG22  THR  68          HG23      THR  68   9.708  -3.363   7.815
  Start of MODEL   12
 8759    H    ASP  69           H        ASP  69  10.305  -7.188   4.502
  Start of MODEL   12
 8760    HA   ASP  69           HA       ASP  69   8.813  -9.442   4.062
  Start of MODEL   12
 8761    HB2  ASP  69           HB2      ASP  69  11.066  -9.235   3.256
  Start of MODEL   12
 8762    HB3  ASP  69           HB3      ASP  69  11.698  -9.168   4.898
  Start of MODEL   12
 8763    H    ARG  70           H        ARG  70   7.894 -10.945   5.265
  Start of MODEL   12
 8764    HA   ARG  70           HA       ARG  70   7.421 -10.575   7.965
  Start of MODEL   12
 8765    HB2  ARG  70           HB2      ARG  70   6.018 -11.847   6.350
  Start of MODEL   12
 8766    HB3  ARG  70           HB3      ARG  70   7.169 -13.169   6.444
  Start of MODEL   12
 8767    HG2  ARG  70           HG2      ARG  70   5.259 -13.634   7.838
  Start of MODEL   12
 8768    HG3  ARG  70           HG3      ARG  70   6.688 -13.395   8.841
  Start of MODEL   12
 8769    HD2  ARG  70           HD2      ARG  70   4.829 -11.112   8.281
  Start of MODEL   12
 8770    HD3  ARG  70           HD3      ARG  70   4.439 -12.292   9.532
  Start of MODEL   12
 8771    HE   ARG  70           HE       ARG  70   7.053 -11.438   9.982
  Start of MODEL   12
 8772   HH11  ARG  70          HH11      ARG  70   3.828 -10.064   9.987
  Start of MODEL   12
 8773   HH12  ARG  70          HH12      ARG  70   4.184  -8.898  11.222
  Start of MODEL   12
 8774   HH21  ARG  70          HH21      ARG  70   7.532  -9.873  11.596
  Start of MODEL   12
 8775   HH22  ARG  70          HH22      ARG  70   6.296  -8.756  12.100
  Start of MODEL   12
 8776    H    ASN  71           H        ASN  71  10.135 -12.172   6.511
  Start of MODEL   12
 8777    HA   ASN  71           HA       ASN  71  10.762 -13.590   8.994
  Start of MODEL   12
 8778    HB2  ASN  71           HB2      ASN  71  11.927 -13.706   6.223
  Start of MODEL   12
 8779    HB3  ASN  71           HB3      ASN  71  12.764 -14.419   7.595
  Start of MODEL   12
 8780   HD21  ASN  71          HD21      ASN  71  12.595 -16.464   6.690
  Start of MODEL   12
 8781   HD22  ASN  71          HD22      ASN  71  11.104 -17.338   6.663
  Start of MODEL   12
 8782    H    THR  72           H        THR  72  12.370 -11.321   6.766
  Start of MODEL   12
 8783    HA   THR  72           HA       THR  72  14.459 -10.876   8.755
  Start of MODEL   12
 8784    HB   THR  72           HB       THR  72  15.494  -9.511   6.910
  Start of MODEL   12
 8785    HG1  THR  72           HG1      THR  72  13.430 -10.691   5.311
  Start of MODEL   12
 8786   HG21  THR  72          HG21      THR  72  14.799 -12.380   6.270
  Start of MODEL   12
 8787   HG23  THR  72          HG22      THR  72  16.137 -11.838   7.283
  Start of MODEL   12
 8788   HG22  THR  72          HG23      THR  72  16.127 -11.464   5.559
  Start of MODEL   12
 8789    H    GLN  73           H        GLN  73  11.656  -9.387   7.578
  Start of MODEL   12
 8790    HA   GLN  73           HA       GLN  73  10.497  -7.523   8.187
  Start of MODEL   12
 8791    HB2  GLN  73           HB2      GLN  73  12.653  -7.196  10.278
  Start of MODEL   12
 8792    HB3  GLN  73           HB3      GLN  73  11.139  -6.301  10.229
  Start of MODEL   12
 8793    HG2  GLN  73           HG2      GLN  73   9.899  -8.399  10.489
  Start of MODEL   12
 8794    HG3  GLN  73           HG3      GLN  73  11.423  -9.284  10.554
  Start of MODEL   12
 8795   HE21  GLN  73          HE21      GLN  73  10.926  -6.152  12.038
  Start of MODEL   12
 8796   HE22  GLN  73          HE22      GLN  73  11.009  -6.708  13.673
  Start of MODEL   12
 8797    H    LYS  74           H        LYS  74  12.696  -7.536   6.259
  Start of MODEL   12
 8798    HA   LYS  74           HA       LYS  74  13.743  -4.824   6.294
  Start of MODEL   12
 8799    HB2  LYS  74           HB2      LYS  74  13.931  -6.954   4.148
  Start of MODEL   12
 8800    HB3  LYS  74           HB3      LYS  74  14.838  -5.449   4.183
  Start of MODEL   12
 8801    HG2  LYS  74           HG2      LYS  74  15.055  -7.635   6.242
  Start of MODEL   12
 8802    HG3  LYS  74           HG3      LYS  74  16.150  -7.415   4.878
  Start of MODEL   12
 8803    HD2  LYS  74           HD2      LYS  74  15.654  -5.371   7.039
  Start of MODEL   12
 8804    HD3  LYS  74           HD3      LYS  74  17.027  -6.480   6.994
  Start of MODEL   12
 8805    HE2  LYS  74           HE2      LYS  74  17.744  -5.511   4.876
  Start of MODEL   12
 8806    HE3  LYS  74           HE3      LYS  74  16.355  -4.425   4.893
  Start of MODEL   12
 8807    HZ3  LYS  74           HZ1      LYS  74  17.204  -3.437   6.933
  Start of MODEL   12
 8808    HZ2  LYS  74           HZ2      LYS  74  18.340  -3.309   5.676
  Start of MODEL   12
 8809    HZ1  LYS  74           HZ3      LYS  74  18.553  -4.466   6.896
  Start of MODEL   12
 8810    H    SER  75           H        SER  75  12.881  -3.122   5.190
  Start of MODEL   12
 8811    HA   SER  75           HA       SER  75  10.254  -3.146   4.290
  Start of MODEL   12
 8812    HB2  SER  75           HB2      SER  75  12.380  -1.194   3.388
  Start of MODEL   12
 8813    HB3  SER  75           HB3      SER  75  10.650  -0.896   3.576
  Start of MODEL   12
 8814    HG   SER  75           HG       SER  75  11.658  -0.081   5.376
  Start of MODEL   12
 8815    H    ARG  76           H        ARG  76   9.298  -3.682   2.431
  Start of MODEL   12
 8816    HA   ARG  76           HA       ARG  76  10.994  -4.751   0.308
  Start of MODEL   12
 8817    HB2  ARG  76           HB2      ARG  76   8.026  -4.963   0.821
  Start of MODEL   12
 8818    HB3  ARG  76           HB3      ARG  76   8.836  -5.674  -0.567
  Start of MODEL   12
 8819    HG2  ARG  76           HG2      ARG  76  10.245  -6.986   1.027
  Start of MODEL   12
 8820    HG3  ARG  76           HG3      ARG  76   9.229  -6.373   2.332
  Start of MODEL   12
 8821    HD2  ARG  76           HD2      ARG  76   7.315  -7.455   1.493
  Start of MODEL   12
 8822    HD3  ARG  76           HD3      ARG  76   8.075  -7.765  -0.065
  Start of MODEL   12
 8823    HE   ARG  76           HE       ARG  76   9.385  -9.053   2.153
  Start of MODEL   12
 8824   HH11  ARG  76          HH11      ARG  76   6.859  -9.285  -0.247
  Start of MODEL   12
 8825   HH12  ARG  76          HH12      ARG  76   6.840 -11.024  -0.247
  Start of MODEL   12
 8826   HH21  ARG  76          HH21      ARG  76   9.367 -11.352   2.175
  Start of MODEL   12
 8827   HH22  ARG  76          HH22      ARG  76   8.265 -12.192   1.116
  Start of MODEL   12
 8828    H    GLY  77           H        GLY  77  10.278  -1.832   0.860
  Start of MODEL   12
 8829    HA2  GLY  77           HA2      GLY  77  10.116   0.056  -0.453
  Start of MODEL   12
 8830    HA3  GLY  77           HA3      GLY  77  10.241  -1.009  -1.838
  Start of MODEL   12
 8831    H    TYR  78           H        TYR  78   7.594  -1.808   0.112
  Start of MODEL   12
 8832    HA   TYR  78           HA       TYR  78   5.827   0.149  -1.082
  Start of MODEL   12
 8833    HB2  TYR  78           HB2      TYR  78   4.248  -1.541  -1.941
  Start of MODEL   12
 8834    HB3  TYR  78           HB3      TYR  78   5.795  -1.600  -2.774
  Start of MODEL   12
 8835    HD1  TYR  78           HD1      TYR  78   3.560  -3.359  -0.451
  Start of MODEL   12
 8836    HD2  TYR  78           HD2      TYR  78   7.229  -3.520  -2.589
  Start of MODEL   12
 8837    HE1  TYR  78           HE1      TYR  78   3.692  -5.771  -0.017
  Start of MODEL   12
 8838    HE2  TYR  78           HE2      TYR  78   7.385  -5.936  -2.159
  Start of MODEL   12
 8839    HH   TYR  78           HH       TYR  78   4.746  -7.763  -0.989
  Start of MODEL   12
 8840    H    GLY  79           H        GLY  79   3.513  -0.222  -0.210
  Start of MODEL   12
 8841    HA2  GLY  79           HA2      GLY  79   3.463  -1.491   2.395
  Start of MODEL   12
 8842    HA3  GLY  79           HA3      GLY  79   3.465   0.264   2.432
  Start of MODEL   12
 8843    H    PHE  80           H        PHE  80   1.395  -0.567   3.610
  Start of MODEL   12
 8844    HA   PHE  80           HA       PHE  80  -0.765  -0.374   1.648
  Start of MODEL   12
 8845    HB2  PHE  80           HB2      PHE  80  -0.528  -2.375   3.882
  Start of MODEL   12
 8846    HB3  PHE  80           HB3      PHE  80  -2.094  -1.906   3.230
  Start of MODEL   12
 8847    HD1  PHE  80           HD1      PHE  80   0.899  -3.841   2.721
  Start of MODEL   12
 8848    HD2  PHE  80           HD2      PHE  80  -2.627  -2.381   0.858
  Start of MODEL   12
 8849    HE1  PHE  80           HE1      PHE  80   1.180  -5.484   0.921
  Start of MODEL   12
 8850    HE2  PHE  80           HE2      PHE  80  -2.359  -4.021  -0.952
  Start of MODEL   12
 8851    HZ   PHE  80           HZ       PHE  80  -0.504  -5.588  -0.917
  Start of MODEL   12
 8852    H    VAL  81           H        VAL  81  -2.318   0.931   2.126
  Start of MODEL   12
 8853    HA   VAL  81           HA       VAL  81  -2.562   1.946   4.886
  Start of MODEL   12
 8854    HB   VAL  81           HB       VAL  81  -2.920   3.478   2.306
  Start of MODEL   12
 8855    H    THR  82           H        THR  82  -4.417   1.467   5.827
  Start of MODEL   12
 8856    HA   THR  82           HA       THR  82  -6.687   0.747   4.106
  Start of MODEL   12
 8857    HB   THR  82           HB       THR  82  -6.304   0.060   7.032
  Start of MODEL   12
 8858    HG1  THR  82           HG1      THR  82  -5.378  -1.144   4.726
  Start of MODEL   12
 8859   HG21  THR  82          HG21      THR  82  -8.263  -0.982   4.975
  Start of MODEL   12
 8860   HG23  THR  82          HG22      THR  82  -8.649   0.134   6.285
  Start of MODEL   12
 8861   HG22  THR  82          HG23      THR  82  -8.144  -1.517   6.647
  Start of MODEL   12
 8862    H    MET  83           H        MET  83  -7.949   2.458   3.869
  Start of MODEL   12
 8863    HA   MET  83           HA       MET  83  -7.909   4.598   5.806
  Start of MODEL   12
 8864    HB2  MET  83           HB2      MET  83  -9.492   4.291   3.244
  Start of MODEL   12
 8865    HB3  MET  83           HB3      MET  83  -9.391   5.759   4.209
  Start of MODEL   12
 8866    HG2  MET  83           HG2      MET  83  -7.056   4.414   2.870
  Start of MODEL   12
 8867    HG3  MET  83           HG3      MET  83  -7.950   5.778   2.205
  Start of MODEL   12
 8868    HE2  MET  83           HE1      MET  83  -7.059   8.662   4.674
  Start of MODEL   12
 8869    HE1  MET  83           HE2      MET  83  -8.483   7.626   4.752
  Start of MODEL   12
 8870    HE3  MET  83           HE3      MET  83  -7.906   8.211   3.193
  Start of MODEL   12
 8871    H    LYS  84           H        LYS  84  -9.646   5.324   6.957
  Start of MODEL   12
 8872    HA   LYS  84           HA       LYS  84 -11.329   3.271   7.987
  Start of MODEL   12
 8873    HB2  LYS  84           HB2      LYS  84 -10.337   5.294   9.204
  Start of MODEL   12
 8874    HB3  LYS  84           HB3      LYS  84 -11.632   6.233   8.478
  Start of MODEL   12
 8875    HG2  LYS  84           HG2      LYS  84 -13.278   4.789   9.577
  Start of MODEL   12
 8876    HG3  LYS  84           HG3      LYS  84 -11.965   3.877  10.325
  Start of MODEL   12
 8877    HD2  LYS  84           HD2      LYS  84 -12.429   6.833  10.688
  Start of MODEL   12
 8878    HD3  LYS  84           HD3      LYS  84 -12.962   5.592  11.821
  Start of MODEL   12
 8879    HE2  LYS  84           HE2      LYS  84 -10.644   4.934  12.211
  Start of MODEL   12
 8880    HE3  LYS  84           HE3      LYS  84 -10.098   6.116  11.021
  Start of MODEL   12
 8881    HZ3  LYS  84           HZ1      LYS  84 -10.629   7.885  12.397
  Start of MODEL   12
 8882    HZ2  LYS  84           HZ2      LYS  84 -10.046   6.743  13.510
  Start of MODEL   12
 8883    HZ1  LYS  84           HZ3      LYS  84 -11.712   6.979  13.337
  Start of MODEL   12
 8884    H    ASP  85           H        ASP  85 -11.578   5.468   5.382
  Start of MODEL   12
 8885    HA   ASP  85           HA       ASP  85 -14.349   4.675   4.937
  Start of MODEL   12
 8886    HB2  ASP  85           HB2      ASP  85 -14.905   6.737   5.783
  Start of MODEL   12
 8887    HB3  ASP  85           HB3      ASP  85 -13.371   7.465   5.326
  Start of MODEL   12
 8888    H    ARG  86           H        ARG  86 -14.951   4.534   2.817
  Start of MODEL   12
 8889    HA   ARG  86           HA       ARG  86 -13.017   3.935   0.910
  Start of MODEL   12
 8890    HB2  ARG  86           HB2      ARG  86 -15.070   2.856   0.753
  Start of MODEL   12
 8891    HB3  ARG  86           HB3      ARG  86 -15.982   4.346   0.904
  Start of MODEL   12
 8892    HG2  ARG  86           HG2      ARG  86 -15.244   4.970  -1.379
  Start of MODEL   12
 8893    HG3  ARG  86           HG3      ARG  86 -14.468   3.384  -1.516
  Start of MODEL   12
 8894    HD2  ARG  86           HD2      ARG  86 -16.553   2.258  -1.261
  Start of MODEL   12
 8895    HD3  ARG  86           HD3      ARG  86 -17.372   3.750  -0.817
  Start of MODEL   12
 8896    HE   ARG  86           HE       ARG  86 -16.246   3.894  -3.434
  Start of MODEL   12
 8897   HH11  ARG  86          HH11      ARG  86 -18.990   2.763  -1.571
  Start of MODEL   12
 8898   HH12  ARG  86          HH12      ARG  86 -20.070   2.736  -2.931
  Start of MODEL   12
 8899   HH21  ARG  86          HH21      ARG  86 -17.672   3.842  -5.232
  Start of MODEL   12
 8900   HH22  ARG  86          HH22      ARG  86 -19.309   3.295  -5.014
  Start of MODEL   12
 8901    H    ALA  87           H        ALA  87 -15.004   6.866   1.263
  Start of MODEL   12
 8902    HA   ALA  87           HA       ALA  87 -14.309   7.996  -1.232
  Start of MODEL   12
 8903    HB1  ALA  87           HB1      ALA  87 -15.198   9.372   1.298
  Start of MODEL   12
 8904    HB3  ALA  87           HB2      ALA  87 -16.236   8.795  -0.007
  Start of MODEL   12
 8905    HB2  ALA  87           HB3      ALA  87 -15.112  10.125  -0.293
  Start of MODEL   12
 8906    H    SER  88           H        SER  88 -12.900   8.265   1.973
  Start of MODEL   12
 8907    HA   SER  88           HA       SER  88 -10.964  10.225   1.391
  Start of MODEL   12
 8908    HB2  SER  88           HB2      SER  88 -10.747   7.954   3.387
  Start of MODEL   12
 8909    HB3  SER  88           HB3      SER  88  -9.882   9.490   3.436
  Start of MODEL   12
 8910    HG   SER  88           HG       SER  88 -12.716   9.238   3.563
  Start of MODEL   12
 8911    H    ALA  89           H        ALA  89 -10.911   6.705   1.206
  Start of MODEL   12
 8912    HA   ALA  89           HA       ALA  89  -8.202   6.389   0.516
  Start of MODEL   12
 8913    HB3  ALA  89           HB1      ALA  89  -9.627   4.569   1.336
  Start of MODEL   12
 8914    HB2  ALA  89           HB2      ALA  89  -8.829   4.150  -0.182
  Start of MODEL   12
 8915    HB1  ALA  89           HB3      ALA  89 -10.534   4.606  -0.176
  Start of MODEL   12
 8916    H    GLU  90           H        GLU  90 -11.095   6.859  -1.434
  Start of MODEL   12
 8917    HA   GLU  90           HA       GLU  90  -9.877   6.347  -3.926
  Start of MODEL   12
 8918    HB2  GLU  90           HB2      GLU  90 -12.363   6.377  -3.418
  Start of MODEL   12
 8919    HB3  GLU  90           HB3      GLU  90 -12.262   8.132  -3.511
  Start of MODEL   12
 8920    HG2  GLU  90           HG2      GLU  90 -11.065   6.696  -5.766
  Start of MODEL   12
 8921    HG3  GLU  90           HG3      GLU  90 -12.810   6.503  -5.597
  Start of MODEL   12
 8922    H    ARG  91           H        ARG  91 -10.394   9.313  -2.075
  Start of MODEL   12
 8923    HA   ARG  91           HA       ARG  91  -9.519  11.131  -4.017
  Start of MODEL   12
 8924    HB2  ARG  91           HB2      ARG  91  -9.256  11.306  -1.009
  Start of MODEL   12
 8925    HB3  ARG  91           HB3      ARG  91  -9.065  12.655  -2.122
  Start of MODEL   12
 8926    HG2  ARG  91           HG2      ARG  91 -11.548  11.152  -1.391
  Start of MODEL   12
 8927    HG3  ARG  91           HG3      ARG  91 -11.226  12.883  -1.287
  Start of MODEL   12
 8928    HD2  ARG  91           HD2      ARG  91 -11.097  12.941  -3.779
  Start of MODEL   12
 8929    HD3  ARG  91           HD3      ARG  91 -11.615  11.256  -3.794
  Start of MODEL   12
 8930    HE   ARG  91           HE       ARG  91 -13.328  13.187  -2.425
  Start of MODEL   12
 8931   HH11  ARG  91          HH11      ARG  91 -12.759  11.091  -5.183
  Start of MODEL   12
 8932   HH12  ARG  91          HH12      ARG  91 -14.355  11.315  -5.824
  Start of MODEL   12
 8933   HH21  ARG  91          HH21      ARG  91 -15.450  13.419  -3.237
  Start of MODEL   12
 8934   HH22  ARG  91          HH22      ARG  91 -15.893  12.628  -4.725
  Start of MODEL   12
 8935    H    ALA  92           H        ALA  92  -7.750   9.300  -1.582
  Start of MODEL   12
 8936    HA   ALA  92           HA       ALA  92  -5.189  10.296  -2.128
  Start of MODEL   12
 8937    HB3  ALA  92           HB1      ALA  92  -5.685   8.956  -0.165
  Start of MODEL   12
 8938    HB2  ALA  92           HB2      ALA  92  -4.361   8.238  -1.084
  Start of MODEL   12
 8939    HB1  ALA  92           HB3      ALA  92  -5.981   7.544  -1.180
  Start of MODEL   12
 8940    H    CYS  93           H        CYS  93  -7.027   7.691  -3.662
  Start of MODEL   12
 8941    HA   CYS  93           HA       CYS  93  -4.778   6.819  -5.253
  Start of MODEL   12
 8942    HB2  CYS  93           HB2      CYS  93  -7.691   6.044  -5.460
  Start of MODEL   12
 8943    HB3  CYS  93           HB3      CYS  93  -6.328   5.201  -6.186
  Start of MODEL   12
 8944    HG   CYS  93           HG       CYS  93  -7.103   5.401  -2.866
  Start of MODEL   12
 8945    H    LYS  94           H        LYS  94  -7.126   9.255  -5.561
  Start of MODEL   12
 8946    HA   LYS  94           HA       LYS  94  -7.698   9.103  -8.321
  Start of MODEL   12
 8947    HB2  LYS  94           HB2      LYS  94  -8.961  10.365  -6.489
  Start of MODEL   12
 8948    HB3  LYS  94           HB3      LYS  94  -7.747  11.623  -6.662
  Start of MODEL   12
 8949    HG2  LYS  94           HG2      LYS  94  -9.164  10.691  -9.100
  Start of MODEL   12
 8950    HG3  LYS  94           HG3      LYS  94 -10.034  11.712  -7.957
  Start of MODEL   12
 8951    HD2  LYS  94           HD2      LYS  94  -8.284  13.408  -8.134
  Start of MODEL   12
 8952    HD3  LYS  94           HD3      LYS  94  -7.394  12.376  -9.257
  Start of MODEL   12
 8953    HE2  LYS  94           HE2      LYS  94  -8.720  14.178 -10.351
  Start of MODEL   12
 8954    HE3  LYS  94           HE3      LYS  94  -9.132  12.550 -10.889
  Start of MODEL   12
 8955    HZ2  LYS  94           HZ1      LYS  94 -11.063  14.035 -10.448
  Start of MODEL   12
 8956    HZ1  LYS  94           HZ2      LYS  94 -10.653  14.010  -8.800
  Start of MODEL   12
 8957    HZ3  LYS  94           HZ3      LYS  94 -11.095  12.580  -9.586
  Start of MODEL   12
 8958    H    ASP  95           H        ASP  95  -5.171  10.749  -6.493
  Start of MODEL   12
 8959    HA   ASP  95           HA       ASP  95  -3.884  11.427  -9.054
  Start of MODEL   12
 8960    HB2  ASP  95           HB2      ASP  95  -4.219  13.281  -7.339
  Start of MODEL   12
 8961    HB3  ASP  95           HB3      ASP  95  -3.059  12.428  -6.324
  Start of MODEL   12
 8962    HA   PRO  96           HA       PRO  96  -1.994   7.566  -7.786
  Start of MODEL   12
 8963    HB2  PRO  96           HB2      PRO  96  -0.895   6.945 -10.176
  Start of MODEL   12
 8964    HB3  PRO  96           HB3      PRO  96  -2.615   6.749  -9.826
  Start of MODEL   12
 8965    HG2  PRO  96           HG2      PRO  96  -1.222   8.960 -11.283
  Start of MODEL   12
 8966    HG3  PRO  96           HG3      PRO  96  -2.735   8.129 -11.693
  Start of MODEL   12
 8967    HD2  PRO  96           HD2      PRO  96  -2.681  10.555 -10.491
  Start of MODEL   12
 8968    HD3  PRO  96           HD3      PRO  96  -3.968   9.371 -10.201
  Start of MODEL   12
 8969    H    ASN  97           H        ASN  97  -0.344  10.444  -8.465
  Start of MODEL   12
 8970    HA   ASN  97           HA       ASN  97   2.231   9.070  -8.018
  Start of MODEL   12
 8971    HB2  ASN  97           HB2      ASN  97   1.747  11.415  -9.865
  Start of MODEL   12
 8972    HB3  ASN  97           HB3      ASN  97   3.333  10.788  -9.445
  Start of MODEL   12
 8973   HD21  ASN  97          HD21      ASN  97   2.337   7.988  -9.487
  Start of MODEL   12
 8974   HD22  ASN  97          HD22      ASN  97   2.186   7.594 -11.170
  Start of MODEL   12
 8975    HA   PRO  98           HA       PRO  98   1.818  12.577  -4.934
  Start of MODEL   12
 8976    HB2  PRO  98           HB2      PRO  98   1.796  11.123  -2.663
  Start of MODEL   12
 8977    HB3  PRO  98           HB3      PRO  98   0.314  11.510  -3.546
  Start of MODEL   12
 8978    HG2  PRO  98           HG2      PRO  98   1.894   8.978  -3.516
  Start of MODEL   12
 8979    HG3  PRO  98           HG3      PRO  98   0.136   9.202  -3.522
  Start of MODEL   12
 8980    HD2  PRO  98           HD2      PRO  98   1.616   8.581  -5.746
  Start of MODEL   12
 8981    HD3  PRO  98           HD3      PRO  98   0.052   9.413  -5.793
  Start of MODEL   12
 8982    H    ILE  99           H        ILE  99   3.651  13.442  -4.096
  Start of MODEL   12
 8983    HA   ILE  99           HA       ILE  99   6.099  11.906  -4.161
  Start of MODEL   12
 8984    HB   ILE  99           HB       ILE  99   5.621  14.764  -3.287
  Start of MODEL   12
 8985   HD11  ILE  99          HD11      ILE  99   6.503  12.439  -6.111
  Start of MODEL   12
 8986   HD13  ILE  99          HD12      ILE  99   7.934  13.460  -5.963
  Start of MODEL   12
 8987   HD12  ILE  99          HD13      ILE  99   6.777  13.747  -7.261
  Start of MODEL   12
 8988    H    ILE 100           H        ILE 100   6.534  10.578  -2.535
  Start of MODEL   12
 8989    HA   ILE 100           HA       ILE 100   5.979  11.458   0.227
  Start of MODEL   12
 8990    HB   ILE 100           HB       ILE 100   5.928   8.615  -0.817
  Start of MODEL   12
 8991   HD12  ILE 100          HD11      ILE 100   2.172   8.616  -0.622
  Start of MODEL   12
 8992   HD11  ILE 100          HD12      ILE 100   3.268   7.996   0.617
  Start of MODEL   12
 8993   HD13  ILE 100          HD13      ILE 100   3.553   7.619  -1.084
  Start of MODEL   12
 8994    H    ASP 101           H        ASP 101   7.796  11.791   1.324
  Start of MODEL   12
 8995    HA   ASP 101           HA       ASP 101   9.922  11.600   2.137
  Start of MODEL   12
 8996    HB2  ASP 101           HB2      ASP 101   9.143   9.188   2.459
  Start of MODEL   12
 8997    HB3  ASP 101           HB3      ASP 101   9.980   8.804   0.962
  Start of MODEL   12
 8998    H    GLY 102           H        GLY 102   9.418  12.648  -0.475
  Start of MODEL   12
 8999    HA2  GLY 102           HA2      GLY 102  10.756  13.630  -2.090
  Start of MODEL   12
 9000    HA3  GLY 102           HA3      GLY 102  12.116  12.717  -1.459
  Start of MODEL   12
 9001    H    ARG 103           H        ARG 103   9.639  10.595  -2.028
  Start of MODEL   12
 9002    HA   ARG 103           HA       ARG 103  10.727   9.912  -4.682
  Start of MODEL   12
 9003    HB2  ARG 103           HB2      ARG 103  11.349   8.304  -3.006
  Start of MODEL   12
 9004    HB3  ARG 103           HB3      ARG 103   9.697   8.198  -2.417
  Start of MODEL   12
 9005    HG2  ARG 103           HG2      ARG 103  10.163   6.238  -3.661
  Start of MODEL   12
 9006    HG3  ARG 103           HG3      ARG 103   9.057   7.218  -4.622
  Start of MODEL   12
 9007    HD2  ARG 103           HD2      ARG 103  10.832   7.939  -6.048
  Start of MODEL   12
 9008    HD3  ARG 103           HD3      ARG 103  12.045   7.188  -5.005
  Start of MODEL   12
 9009    HE   ARG 103           HE       ARG 103  10.102   5.317  -5.946
  Start of MODEL   12
 9010   HH11  ARG 103          HH11      ARG 103  13.025   7.014  -6.856
  Start of MODEL   12
 9011   HH12  ARG 103          HH12      ARG 103  13.549   5.778  -7.965
  Start of MODEL   12
 9012   HH21  ARG 103          HH21      ARG 103  10.778   3.702  -7.415
  Start of MODEL   12
 9013   HH22  ARG 103          HH22      ARG 103  12.240   3.920  -8.322
  Start of MODEL   12
 9014    H    LYS 104           H        LYS 104   9.311   9.522  -6.343
  Start of MODEL   12
 9015    HA   LYS 104           HA       LYS 104   6.536  10.198  -5.891
  Start of MODEL   12
 9016    HB2  LYS 104           HB2      LYS 104   7.557  11.094  -7.886
  Start of MODEL   12
 9017    HB3  LYS 104           HB3      LYS 104   8.033   9.487  -8.420
  Start of MODEL   12
 9018    HG2  LYS 104           HG2      LYS 104   5.819   8.882  -8.929
  Start of MODEL   12
 9019    HG3  LYS 104           HG3      LYS 104   5.153  10.250  -8.034
  Start of MODEL   12
 9020    HD2  LYS 104           HD2      LYS 104   6.913  10.597 -10.451
  Start of MODEL   12
 9021    HD3  LYS 104           HD3      LYS 104   5.159  10.441 -10.570
  Start of MODEL   12
 9022    HE2  LYS 104           HE2      LYS 104   4.905  12.390  -9.091
  Start of MODEL   12
 9023    HE3  LYS 104           HE3      LYS 104   6.658  12.551  -9.019
  Start of MODEL   12
 9024    HZ3  LYS 104           HZ1      LYS 104   6.758  13.125 -11.281
  Start of MODEL   12
 9025    HZ2  LYS 104           HZ2      LYS 104   5.466  14.027 -10.655
  Start of MODEL   12
 9026    HZ1  LYS 104           HZ3      LYS 104   5.159  12.635 -11.574
  Start of MODEL   12
 9027    H    ALA 105           H        ALA 105   5.027   8.826  -5.451
  Start of MODEL   12
 9028    HA   ALA 105           HA       ALA 105   5.600   5.957  -5.749
  Start of MODEL   12
 9029    HB1  ALA 105           HB1      ALA 105   5.318   6.797  -3.437
  Start of MODEL   12
 9030    HB3  ALA 105           HB2      ALA 105   4.135   5.567  -3.884
  Start of MODEL   12
 9031    HB2  ALA 105           HB3      ALA 105   3.666   7.269  -3.842
  Start of MODEL   12
 9032    H    ASN 106           H        ASN 106   3.745   4.557  -6.087
  Start of MODEL   12
 9033    HA   ASN 106           HA       ASN 106   1.728   5.777  -7.873
  Start of MODEL   12
 9034    HB2  ASN 106           HB2      ASN 106   2.544   2.860  -7.723
  Start of MODEL   12
 9035    HB3  ASN 106           HB3      ASN 106   1.419   3.573  -8.871
  Start of MODEL   12
 9036   HD21  ASN 106          HD21      ASN 106   3.812   2.043  -9.376
  Start of MODEL   12
 9037   HD22  ASN 106          HD22      ASN 106   4.855   3.059 -10.311
  Start of MODEL   12
 9038    H    VAL 107           H        VAL 107  -0.153   6.063  -6.796
  Start of MODEL   12
 9039    HA   VAL 107           HA       VAL 107  -0.843   4.099  -4.720
  Start of MODEL   12
 9040    HB   VAL 107           HB       VAL 107  -1.707   6.975  -5.023
  Start of MODEL   12
 9041    H    ASN 108           H        ASN 108  -2.477   2.801  -5.050
  Start of MODEL   12
 9042    HA   ASN 108           HA       ASN 108  -4.883   3.718  -6.367
  Start of MODEL   12
 9043    HB2  ASN 108           HB2      ASN 108  -4.949   1.827  -7.954
  Start of MODEL   12
 9044    HB3  ASN 108           HB3      ASN 108  -3.580   2.884  -8.274
  Start of MODEL   12
 9045   HD21  ASN 108          HD21      ASN 108  -4.585  -0.247  -7.123
  Start of MODEL   12
 9046   HD22  ASN 108          HD22      ASN 108  -3.025  -0.988  -7.181
  Start of MODEL   12
 9047    H    LEU 109           H        LEU 109  -6.716   2.370  -5.870
  Start of MODEL   12
 9048    HA   LEU 109           HA       LEU 109  -6.729   1.035  -3.448
  Start of MODEL   12
 9049    HB2  LEU 109           HB2      LEU 109  -8.507   0.624  -5.850
  Start of MODEL   12
 9050    HB3  LEU 109           HB3      LEU 109  -8.827  -0.068  -4.270
  Start of MODEL   12
 9051    HG   LEU 109           HG       LEU 109  -8.707   2.881  -4.911
  Start of MODEL   12
 9052   HD13  LEU 109          HD11      LEU 109 -10.697   1.843  -5.804
  Start of MODEL   12
 9053   HD12  LEU 109          HD12      LEU 109 -11.108   2.817  -4.393
  Start of MODEL   12
 9054   HD11  LEU 109          HD13      LEU 109 -11.015   1.061  -4.256
  Start of MODEL   12
 9055   HD22  LEU 109          HD21      LEU 109  -9.502   3.183  -2.616
  Start of MODEL   12
 9056   HD21  LEU 109          HD22      LEU 109  -7.910   2.427  -2.661
  Start of MODEL   12
 9057   HD23  LEU 109          HD23      LEU 109  -9.342   1.451  -2.336
  Start of MODEL   12
 9058    H    ALA 110           H        ALA 110  -6.253  -0.965  -2.761
  Start of MODEL   12
 9059    HA   ALA 110           HA       ALA 110  -4.243  -2.300  -4.182
  Start of MODEL   12
 9060    HB1  ALA 110           HB1      ALA 110  -4.413  -2.232  -1.732
  Start of MODEL   12
 9061    HB3  ALA 110           HB2      ALA 110  -4.206  -3.869  -2.352
  Start of MODEL   12
 9062    HB2  ALA 110           HB3      ALA 110  -5.794  -3.325  -1.813
  Start of MODEL   12
 9063    H    TYR 111           H        TYR 111  -7.686  -2.965  -3.965
  Start of MODEL   12
 9064    HA   TYR 111           HA       TYR 111  -7.468  -5.663  -4.842
  Start of MODEL   12
 9065    HB2  TYR 111           HB2      TYR 111  -9.770  -5.774  -4.697
  Start of MODEL   12
 9066    HB3  TYR 111           HB3      TYR 111  -9.419  -4.461  -3.584
  Start of MODEL   12
 9067    HD1  TYR 111           HD1      TYR 111  -9.614  -2.044  -4.545
  Start of MODEL   12
 9068    HD2  TYR 111           HD2      TYR 111 -11.311  -5.485  -6.382
  Start of MODEL   12
 9069    HE1  TYR 111           HE1      TYR 111 -11.201  -0.608  -5.763
  Start of MODEL   12
 9070    HE2  TYR 111           HE2      TYR 111 -12.891  -4.065  -7.602
  Start of MODEL   12
 9071    HH   TYR 111           HH       TYR 111 -12.567  -0.749  -7.912
  Start of MODEL   12
 9072    H    LEU 112           H        LEU 112  -7.308  -2.682  -6.457
  Start of MODEL   12
 9073    HA   LEU 112           HA       LEU 112  -8.283  -3.446  -8.996
  Start of MODEL   12
 9074    HB2  LEU 112           HB2      LEU 112  -6.296  -1.325  -8.204
  Start of MODEL   12
 9075    HB3  LEU 112           HB3      LEU 112  -6.954  -1.496  -9.819
  Start of MODEL   12
 9076    HG   LEU 112           HG       LEU 112  -8.495  -0.822  -7.316
  Start of MODEL   12
 9077   HD12  LEU 112          HD11      LEU 112  -8.901   1.312  -8.418
  Start of MODEL   12
 9078   HD11  LEU 112          HD12      LEU 112  -7.932   0.800  -9.801
  Start of MODEL   12
 9079   HD13  LEU 112          HD13      LEU 112  -7.169   1.035  -8.227
  Start of MODEL   12
 9080   HD22  LEU 112          HD21      LEU 112 -10.438  -0.650  -8.773
  Start of MODEL   12
 9081   HD21  LEU 112          HD22      LEU 112  -9.768  -2.283  -8.785
  Start of MODEL   12
 9082   HD23  LEU 112          HD23      LEU 112  -9.466  -1.196 -10.139
  Start of MODEL   12
 9083    H    GLY 113           H        GLY 113  -5.421  -4.312  -7.352
  Start of MODEL   12
 9084    HA2  GLY 113           HA2      GLY 113  -4.340  -5.443  -9.830
  Start of MODEL   12
 9085    HA3  GLY 113           HA3      GLY 113  -3.287  -4.442  -8.831
  Start of MODEL   12
 9086    H    ALA 114           H        ALA 114  -5.646  -6.223  -7.164
  Start of MODEL   12
 9087    HA   ALA 114           HA       ALA 114  -3.681  -7.584  -5.635
  Start of MODEL   12
 9088    HB3  ALA 114           HB1      ALA 114  -5.542  -8.551  -4.419
  Start of MODEL   12
 9089    HB2  ALA 114           HB2      ALA 114  -6.666  -8.031  -5.676
  Start of MODEL   12
 9090    HB1  ALA 114           HB3      ALA 114  -5.830  -6.831  -4.690
  Start of MODEL   12
 9091    H    LYS 115           H        LYS 115  -2.972  -9.623  -5.736
  Start of MODEL   12
 9092    HA   LYS 115           HA       LYS 115  -3.372 -10.995  -8.233
  Start of MODEL   12
 9093    HB2  LYS 115           HB2      LYS 115  -1.661 -11.782  -5.868
  Start of MODEL   12
 9094    HB3  LYS 115           HB3      LYS 115  -1.570 -12.453  -7.491
  Start of MODEL   12
 9095    HG2  LYS 115           HG2      LYS 115  -0.973  -9.597  -6.748
  Start of MODEL   12
 9096    HG3  LYS 115           HG3      LYS 115   0.225 -10.855  -7.050
  Start of MODEL   12
 9097    HD2  LYS 115           HD2      LYS 115  -0.642 -11.100  -9.340
  Start of MODEL   12
 9098    HD3  LYS 115           HD3      LYS 115  -1.793  -9.800  -9.028
  Start of MODEL   12
 9099    HE2  LYS 115           HE2      LYS 115   0.027  -8.241  -8.670
  Start of MODEL   12
 9100    HE3  LYS 115           HE3      LYS 115   1.208  -9.532  -8.879
  Start of MODEL   12
 9101    HZ3  LYS 115           HZ1      LYS 115   1.049  -8.292 -10.895
  Start of MODEL   12
 9102    HZ2  LYS 115           HZ2      LYS 115  -0.642  -8.453 -10.940
  Start of MODEL   12
 9103    HZ1  LYS 115           HZ3      LYS 115   0.349  -9.814 -11.164
  Start of MODEL   12
 9104    HA   PRO 116           HA       PRO 116  -6.317 -13.900  -6.457
  Start of MODEL   12
 9105    HB2  PRO 116           HB2      PRO 116  -6.831 -15.267  -8.709
  Start of MODEL   12
 9106    HB3  PRO 116           HB3      PRO 116  -7.439 -13.625  -8.467
  Start of MODEL   12
 9107    HG2  PRO 116           HG2      PRO 116  -5.084 -14.561 -10.054
  Start of MODEL   12
 9108    HG3  PRO 116           HG3      PRO 116  -6.290 -13.329 -10.466
  Start of MODEL   12
 9109    HD2  PRO 116           HD2      PRO 116  -3.786 -12.775  -9.467
  Start of MODEL   12
 9110    HD3  PRO 116           HD3      PRO 116  -5.186 -11.698  -9.301
  Start of MODEL   12
 9111    H    ARG 117           H        ARG 117  -3.261 -14.279  -6.709
  Start of MODEL   12
 9112    HA   ARG 117           HA       ARG 117  -3.228 -17.022  -5.887
  Start of MODEL   12
 9113    HB2  ARG 117           HB2      ARG 117  -3.097 -17.353  -8.315
  Start of MODEL   12
 9114    HB3  ARG 117           HB3      ARG 117  -1.744 -16.235  -8.410
  Start of MODEL   12
 9115    HG2  ARG 117           HG2      ARG 117  -0.604 -18.191  -8.419
  Start of MODEL   12
 9116    HG3  ARG 117           HG3      ARG 117  -0.687 -17.925  -6.680
  Start of MODEL   12
 9117    HD2  ARG 117           HD2      ARG 117  -2.438 -19.729  -8.340
  Start of MODEL   12
 9118    HD3  ARG 117           HD3      ARG 117  -1.239 -20.213  -7.147
  Start of MODEL   12
 9119    HE   ARG 117           HE       ARG 117  -3.798 -18.883  -6.517
  Start of MODEL   12
 9120   HH11  ARG 117          HH11      ARG 117  -1.132 -20.968  -5.617
  Start of MODEL   12
 9121   HH12  ARG 117          HH12      ARG 117  -1.921 -21.574  -4.200
  Start of MODEL   12
 9122   HH21  ARG 117          HH21      ARG 117  -4.846 -19.689  -4.662
  Start of MODEL   12
 9123   HH22  ARG 117          HH22      ARG 117  -4.033 -20.853  -3.651
  Start of MODEL   12
 9124    H    THR 118           H        THR 118  -1.928 -16.990  -4.190
  Start of MODEL   12
 9125    HA   THR 118           HA       THR 118   0.656 -15.717  -4.349
  Start of MODEL   12
 9126    HB   THR 118           HB       THR 118  -0.819 -13.885  -3.546
  Start of MODEL   12
 9127    HG1  THR 118           HG1      THR 118   1.077 -13.493  -2.665
  Start of MODEL   12
 9128   HG23  THR 118          HG21      THR 118  -2.515 -15.205  -2.389
  Start of MODEL   12
 9129   HG22  THR 118          HG22      THR 118  -1.808 -14.018  -1.296
  Start of MODEL   12
 9130   HG21  THR 118          HG23      THR 118  -1.328 -15.712  -1.188
  Start of MODEL   12
 9131    H    ASN 119           H        ASN 119   1.335 -15.931  -1.639
  Start of MODEL   12
 9132    HA   ASN 119           HA       ASN 119   1.997 -18.652  -1.473
  Start of MODEL   12
 9133    HB2  ASN 119           HB2      ASN 119   3.366 -17.017  -0.347
  Start of MODEL   12
 9134    HB3  ASN 119           HB3      ASN 119   2.014 -16.503   0.658
  Start of MODEL   12
 9135   HD21  ASN 119          HD21      ASN 119   4.405 -18.969   0.111
  Start of MODEL   12
 9136   HD22  ASN 119          HD22      ASN 119   4.191 -19.782   1.619
  Start of MODEL   12
 9137    H    VAL 120           H        VAL 120  -0.005 -16.939   0.922
  Start of MODEL   12
 9138    HA   VAL 120           HA       VAL 120  -1.823 -17.536   2.133
  Start of MODEL   12
 9139    HB   VAL 120           HB       VAL 120  -2.204 -19.714   0.065
  Start of MODEL   12
 9140    H    GLN 121           H        GLN 121  -0.451 -20.626   0.989
  Start of MODEL   12
 9141    HA   GLN 121           HA       GLN 121   0.147 -21.326   3.773
  Start of MODEL   12
 9142    HB2  GLN 121           HB2      GLN 121  -1.254 -23.080   1.744
  Start of MODEL   12
 9143    HB3  GLN 121           HB3      GLN 121  -0.503 -23.710   3.201
  Start of MODEL   12
 9144    HG2  GLN 121           HG2      GLN 121  -2.739 -21.700   3.139
  Start of MODEL   12
 9145    HG3  GLN 121           HG3      GLN 121  -2.931 -23.428   3.413
  Start of MODEL   12
 9146   HE21  GLN 121          HE21      GLN 121  -3.624 -21.210   5.144
  Start of MODEL   12
 9147   HE22  GLN 121          HE22      GLN 121  -2.760 -21.455   6.621
  Start of MODEL   12
 9148    H5'   DG   1           H5'       DG   1  21.442  -3.054  -3.187
  Start of MODEL   12
 9149    H4'   DG   1           H4'       DG   1  19.711  -4.005  -4.816
  Start of MODEL   12
 9150    H3'   DG   1           H3'       DG   1  18.906  -1.455  -5.281
  Start of MODEL   12
 9151    H2'   DG   1           H2'       DG   1  18.010  -0.926  -3.137
  Start of MODEL   12
 9152    H1'   DG   1           H1'       DG   1  16.981  -3.785  -2.840
  Start of MODEL   12
 9153    H8    DG   1           H8        DG   1  19.272  -1.268  -0.960
  Start of MODEL   12
 9154    H1    DG   1           H1        DG   1  14.630  -4.024   2.512
  Start of MODEL   12
 9155    H22   DG   1           H21       DG   1  13.807  -5.640  -0.445
  Start of MODEL   12
 9156    H21   DG   1           H22       DG   1  13.441  -5.385   1.245
  Start of MODEL   12
 9157   HO5'   DG   1           H5T       DG   1  19.760  -1.064  -3.165
  Start of MODEL   12
 9158   H5''   DG   1          5H''       DG   1  21.404  -2.456  -4.854
  Start of MODEL   12
 9159   H2''   DG   1          2H''       DG   1  16.592  -1.669  -3.866
  Start of MODEL   12
 9160    H5'   DG   2           H5'       DG   2  15.636  -3.799  -9.653
  Start of MODEL   12
 9161    H4'   DG   2           H4'       DG   2  13.592  -3.115  -9.061
  Start of MODEL   12
 9162    H3'   DG   2           H3'       DG   2  14.591  -1.251 -10.751
  Start of MODEL   12
 9163    H2'   DG   2           H2'       DG   2  15.331   0.297  -9.055
  Start of MODEL   12
 9164    H1'   DG   2           H1'       DG   2  12.705  -0.354  -7.618
  Start of MODEL   12
 9165    H8    DG   2           H8        DG   2  16.299   0.962  -7.203
  Start of MODEL   12
 9166    H1    DG   2           H1        DG   2  12.385   1.707  -2.162
  Start of MODEL   12
 9167    H22   DG   2           H21       DG   2  10.204  -0.270  -3.990
  Start of MODEL   12
 9168    H21   DG   2           H22       DG   2  10.486   0.656  -2.536
  Start of MODEL   12
 9169   H5''   DG   2          5H''       DG   2  16.345  -2.178  -9.503
  Start of MODEL   12
 9170   H2''   DG   2          2H''       DG   2  13.731   0.920  -9.437
  Start of MODEL   12
 9171    H5'   DT   3           H5'       DT   3  11.402  -4.234  -9.871
  Start of MODEL   12
 9172    H4'   DT   3           H4'       DT   3   9.204  -5.522 -10.363
  Start of MODEL   12
 9173    H3'   DT   3           H3'       DT   3   8.572  -3.619 -12.163
  Start of MODEL   12
 9174    H2'   DT   3           H2'       DT   3   8.560  -1.743 -10.651
  Start of MODEL   12
 9175    H1'   DT   3           H1'       DT   3   7.137  -3.486  -8.567
  Start of MODEL   12
 9176    H3    DT   3           H3        DT   3   7.819  -0.697  -5.096
  Start of MODEL   12
 9177    H71   DT   3           H71       DT   3  11.486   1.239  -7.278
  Start of MODEL   12
 9178    H73   DT   3           H72       DT   3  10.292   1.908  -8.411
  Start of MODEL   12
 9179    H72   DT   3           H73       DT   3  11.378   0.598  -8.936
  Start of MODEL   12
 9180    H6    DT   3           H6        DT   3   9.878  -1.195  -9.360
  Start of MODEL   12
 9181   H5''   DT   3          5H''       DT   3  11.017  -4.713 -11.540
  Start of MODEL   12
 9182   H2''   DT   3          2H''       DT   3   6.868  -2.218 -10.621
  Start of MODEL   12
 9183    H5'   DG   4           H5'       DG   4   4.741  -7.655  -9.996
  Start of MODEL   12
 9184    H4'   DG   4           H4'       DG   4   6.353  -6.318  -8.375
  Start of MODEL   12
 9185    H3'   DG   4           H3'       DG   4   3.503  -6.831  -8.380
  Start of MODEL   12
 9186    H2'   DG   4           H2'       DG   4   2.793  -4.678  -7.905
  Start of MODEL   12
 9187    H1'   DG   4           H1'       DG   4   5.623  -3.811  -7.219
  Start of MODEL   12
 9188    H8    DG   4           H8        DG   4   5.513  -1.292  -7.111
  Start of MODEL   12
 9189    H1    DG   4           H1        DG   4   1.066  -0.991 -11.731
  Start of MODEL   12
 9190    H22   DG   4           H21       DG   4   1.218  -4.461 -11.674
  Start of MODEL   12
 9191    H21   DG   4           H22       DG   4   0.523  -3.029 -12.396
  Start of MODEL   12
 9192   H5''   DG   4          5H''       DG   4   4.704  -6.102 -10.852
  Start of MODEL   12
 9193   H2''   DG   4          2H''       DG   4   3.656  -4.815  -6.379
  Start of MODEL   12
 9194    H5'   DT   5           H5'       DT   5   4.258  -7.190  -3.354
  Start of MODEL   12
 9195    H4'   DT   5           H4'       DT   5   2.722  -7.216  -1.679
  Start of MODEL   12
 9196    H3'   DT   5           H3'       DT   5   1.572  -9.469  -2.692
  Start of MODEL   12
 9197    H2'   DT   5           H2'       DT   5   0.156  -8.401  -4.309
  Start of MODEL   12
 9198    H1'   DT   5           H1'       DT   5  -0.279  -6.173  -2.260
  Start of MODEL   12
 9199    H3    DT   5           H3        DT   5  -2.999  -3.891  -4.932
  Start of MODEL   12
 9200    H71   DT   5           H71       DT   5  -0.489  -5.003  -8.689
  Start of MODEL   12
 9201    H72   DT   5           H72       DT   5   0.822  -4.004  -8.021
  Start of MODEL   12
 9202    H73   DT   5           H73       DT   5   0.969  -5.780  -8.033
  Start of MODEL   12
 9203    H6    DT   5           H6        DT   5   1.075  -6.255  -5.702
  Start of MODEL   12
 9204   H5''   DT   5          5H''       DT   5   3.607  -8.833  -3.469
  Start of MODEL   12
 9205   H2''   DT   5          2H''       DT   5  -0.907  -8.414  -2.912
  Start of MODEL   12
 9206    H5'   DG   6           H5'       DG   6   2.895  -7.318   1.799
  Start of MODEL   12
 9207    H4'   DG   6           H4'       DG   6   3.236  -8.109   4.168
  Start of MODEL   12
 9208    H3'   DG   6           H3'       DG   6   1.654 -10.266   3.653
  Start of MODEL   12
 9209    H2'   DG   6           H2'       DG   6  -0.434  -9.135   3.432
  Start of MODEL   12
 9210    H1'   DG   6           H1'       DG   6   0.395  -7.164   5.618
  Start of MODEL   12
 9211    H8    DG   6           H8        DG   6  -1.155  -7.522   2.095
  Start of MODEL   12
 9212    H1    DG   6           H1        DG   6  -3.611  -2.861   5.773
  Start of MODEL   12
 9213    H22   DG   6           H21       DG   6  -1.146  -3.798   8.038
  Start of MODEL   12
 9214    H21   DG   6           H22       DG   6  -2.477  -2.724   7.675
  Start of MODEL   12
 9215   H5''   DG   6          5H''       DG   6   3.397  -9.002   2.032
  Start of MODEL   12
 9216   H2''   DG   6          2H''       DG   6  -0.424  -9.377   5.173
  Start of MODEL   12
 9217    H5'   DC   7           H5'       DC   7   4.546 -11.935   4.434
  Start of MODEL   12
 9218    H4'   DC   7           H4'       DC   7   4.660 -14.123   5.058
  Start of MODEL   12
 9219    H3'   DC   7           H3'       DC   7   2.658 -13.957   2.828
  Start of MODEL   12
 9220   HO3'   DC   7           H3T       DC   7   4.854 -13.763   2.385
  Start of MODEL   12
 9221    H2'   DC   7           H2'       DC   7   2.137 -16.262   3.089
  Start of MODEL   12
 9222    H1'   DC   7           H1'       DC   7   2.537 -16.376   5.910
  Start of MODEL   12
 9223    H42   DC   7           H41       DC   7  -3.844 -15.127   4.571
  Start of MODEL   12
 9224    H41   DC   7           H42       DC   7  -3.798 -16.392   5.780
  Start of MODEL   12
 9225    H5    DC   7           H5        DC   7  -1.850 -14.117   3.650
  Start of MODEL   12
 9226    H6    DC   7           H6        DC   7   0.588 -14.114   3.693
  Start of MODEL   12
 9227   H5''   DC   7          5H''       DC   7   2.826 -12.027   3.999
  Start of MODEL   12
 9228   H2''   DC   7          2H''       DC   7   3.650 -16.616   3.916
  Start of MODEL   13
 9229    H1   GLY  25           HT1      GLY  25  -9.451 -17.372  -5.118
  Start of MODEL   13
 9230    H2   GLY  25           HT2      GLY  25 -11.006 -17.484  -4.446
  Start of MODEL   13
 9231    H3   GLY  25           HT3      GLY  25  -9.876 -18.710  -4.167
  Start of MODEL   13
 9232    HA3  GLY  25           HA2      GLY  25  -8.468 -17.188  -2.932
  Start of MODEL   13
 9233    HA2  GLY  25           HA3      GLY  25 -10.066 -17.335  -2.214
  Start of MODEL   13
 9234    H    ALA  26           H        ALA  26 -11.483 -15.703  -4.040
  Start of MODEL   13
 9235    HA   ALA  26           HA       ALA  26 -10.866 -13.107  -3.001
  Start of MODEL   13
 9236    HB3  ALA  26           HB1      ALA  26  -9.227 -13.205  -4.834
  Start of MODEL   13
 9237    HB2  ALA  26           HB2      ALA  26 -10.452 -11.972  -5.109
  Start of MODEL   13
 9238    HB1  ALA  26           HB3      ALA  26 -10.532 -13.502  -5.975
  Start of MODEL   13
 9239    H    MET  27           H        MET  27 -12.906 -12.751  -2.362
  Start of MODEL   13
 9240    HA   MET  27           HA       MET  27 -15.145 -13.522  -4.052
  Start of MODEL   13
 9241    HB2  MET  27           HB2      MET  27 -14.975 -12.353  -1.277
  Start of MODEL   13
 9242    HB3  MET  27           HB3      MET  27 -16.499 -12.606  -2.109
  Start of MODEL   13
 9243    HG2  MET  27           HG2      MET  27 -16.069 -14.997  -2.201
  Start of MODEL   13
 9244    HG3  MET  27           HG3      MET  27 -14.509 -14.751  -1.414
  Start of MODEL   13
 9245    HE3  MET  27           HE1      MET  27 -17.752 -12.739  -0.593
  Start of MODEL   13
 9246    HE2  MET  27           HE2      MET  27 -18.489 -13.712   0.680
  Start of MODEL   13
 9247    HE1  MET  27           HE3      MET  27 -18.425 -14.324  -0.972
  Start of MODEL   13
 9248    H    GLY  28           H        GLY  28 -14.155 -10.547  -2.357
  Start of MODEL   13
 9249    HA2  GLY  28           HA2      GLY  28 -14.318  -8.367  -3.434
  Start of MODEL   13
 9250    HA3  GLY  28           HA3      GLY  28 -15.691  -8.997  -4.344
  Start of MODEL   13
 9251    H    SER  29           H        SER  29 -16.367  -6.788  -3.209
  Start of MODEL   13
 9252    HA   SER  29           HA       SER  29 -17.483  -5.649  -1.582
  Start of MODEL   13
 9253    HB2  SER  29           HB2      SER  29 -19.567  -6.914  -0.814
  Start of MODEL   13
 9254    HB3  SER  29           HB3      SER  29 -19.353  -6.705  -2.548
  Start of MODEL   13
 9255    HG   SER  29           HG       SER  29 -19.182  -9.014  -0.987
  Start of MODEL   13
 9256    H    ARG  30           H        ARG  30 -15.221  -6.405  -0.458
  Start of MODEL   13
 9257    HA   ARG  30           HA       ARG  30 -15.928  -7.568   2.144
  Start of MODEL   13
 9258    HB2  ARG  30           HB2      ARG  30 -13.356  -7.518   0.595
  Start of MODEL   13
 9259    HB3  ARG  30           HB3      ARG  30 -13.350  -7.767   2.337
  Start of MODEL   13
 9260    HG2  ARG  30           HG2      ARG  30 -14.815  -9.466   0.322
  Start of MODEL   13
 9261    HG3  ARG  30           HG3      ARG  30 -13.301  -9.889   1.130
  Start of MODEL   13
 9262    HD2  ARG  30           HD2      ARG  30 -14.407  -9.838   3.283
  Start of MODEL   13
 9263    HD3  ARG  30           HD3      ARG  30 -15.910  -9.317   2.527
  Start of MODEL   13
 9264    HE   ARG  30           HE       ARG  30 -15.474 -11.641   1.287
  Start of MODEL   13
 9265   HH11  ARG  30          HH11      ARG  30 -15.257 -10.771   4.664
  Start of MODEL   13
 9266   HH12  ARG  30          HH12      ARG  30 -15.803 -12.313   5.243
  Start of MODEL   13
 9267   HH21  ARG  30          HH21      ARG  30 -16.165 -13.723   2.046
  Start of MODEL   13
 9268   HH22  ARG  30          HH22      ARG  30 -16.313 -13.988   3.754
  Start of MODEL   13
 9269    H    ASP  31           H        ASP  31 -14.578  -6.706   3.966
  Start of MODEL   13
 9270    HA   ASP  31           HA       ASP  31 -15.345  -4.061   4.419
  Start of MODEL   13
 9271    HB2  ASP  31           HB2      ASP  31 -14.762  -5.990   6.061
  Start of MODEL   13
 9272    HB3  ASP  31           HB3      ASP  31 -13.110  -5.400   5.921
  Start of MODEL   13
 9273    H    THR  32           H        THR  32 -12.440  -5.402   3.114
  Start of MODEL   13
 9274    HA   THR  32           HA       THR  32 -11.043  -2.841   3.319
  Start of MODEL   13
 9275    HB   THR  32           HB       THR  32  -9.052  -4.164   2.550
  Start of MODEL   13
 9276    HG1  THR  32           HG1      THR  32  -9.581  -6.577   3.042
  Start of MODEL   13
 9277   HG23  THR  32          HG21      THR  32  -9.485  -3.717   4.930
  Start of MODEL   13
 9278   HG22  THR  32          HG22      THR  32  -8.708  -5.280   4.686
  Start of MODEL   13
 9279   HG21  THR  32          HG23      THR  32 -10.438  -5.198   5.025
  Start of MODEL   13
 9280    H    MET  33           H        MET  33 -13.009  -4.344   1.087
  Start of MODEL   13
 9281    HA   MET  33           HA       MET  33 -11.632  -4.413  -1.278
  Start of MODEL   13
 9282    HB2  MET  33           HB2      MET  33 -13.994  -5.114  -0.941
  Start of MODEL   13
 9283    HB3  MET  33           HB3      MET  33 -14.467  -3.431  -1.026
  Start of MODEL   13
 9284    HG2  MET  33           HG2      MET  33 -13.593  -3.282  -3.289
  Start of MODEL   13
 9285    HG3  MET  33           HG3      MET  33 -13.086  -4.966  -3.213
  Start of MODEL   13
 9286    HE1  MET  33           HE1      MET  33 -14.410  -5.416  -5.504
  Start of MODEL   13
 9287    HE3  MET  33           HE2      MET  33 -14.910  -3.725  -5.534
  Start of MODEL   13
 9288    HE2  MET  33           HE3      MET  33 -16.110  -5.002  -5.732
  Start of MODEL   13
 9289    H    PHE  34           H        PHE  34 -13.431  -1.546  -0.062
  Start of MODEL   13
 9290    HA   PHE  34           HA       PHE  34 -12.167  -0.013  -2.219
  Start of MODEL   13
 9291    HB2  PHE  34           HB2      PHE  34 -14.541   0.615  -0.457
  Start of MODEL   13
 9292    HB3  PHE  34           HB3      PHE  34 -13.887   1.709  -1.671
  Start of MODEL   13
 9293    HD1  PHE  34           HD1      PHE  34 -15.989  -1.142  -1.038
  Start of MODEL   13
 9294    HD2  PHE  34           HD2      PHE  34 -14.022   1.086  -4.078
  Start of MODEL   13
 9295    HE1  PHE  34           HE1      PHE  34 -17.426  -2.200  -2.731
  Start of MODEL   13
 9296    HE2  PHE  34           HE2      PHE  34 -15.457   0.040  -5.781
  Start of MODEL   13
 9297    HZ   PHE  34           HZ       PHE  34 -17.193  -1.535  -5.119
  Start of MODEL   13
 9298    H    THR  35           H        THR  35 -11.506  -0.752   0.878
  Start of MODEL   13
 9299    HA   THR  35           HA       THR  35 -10.743   1.986   1.613
  Start of MODEL   13
 9300    HB   THR  35           HB       THR  35 -10.662   1.111   3.956
  Start of MODEL   13
 9301    HG1  THR  35           HG1      THR  35 -12.132  -0.973   3.933
  Start of MODEL   13
 9302   HG23  THR  35          HG21      THR  35 -12.623   2.319   3.107
  Start of MODEL   13
 9303   HG22  THR  35          HG22      THR  35 -13.098   1.058   4.246
  Start of MODEL   13
 9304   HG21  THR  35          HG23      THR  35 -13.302   0.803   2.513
  Start of MODEL   13
 9305    H    LYS  36           H        LYS  36  -9.488  -1.169   0.904
  Start of MODEL   13
 9306    HA   LYS  36           HA       LYS  36  -6.955  -0.683   2.202
  Start of MODEL   13
 9307    HB2  LYS  36           HB2      LYS  36  -7.878  -2.937   2.140
  Start of MODEL   13
 9308    HB3  LYS  36           HB3      LYS  36  -7.935  -2.892   0.385
  Start of MODEL   13
 9309    HG2  LYS  36           HG2      LYS  36  -5.480  -2.767   0.333
  Start of MODEL   13
 9310    HG3  LYS  36           HG3      LYS  36  -5.458  -2.883   2.096
  Start of MODEL   13
 9311    HD2  LYS  36           HD2      LYS  36  -6.493  -5.063   2.011
  Start of MODEL   13
 9312    HD3  LYS  36           HD3      LYS  36  -6.689  -4.940   0.261
  Start of MODEL   13
 9313    HE2  LYS  36           HE2      LYS  36  -4.235  -4.851   0.025
  Start of MODEL   13
 9314    HE3  LYS  36           HE3      LYS  36  -4.081  -5.054   1.768
  Start of MODEL   13
 9315    HZ2  LYS  36           HZ1      LYS  36  -3.806  -7.147   0.567
  Start of MODEL   13
 9316    HZ1  LYS  36           HZ2      LYS  36  -5.367  -7.005  -0.068
  Start of MODEL   13
 9317    HZ3  LYS  36           HZ3      LYS  36  -5.145  -7.206   1.602
  Start of MODEL   13
 9318    H    ILE  37           H        ILE  37  -5.572   0.633   1.319
  Start of MODEL   13
 9319    HA   ILE  37           HA       ILE  37  -5.429   0.943  -1.590
  Start of MODEL   13
 9320    HB   ILE  37           HB       ILE  37  -4.275   2.653   0.624
  Start of MODEL   13
 9321   HD12  ILE  37          HD11      ILE  37  -7.016   5.153   0.054
  Start of MODEL   13
 9322   HD11  ILE  37          HD12      ILE  37  -5.428   5.229  -0.714
  Start of MODEL   13
 9323   HD13  ILE  37          HD13      ILE  37  -5.562   4.853   1.006
  Start of MODEL   13
 9324    H    PHE  38           H        PHE  38  -3.661   0.299  -2.706
  Start of MODEL   13
 9325    HA   PHE  38           HA       PHE  38  -1.391  -0.757  -1.185
  Start of MODEL   13
 9326    HB2  PHE  38           HB2      PHE  38  -2.264  -2.323  -2.813
  Start of MODEL   13
 9327    HB3  PHE  38           HB3      PHE  38  -2.171  -1.110  -4.087
  Start of MODEL   13
 9328    HD1  PHE  38           HD1      PHE  38  -0.343  -1.105  -5.482
  Start of MODEL   13
 9329    HD2  PHE  38           HD2      PHE  38   0.007  -2.849  -1.616
  Start of MODEL   13
 9330    HE1  PHE  38           HE1      PHE  38   1.948  -1.822  -6.016
  Start of MODEL   13
 9331    HE2  PHE  38           HE2      PHE  38   2.295  -3.570  -2.144
  Start of MODEL   13
 9332    HZ   PHE  38           HZ       PHE  38   3.274  -3.057  -4.345
  Start of MODEL   13
 9333    H    VAL  39           H        VAL  39   0.433   0.376  -1.055
  Start of MODEL   13
 9334    HA   VAL  39           HA       VAL  39   0.767   2.633  -2.908
  Start of MODEL   13
 9335    HB   VAL  39           HB       VAL  39   2.219   2.331  -0.284
  Start of MODEL   13
 9336    H    GLY  40           H        GLY  40   2.527   2.728  -4.160
  Start of MODEL   13
 9337    HA2  GLY  40           HA2      GLY  40   4.500   0.543  -3.901
  Start of MODEL   13
 9338    HA3  GLY  40           HA3      GLY  40   3.739   0.882  -5.447
  Start of MODEL   13
 9339    H    GLY  41           H        GLY  41   6.541   0.923  -4.971
  Start of MODEL   13
 9340    HA2  GLY  41           HA2      GLY  41   8.255   2.202  -5.841
  Start of MODEL   13
 9341    HA3  GLY  41           HA3      GLY  41   7.092   3.479  -6.163
  Start of MODEL   13
 9342    H    LEU  42           H        LEU  42   6.972   2.389  -2.976
  Start of MODEL   13
 9343    HA   LEU  42           HA       LEU  42   7.841   4.864  -1.904
  Start of MODEL   13
 9344    HB2  LEU  42           HB2      LEU  42   7.289   2.197  -0.610
  Start of MODEL   13
 9345    HB3  LEU  42           HB3      LEU  42   7.654   3.655   0.288
  Start of MODEL   13
 9346    HG   LEU  42           HG       LEU  42   5.276   3.320  -1.534
  Start of MODEL   13
 9347   HD12  LEU  42          HD11      LEU  42   3.978   3.212   0.547
  Start of MODEL   13
 9348   HD11  LEU  42          HD12      LEU  42   5.477   3.212   1.473
  Start of MODEL   13
 9349   HD13  LEU  42          HD13      LEU  42   5.104   1.862   0.404
  Start of MODEL   13
 9350   HD21  LEU  42          HD21      LEU  42   6.054   5.622  -1.336
  Start of MODEL   13
 9351   HD23  LEU  42          HD22      LEU  42   6.026   5.489   0.422
  Start of MODEL   13
 9352   HD22  LEU  42          HD23      LEU  42   4.520   5.403  -0.492
  Start of MODEL   13
 9353    HA   PRO  43           HA       PRO  43  12.213   4.035  -1.585
  Start of MODEL   13
 9354    HB2  PRO  43           HB2      PRO  43  12.721   5.888   0.390
  Start of MODEL   13
 9355    HB3  PRO  43           HB3      PRO  43  12.645   6.263  -1.334
  Start of MODEL   13
 9356    HG2  PRO  43           HG2      PRO  43  10.599   6.669   0.790
  Start of MODEL   13
 9357    HG3  PRO  43           HG3      PRO  43  10.986   7.685  -0.610
  Start of MODEL   13
 9358    HD2  PRO  43           HD2      PRO  43   8.819   6.040  -0.522
  Start of MODEL   13
 9359    HD3  PRO  43           HD3      PRO  43   9.665   6.444  -2.028
  Start of MODEL   13
 9360    H    TYR  44           H        TYR  44  13.576   2.981  -0.072
  Start of MODEL   13
 9361    HA   TYR  44           HA       TYR  44  12.106   1.151   1.514
  Start of MODEL   13
 9362    HB2  TYR  44           HB2      TYR  44  15.098   1.596   1.469
  Start of MODEL   13
 9363    HB3  TYR  44           HB3      TYR  44  14.262   0.158   2.042
  Start of MODEL   13
 9364    HD1  TYR  44           HD1      TYR  44  12.571  -0.854   0.173
  Start of MODEL   13
 9365    HD2  TYR  44           HD2      TYR  44  16.055   1.458  -0.614
  Start of MODEL   13
 9366    HE1  TYR  44           HE1      TYR  44  12.708  -1.845  -2.075
  Start of MODEL   13
 9367    HE2  TYR  44           HE2      TYR  44  16.202   0.481  -2.865
  Start of MODEL   13
 9368    HH   TYR  44           HH       TYR  44  13.664  -1.382  -4.244
  Start of MODEL   13
 9369    H    HIS  45           H        HIS  45  13.769   4.108   2.246
  Start of MODEL   13
 9370    HA   HIS  45           HA       HIS  45  13.905   3.625   5.060
  Start of MODEL   13
 9371    HB2  HIS  45           HB2      HIS  45  14.698   5.914   5.277
  Start of MODEL   13
 9372    HB3  HIS  45           HB3      HIS  45  15.546   5.083   3.984
  Start of MODEL   13
 9373    HD1  HIS  45           HD1      HIS  45  13.780   8.139   4.744
  Start of MODEL   13
 9374    HD2  HIS  45           HD2      HIS  45  14.544   5.906   1.321
  Start of MODEL   13
 9375    HE1  HIS  45           HE1      HIS  45  13.353   9.689   2.812
  Start of MODEL   13
 9376    HE2  HIS  45           HE2      HIS  45  13.990   8.369   0.756
  Start of MODEL   13
 9377    H    THR  46           H        THR  46  11.312   4.689   3.053
  Start of MODEL   13
 9378    HA   THR  46           HA       THR  46   9.859   6.320   4.737
  Start of MODEL   13
 9379    HB   THR  46           HB       THR  46   8.828   4.137   2.904
  Start of MODEL   13
 9380    HG1  THR  46           HG1      THR  46   9.158   6.952   2.490
  Start of MODEL   13
 9381   HG21  THR  46          HG21      THR  46   7.403   6.581   3.985
  Start of MODEL   13
 9382   HG23  THR  46          HG22      THR  46   7.115   4.922   4.512
  Start of MODEL   13
 9383   HG22  THR  46          HG23      THR  46   6.746   5.399   2.855
  Start of MODEL   13
 9384    H    SER  47           H        SER  47   8.542   6.041   6.491
  Start of MODEL   13
 9385    HA   SER  47           HA       SER  47   8.499   3.352   7.663
  Start of MODEL   13
 9386    HB2  SER  47           HB2      SER  47   8.248   4.469   9.832
  Start of MODEL   13
 9387    HB3  SER  47           HB3      SER  47   9.699   5.028   9.003
  Start of MODEL   13
 9388    HG   SER  47           HG       SER  47   8.316   6.837   8.258
  Start of MODEL   13
 9389    H    ASP  48           H        ASP  48   6.595   2.780   8.907
  Start of MODEL   13
 9390    HA   ASP  48           HA       ASP  48   4.163   3.029   7.669
  Start of MODEL   13
 9391    HB2  ASP  48           HB2      ASP  48   4.424   2.768  10.667
  Start of MODEL   13
 9392    HB3  ASP  48           HB3      ASP  48   3.195   2.066   9.619
  Start of MODEL   13
 9393    H    LYS  49           H        LYS  49   5.583   5.118  10.097
  Start of MODEL   13
 9394    HA   LYS  49           HA       LYS  49   3.261   6.628  10.677
  Start of MODEL   13
 9395    HB2  LYS  49           HB2      LYS  49   5.289   6.506  12.124
  Start of MODEL   13
 9396    HB3  LYS  49           HB3      LYS  49   6.147   7.481  10.943
  Start of MODEL   13
 9397    HG2  LYS  49           HG2      LYS  49   4.589   9.321  11.315
  Start of MODEL   13
 9398    HG3  LYS  49           HG3      LYS  49   3.710   8.346  12.492
  Start of MODEL   13
 9399    HD2  LYS  49           HD2      LYS  49   6.589   9.222  12.707
  Start of MODEL   13
 9400    HD3  LYS  49           HD3      LYS  49   5.230   9.923  13.587
  Start of MODEL   13
 9401    HE2  LYS  49           HE2      LYS  49   5.956   8.487  15.191
  Start of MODEL   13
 9402    HE3  LYS  49           HE3      LYS  49   4.917   7.368  14.309
  Start of MODEL   13
 9403    HZ1  LYS  49           HZ1      LYS  49   7.038   6.845  12.989
  Start of MODEL   13
 9404    HZ3  LYS  49           HZ2      LYS  49   6.895   6.210  14.551
  Start of MODEL   13
 9405    HZ2  LYS  49           HZ3      LYS  49   7.861   7.576  14.274
  Start of MODEL   13
 9406    H    THR  50           H        THR  50   5.836   6.960   8.308
  Start of MODEL   13
 9407    HA   THR  50           HA       THR  50   5.168   9.540   7.371
  Start of MODEL   13
 9408    HB   THR  50           HB       THR  50   6.395   7.321   5.712
  Start of MODEL   13
 9409    HG1  THR  50           HG1      THR  50   7.953   9.110   7.238
  Start of MODEL   13
 9410   HG22  THR  50          HG21      THR  50   7.628   9.178   4.653
  Start of MODEL   13
 9411   HG21  THR  50          HG22      THR  50   6.754  10.322   5.674
  Start of MODEL   13
 9412   HG23  THR  50          HG23      THR  50   5.882   9.360   4.483
  Start of MODEL   13
 9413    H    LEU  51           H        LEU  51   4.066   6.306   6.443
  Start of MODEL   13
 9414    HA   LEU  51           HA       LEU  51   2.462   7.223   4.245
  Start of MODEL   13
 9415    HB2  LEU  51           HB2      LEU  51   2.402   4.662   5.838
  Start of MODEL   13
 9416    HB3  LEU  51           HB3      LEU  51   1.331   4.977   4.485
  Start of MODEL   13
 9417    HG   LEU  51           HG       LEU  51   4.334   4.732   4.397
  Start of MODEL   13
 9418   HD12  LEU  51          HD11      LEU  51   3.836   2.822   2.943
  Start of MODEL   13
 9419   HD11  LEU  51          HD12      LEU  51   2.114   3.079   3.212
  Start of MODEL   13
 9420   HD13  LEU  51          HD13      LEU  51   3.155   2.617   4.555
  Start of MODEL   13
 9421   HD21  LEU  51          HD21      LEU  51   3.632   6.491   2.879
  Start of MODEL   13
 9422   HD23  LEU  51          HD22      LEU  51   2.387   5.438   2.204
  Start of MODEL   13
 9423   HD22  LEU  51          HD23      LEU  51   4.093   5.051   1.968
  Start of MODEL   13
 9424    H    HIS  52           H        HIS  52   1.920   6.392   7.586
  Start of MODEL   13
 9425    HA   HIS  52           HA       HIS  52  -0.795   6.810   7.851
  Start of MODEL   13
 9426    HB2  HIS  52           HB2      HIS  52   0.928   6.056   9.599
  Start of MODEL   13
 9427    HB3  HIS  52           HB3      HIS  52   1.229   7.763   9.880
  Start of MODEL   13
 9428    HD1  HIS  52           HD1      HIS  52  -1.078   9.154  10.638
  Start of MODEL   13
 9429    HD2  HIS  52           HD2      HIS  52  -0.996   5.019  11.143
  Start of MODEL   13
 9430    HE1  HIS  52           HE1      HIS  52  -2.833   8.639  12.359
  Start of MODEL   13
 9431    HE2  HIS  52           HE2      HIS  52  -2.549   6.178  12.840
  Start of MODEL   13
 9432    H    GLU  53           H        GLU  53   1.779   9.244   8.393
  Start of MODEL   13
 9433    HA   GLU  53           HA       GLU  53   0.108  11.379   8.872
  Start of MODEL   13
 9434    HB2  GLU  53           HB2      GLU  53   1.990  12.751   8.749
  Start of MODEL   13
 9435    HB3  GLU  53           HB3      GLU  53   2.623  11.176   9.209
  Start of MODEL   13
 9436    HG2  GLU  53           HG2      GLU  53   3.253  10.758   6.901
  Start of MODEL   13
 9437    HG3  GLU  53           HG3      GLU  53   2.683  12.363   6.458
  Start of MODEL   13
 9438    H    TYR  54           H        TYR  54   1.413  10.333   5.767
  Start of MODEL   13
 9439    HA   TYR  54           HA       TYR  54   0.470  12.618   4.367
  Start of MODEL   13
 9440    HB2  TYR  54           HB2      TYR  54   2.315  11.169   3.538
  Start of MODEL   13
 9441    HB3  TYR  54           HB3      TYR  54   1.135   9.907   3.202
  Start of MODEL   13
 9442    HD1  TYR  54           HD1      TYR  54  -0.248   9.997   1.264
  Start of MODEL   13
 9443    HD2  TYR  54           HD2      TYR  54   2.273  13.280   2.242
  Start of MODEL   13
 9444    HE1  TYR  54           HE1      TYR  54  -0.636  10.951  -0.969
  Start of MODEL   13
 9445    HE2  TYR  54           HE2      TYR  54   1.894  14.245   0.015
  Start of MODEL   13
 9446    HH   TYR  54           HH       TYR  54   1.229  13.507  -2.224
  Start of MODEL   13
 9447    H    PHE  55           H        PHE  55  -0.767   9.274   4.448
  Start of MODEL   13
 9448    HA   PHE  55           HA       PHE  55  -2.999   9.911   2.836
  Start of MODEL   13
 9449    HB2  PHE  55           HB2      PHE  55  -2.273   7.510   4.475
  Start of MODEL   13
 9450    HB3  PHE  55           HB3      PHE  55  -3.798   7.608   3.599
  Start of MODEL   13
 9451    HD1  PHE  55           HD1      PHE  55  -0.151   7.395   3.282
  Start of MODEL   13
 9452    HD2  PHE  55           HD2      PHE  55  -3.866   7.481   1.205
  Start of MODEL   13
 9453    HE1  PHE  55           HE1      PHE  55   0.978   6.620   1.237
  Start of MODEL   13
 9454    HE2  PHE  55           HE2      PHE  55  -2.740   6.705  -0.838
  Start of MODEL   13
 9455    HZ   PHE  55           HZ       PHE  55  -0.323   6.269  -0.826
  Start of MODEL   13
 9456    H    GLU  56           H        GLU  56  -2.564  10.037   6.311
  Start of MODEL   13
 9457    HA   GLU  56           HA       GLU  56  -5.303   9.718   6.958
  Start of MODEL   13
 9458    HB2  GLU  56           HB2      GLU  56  -4.766  10.440   9.172
  Start of MODEL   13
 9459    HB3  GLU  56           HB3      GLU  56  -3.434   9.449   8.596
  Start of MODEL   13
 9460    HG2  GLU  56           HG2      GLU  56  -2.146  11.470   8.105
  Start of MODEL   13
 9461    HG3  GLU  56           HG3      GLU  56  -3.480  12.461   8.696
  Start of MODEL   13
 9462    H    GLN  57           H        GLN  57  -3.542  12.324   5.637
  Start of MODEL   13
 9463    HA   GLN  57           HA       GLN  57  -5.072  14.501   6.566
  Start of MODEL   13
 9464    HB2  GLN  57           HB2      GLN  57  -3.565  14.235   3.961
  Start of MODEL   13
 9465    HB3  GLN  57           HB3      GLN  57  -4.080  15.744   4.704
  Start of MODEL   13
 9466    HG2  GLN  57           HG2      GLN  57  -2.620  15.360   6.584
  Start of MODEL   13
 9467    HG3  GLN  57           HG3      GLN  57  -2.161  13.787   5.942
  Start of MODEL   13
 9468   HE21  GLN  57          HE21      GLN  57  -0.022  14.236   5.807
  Start of MODEL   13
 9469   HE22  GLN  57          HE22      GLN  57   0.643  15.363   4.674
  Start of MODEL   13
 9470    H    PHE  58           H        PHE  58  -6.004  11.980   4.539
  Start of MODEL   13
 9471    HA   PHE  58           HA       PHE  58  -7.906  13.595   3.023
  Start of MODEL   13
 9472    HB2  PHE  58           HB2      PHE  58  -7.351  10.620   2.916
  Start of MODEL   13
 9473    HB3  PHE  58           HB3      PHE  58  -8.520  11.455   1.907
  Start of MODEL   13
 9474    HD1  PHE  58           HD1      PHE  58  -4.901  11.357   2.745
  Start of MODEL   13
 9475    HD2  PHE  58           HD2      PHE  58  -7.882  12.404  -0.102
  Start of MODEL   13
 9476    HE1  PHE  58           HE1      PHE  58  -3.143  11.861   1.105
  Start of MODEL   13
 9477    HE2  PHE  58           HE2      PHE  58  -6.127  12.919  -1.753
  Start of MODEL   13
 9478    HZ   PHE  58           HZ       PHE  58  -3.755  12.648  -1.149
  Start of MODEL   13
 9479    H    GLY  59           H        GLY  59  -7.783  11.956   5.970
  Start of MODEL   13
 9480    HA2  GLY  59           HA2      GLY  59 -10.201  12.673   6.944
  Start of MODEL   13
 9481    HA3  GLY  59           HA3      GLY  59 -10.588  11.224   6.037
  Start of MODEL   13
 9482    H    ASP  60           H        ASP  60 -10.295   9.305   6.971
  Start of MODEL   13
 9483    HA   ASP  60           HA       ASP  60  -8.739   9.189   9.466
  Start of MODEL   13
 9484    HB2  ASP  60           HB2      ASP  60 -11.474   8.065   8.905
  Start of MODEL   13
 9485    HB3  ASP  60           HB3      ASP  60 -10.439   7.365  10.141
  Start of MODEL   13
 9486    H    ILE  61           H        ILE  61  -7.233   7.632   9.524
  Start of MODEL   13
 9487    HA   ILE  61           HA       ILE  61  -7.408   5.450   7.593
  Start of MODEL   13
 9488    HB   ILE  61           HB       ILE  61  -5.145   6.667   9.136
  Start of MODEL   13
 9489   HD12  ILE  61          HD11      ILE  61  -3.575   7.464   5.892
  Start of MODEL   13
 9490   HD11  ILE  61          HD12      ILE  61  -3.077   6.167   6.978
  Start of MODEL   13
 9491   HD13  ILE  61          HD13      ILE  61  -3.487   7.753   7.629
  Start of MODEL   13
 9492    H    GLU  62           H        GLU  62  -7.609   3.387   8.193
  Start of MODEL   13
 9493    HA   GLU  62           HA       GLU  62  -8.182   2.698  10.937
  Start of MODEL   13
 9494    HB2  GLU  62           HB2      GLU  62  -8.256   1.364   8.280
  Start of MODEL   13
 9495    HB3  GLU  62           HB3      GLU  62  -8.087   0.331   9.686
  Start of MODEL   13
 9496    HG2  GLU  62           HG2      GLU  62 -10.295   2.324   9.232
  Start of MODEL   13
 9497    HG3  GLU  62           HG3      GLU  62 -10.418   0.583   8.979
  Start of MODEL   13
 9498    H    GLU  63           H        GLU  63  -5.723   1.949   8.509
  Start of MODEL   13
 9499    HA   GLU  63           HA       GLU  63  -3.693   1.638  10.533
  Start of MODEL   13
 9500    HB2  GLU  63           HB2      GLU  63  -4.790  -0.605  10.474
  Start of MODEL   13
 9501    HB3  GLU  63           HB3      GLU  63  -4.353  -0.731   8.773
  Start of MODEL   13
 9502    HG2  GLU  63           HG2      GLU  63  -2.813  -1.948  10.237
  Start of MODEL   13
 9503    HG3  GLU  63           HG3      GLU  63  -2.007  -0.667   9.330
  Start of MODEL   13
 9504    H    ALA  64           H        ALA  64  -1.640   1.990   9.706
  Start of MODEL   13
 9505    HA   ALA  64           HA       ALA  64  -1.341   2.104   6.791
  Start of MODEL   13
 9506    HB1  ALA  64           HB1      ALA  64  -1.848   4.389   7.582
  Start of MODEL   13
 9507    HB3  ALA  64           HB2      ALA  64  -0.229   4.254   6.893
  Start of MODEL   13
 9508    HB2  ALA  64           HB3      ALA  64  -0.439   4.313   8.645
  Start of MODEL   13
 9509    H    VAL  65           H        VAL  65   0.332   0.864   6.263
  Start of MODEL   13
 9510    HA   VAL  65           HA       VAL  65   2.599   0.660   8.123
  Start of MODEL   13
 9511    HB   VAL  65           HB       VAL  65   2.676  -1.779   7.869
  Start of MODEL   13
 9512    H    VAL  66           H        VAL  66   4.572   0.166   7.202
  Start of MODEL   13
 9513    HA   VAL  66           HA       VAL  66   4.671   0.052   4.261
  Start of MODEL   13
 9514    HB   VAL  66           HB       VAL  66   6.928   0.444   6.254
  Start of MODEL   13
 9515    H    ILE  67           H        ILE  67   5.510  -1.798   3.224
  Start of MODEL   13
 9516    HA   ILE  67           HA       ILE  67   4.999  -4.116   4.881
  Start of MODEL   13
 9517    HB   ILE  67           HB       ILE  67   5.277  -3.850   1.894
  Start of MODEL   13
 9518   HD11  ILE  67          HD11      ILE  67   3.246  -3.773   4.939
  Start of MODEL   13
 9519   HD13  ILE  67          HD12      ILE  67   2.673  -5.314   4.297
  Start of MODEL   13
 9520   HD12  ILE  67          HD13      ILE  67   1.678  -3.865   4.145
  Start of MODEL   13
 9521    H    THR  68           H        THR  68   6.412  -5.420   5.611
  Start of MODEL   13
 9522    HA   THR  68           HA       THR  68   9.121  -5.467   4.477
  Start of MODEL   13
 9523    HB   THR  68           HB       THR  68   9.932  -5.927   6.813
  Start of MODEL   13
 9524    HG1  THR  68           HG1      THR  68   7.920  -4.769   8.150
  Start of MODEL   13
 9525   HG23  THR  68          HG21      THR  68  10.175  -3.693   5.883
  Start of MODEL   13
 9526   HG22  THR  68          HG22      THR  68   9.790  -3.591   7.600
  Start of MODEL   13
 9527   HG21  THR  68          HG23      THR  68   8.541  -3.278   6.395
  Start of MODEL   13
 9528    H    ASP  69           H        ASP  69  10.032  -7.548   4.347
  Start of MODEL   13
 9529    HA   ASP  69           HA       ASP  69   8.329  -9.718   4.079
  Start of MODEL   13
 9530    HB2  ASP  69           HB2      ASP  69  10.462  -9.783   3.026
  Start of MODEL   13
 9531    HB3  ASP  69           HB3      ASP  69  11.303  -9.570   4.557
  Start of MODEL   13
 9532    H    ARG  70           H        ARG  70   7.573 -11.266   5.389
  Start of MODEL   13
 9533    HA   ARG  70           HA       ARG  70   7.291 -10.843   8.106
  Start of MODEL   13
 9534    HB2  ARG  70           HB2      ARG  70   5.759 -12.217   6.860
  Start of MODEL   13
 9535    HB3  ARG  70           HB3      ARG  70   7.027 -13.370   6.477
  Start of MODEL   13
 9536    HG2  ARG  70           HG2      ARG  70   5.717 -14.379   8.141
  Start of MODEL   13
 9537    HG3  ARG  70           HG3      ARG  70   7.181 -13.833   8.955
  Start of MODEL   13
 9538    HD2  ARG  70           HD2      ARG  70   4.709 -12.133   8.908
  Start of MODEL   13
 9539    HD3  ARG  70           HD3      ARG  70   4.889 -13.433  10.081
  Start of MODEL   13
 9540    HE   ARG  70           HE       ARG  70   7.001 -11.409   9.926
  Start of MODEL   13
 9541   HH11  ARG  70          HH11      ARG  70   4.368 -12.913  11.658
  Start of MODEL   13
 9542   HH12  ARG  70          HH12      ARG  70   4.653 -12.036  13.133
  Start of MODEL   13
 9543   HH21  ARG  70          HH21      ARG  70   7.403 -10.251  11.887
  Start of MODEL   13
 9544   HH22  ARG  70          HH22      ARG  70   6.351 -10.499  13.250
  Start of MODEL   13
 9545    H    ASN  71           H        ASN  71   9.880 -12.557   6.460
  Start of MODEL   13
 9546    HA   ASN  71           HA       ASN  71  10.711 -13.824   8.955
  Start of MODEL   13
 9547    HB2  ASN  71           HB2      ASN  71  11.563 -14.167   6.089
  Start of MODEL   13
 9548    HB3  ASN  71           HB3      ASN  71  12.455 -14.897   7.418
  Start of MODEL   13
 9549   HD21  ASN  71          HD21      ASN  71  11.995 -16.960   6.620
  Start of MODEL   13
 9550   HD22  ASN  71          HD22      ASN  71  10.426 -17.679   6.811
  Start of MODEL   13
 9551    H    THR  72           H        THR  72  12.214 -11.837   6.400
  Start of MODEL   13
 9552    HA   THR  72           HA       THR  72  14.512 -11.341   8.124
  Start of MODEL   13
 9553    HB   THR  72           HB       THR  72  15.371 -10.107   6.089
  Start of MODEL   13
 9554    HG1  THR  72           HG1      THR  72  12.988 -11.241   4.971
  Start of MODEL   13
 9555   HG22  THR  72          HG21      THR  72  15.838 -12.172   4.841
  Start of MODEL   13
 9556   HG21  THR  72          HG22      THR  72  14.585 -13.006   5.762
  Start of MODEL   13
 9557   HG23  THR  72          HG23      THR  72  16.028 -12.403   6.579
  Start of MODEL   13
 9558    H    GLN  73           H        GLN  73  11.683  -9.789   7.094
  Start of MODEL   13
 9559    HA   GLN  73           HA       GLN  73  10.598  -7.904   7.897
  Start of MODEL   13
 9560    HB2  GLN  73           HB2      GLN  73  12.996  -7.574   9.711
  Start of MODEL   13
 9561    HB3  GLN  73           HB3      GLN  73  11.427  -6.803   9.901
  Start of MODEL   13
 9562    HG2  GLN  73           HG2      GLN  73  10.389  -8.816  10.507
  Start of MODEL   13
 9563    HG3  GLN  73           HG3      GLN  73  11.745  -9.783   9.926
  Start of MODEL   13
 9564   HE21  GLN  73          HE21      GLN  73  12.006 -10.830  11.884
  Start of MODEL   13
 9565   HE22  GLN  73          HE22      GLN  73  12.644 -10.044  13.282
  Start of MODEL   13
 9566    H    LYS  74           H        LYS  74  12.570  -7.856   5.712
  Start of MODEL   13
 9567    HA   LYS  74           HA       LYS  74  13.805  -5.226   5.875
  Start of MODEL   13
 9568    HB2  LYS  74           HB2      LYS  74  13.694  -7.042   3.466
  Start of MODEL   13
 9569    HB3  LYS  74           HB3      LYS  74  14.844  -5.751   3.788
  Start of MODEL   13
 9570    HG2  LYS  74           HG2      LYS  74  14.640  -8.309   5.363
  Start of MODEL   13
 9571    HG3  LYS  74           HG3      LYS  74  15.789  -8.011   4.061
  Start of MODEL   13
 9572    HD2  LYS  74           HD2      LYS  74  16.849  -6.252   5.331
  Start of MODEL   13
 9573    HD3  LYS  74           HD3      LYS  74  15.612  -6.365   6.586
  Start of MODEL   13
 9574    HE2  LYS  74           HE2      LYS  74  16.331  -8.595   7.150
  Start of MODEL   13
 9575    HE3  LYS  74           HE3      LYS  74  17.492  -8.595   5.826
  Start of MODEL   13
 9576    HZ2  LYS  74           HZ1      LYS  74  18.442  -8.150   8.069
  Start of MODEL   13
 9577    HZ1  LYS  74           HZ2      LYS  74  17.604  -6.675   8.092
  Start of MODEL   13
 9578    HZ3  LYS  74           HZ3      LYS  74  18.788  -6.960   6.919
  Start of MODEL   13
 9579    H    SER  75           H        SER  75  12.875  -3.393   5.082
  Start of MODEL   13
 9580    HA   SER  75           HA       SER  75  10.288  -3.256   4.114
  Start of MODEL   13
 9581    HB2  SER  75           HB2      SER  75  12.507  -1.280   3.515
  Start of MODEL   13
 9582    HB3  SER  75           HB3      SER  75  10.775  -0.948   3.590
  Start of MODEL   13
 9583    HG   SER  75           HG       SER  75  11.617  -0.329   5.538
  Start of MODEL   13
 9584    H    ARG  76           H        ARG  76   9.368  -3.486   2.171
  Start of MODEL   13
 9585    HA   ARG  76           HA       ARG  76  11.123  -4.470   0.029
  Start of MODEL   13
 9586    HB2  ARG  76           HB2      ARG  76   8.132  -4.747   0.316
  Start of MODEL   13
 9587    HB3  ARG  76           HB3      ARG  76   9.140  -5.533  -0.893
  Start of MODEL   13
 9588    HG2  ARG  76           HG2      ARG  76  10.381  -6.512   1.169
  Start of MODEL   13
 9589    HG3  ARG  76           HG3      ARG  76   8.889  -6.101   2.019
  Start of MODEL   13
 9590    HD2  ARG  76           HD2      ARG  76   8.848  -8.405   1.199
  Start of MODEL   13
 9591    HD3  ARG  76           HD3      ARG  76   7.607  -7.418   0.426
  Start of MODEL   13
 9592    HE   ARG  76           HE       ARG  76   9.378  -7.188  -1.423
  Start of MODEL   13
 9593   HH11  ARG  76          HH11      ARG  76   8.871 -10.058   0.512
  Start of MODEL   13
 9594   HH12  ARG  76          HH12      ARG  76   9.459 -11.141  -0.714
  Start of MODEL   13
 9595   HH21  ARG  76          HH21      ARG  76  10.187  -8.581  -3.003
  Start of MODEL   13
 9596   HH22  ARG  76          HH22      ARG  76  10.283 -10.292  -2.691
  Start of MODEL   13
 9597    H    GLY  77           H        GLY  77  10.317  -1.624   0.742
  Start of MODEL   13
 9598    HA2  GLY  77           HA2      GLY  77  10.102   0.327  -0.461
  Start of MODEL   13
 9599    HA3  GLY  77           HA3      GLY  77  10.246  -0.647  -1.911
  Start of MODEL   13
 9600    H    TYR  78           H        TYR  78   7.624  -1.547   0.126
  Start of MODEL   13
 9601    HA   TYR  78           HA       TYR  78   5.810   0.411  -0.952
  Start of MODEL   13
 9602    HB2  TYR  78           HB2      TYR  78   4.253  -1.291  -1.911
  Start of MODEL   13
 9603    HB3  TYR  78           HB3      TYR  78   5.749  -1.095  -2.808
  Start of MODEL   13
 9604    HD1  TYR  78           HD1      TYR  78   3.864  -3.316  -0.573
  Start of MODEL   13
 9605    HD2  TYR  78           HD2      TYR  78   7.299  -2.925  -3.045
  Start of MODEL   13
 9606    HE1  TYR  78           HE1      TYR  78   4.235  -5.741  -0.419
  Start of MODEL   13
 9607    HE2  TYR  78           HE2      TYR  78   7.681  -5.349  -2.906
  Start of MODEL   13
 9608    HH   TYR  78           HH       TYR  78   7.112  -7.211  -1.307
  Start of MODEL   13
 9609    H    GLY  79           H        GLY  79   3.484  -0.075  -0.145
  Start of MODEL   13
 9610    HA2  GLY  79           HA2      GLY  79   3.406  -1.547   2.341
  Start of MODEL   13
 9611    HA3  GLY  79           HA3      GLY  79   3.426   0.196   2.548
  Start of MODEL   13
 9612    H    PHE  80           H        PHE  80   1.358  -0.531   3.632
  Start of MODEL   13
 9613    HA   PHE  80           HA       PHE  80  -0.827  -0.310   1.694
  Start of MODEL   13
 9614    HB2  PHE  80           HB2      PHE  80  -0.569  -2.357   3.875
  Start of MODEL   13
 9615    HB3  PHE  80           HB3      PHE  80  -2.149  -1.848   3.291
  Start of MODEL   13
 9616    HD1  PHE  80           HD1      PHE  80   0.704  -3.910   2.724
  Start of MODEL   13
 9617    HD2  PHE  80           HD2      PHE  80  -2.682  -2.165   0.843
  Start of MODEL   13
 9618    HE1  PHE  80           HE1      PHE  80   0.909  -5.521   0.883
  Start of MODEL   13
 9619    HE2  PHE  80           HE2      PHE  80  -2.492  -3.768  -1.010
  Start of MODEL   13
 9620    HZ   PHE  80           HZ       PHE  80  -0.783  -5.454  -0.998
  Start of MODEL   13
 9621    H    VAL  81           H        VAL  81  -2.539   0.803   2.282
  Start of MODEL   13
 9622    HA   VAL  81           HA       VAL  81  -2.744   1.761   5.061
  Start of MODEL   13
 9623    HB   VAL  81           HB       VAL  81  -3.205   3.483   2.617
  Start of MODEL   13
 9624    H    THR  82           H        THR  82  -4.642   1.335   5.933
  Start of MODEL   13
 9625    HA   THR  82           HA       THR  82  -6.879   0.647   4.168
  Start of MODEL   13
 9626    HB   THR  82           HB       THR  82  -6.617   0.040   7.125
  Start of MODEL   13
 9627    HG1  THR  82           HG1      THR  82  -6.193  -1.744   4.939
  Start of MODEL   13
 9628   HG23  THR  82          HG21      THR  82  -8.915   0.076   6.237
  Start of MODEL   13
 9629   HG22  THR  82          HG22      THR  82  -8.427  -1.554   6.697
  Start of MODEL   13
 9630   HG21  THR  82          HG23      THR  82  -8.451  -1.087   4.997
  Start of MODEL   13
 9631    H    MET  83           H        MET  83  -8.118   2.388   3.850
  Start of MODEL   13
 9632    HA   MET  83           HA       MET  83  -8.197   4.511   5.800
  Start of MODEL   13
 9633    HB2  MET  83           HB2      MET  83  -9.649   4.225   3.163
  Start of MODEL   13
 9634    HB3  MET  83           HB3      MET  83  -9.584   5.683   4.144
  Start of MODEL   13
 9635    HG2  MET  83           HG2      MET  83  -7.206   4.333   2.891
  Start of MODEL   13
 9636    HG3  MET  83           HG3      MET  83  -8.049   5.731   2.231
  Start of MODEL   13
 9637    HE3  MET  83           HE1      MET  83  -7.946   8.176   3.287
  Start of MODEL   13
 9638    HE2  MET  83           HE2      MET  83  -7.302   8.484   4.902
  Start of MODEL   13
 9639    HE1  MET  83           HE3      MET  83  -8.725   7.466   4.702
  Start of MODEL   13
 9640    H    LYS  84           H        LYS  84 -10.019   5.281   6.791
  Start of MODEL   13
 9641    HA   LYS  84           HA       LYS  84 -11.777   3.240   7.756
  Start of MODEL   13
 9642    HB2  LYS  84           HB2      LYS  84 -10.785   5.163   9.074
  Start of MODEL   13
 9643    HB3  LYS  84           HB3      LYS  84 -11.963   6.201   8.286
  Start of MODEL   13
 9644    HG2  LYS  84           HG2      LYS  84 -13.773   5.089   9.330
  Start of MODEL   13
 9645    HG3  LYS  84           HG3      LYS  84 -12.725   3.784   9.897
  Start of MODEL   13
 9646    HD2  LYS  84           HD2      LYS  84 -12.405   6.662  10.728
  Start of MODEL   13
 9647    HD3  LYS  84           HD3      LYS  84 -13.350   5.485  11.642
  Start of MODEL   13
 9648    HE2  LYS  84           HE2      LYS  84 -11.374   4.116  11.965
  Start of MODEL   13
 9649    HE3  LYS  84           HE3      LYS  84 -10.418   5.207  10.961
  Start of MODEL   13
 9650    HZ2  LYS  84           HZ1      LYS  84 -10.052   5.638  13.300
  Start of MODEL   13
 9651    HZ1  LYS  84           HZ2      LYS  84 -11.706   5.891  13.552
  Start of MODEL   13
 9652    HZ3  LYS  84           HZ3      LYS  84 -10.819   6.966  12.589
  Start of MODEL   13
 9653    H    ASP  85           H        ASP  85 -11.932   5.440   5.163
  Start of MODEL   13
 9654    HA   ASP  85           HA       ASP  85 -14.678   4.676   4.622
  Start of MODEL   13
 9655    HB2  ASP  85           HB2      ASP  85 -15.071   6.760   5.750
  Start of MODEL   13
 9656    HB3  ASP  85           HB3      ASP  85 -13.800   7.565   4.833
  Start of MODEL   13
 9657    H    ARG  86           H        ARG  86 -15.252   4.815   2.430
  Start of MODEL   13
 9658    HA   ARG  86           HA       ARG  86 -13.142   4.195   0.679
  Start of MODEL   13
 9659    HB2  ARG  86           HB2      ARG  86 -15.317   3.273   0.235
  Start of MODEL   13
 9660    HB3  ARG  86           HB3      ARG  86 -16.028   4.878   0.097
  Start of MODEL   13
 9661    HG2  ARG  86           HG2      ARG  86 -14.394   5.233  -1.842
  Start of MODEL   13
 9662    HG3  ARG  86           HG3      ARG  86 -14.171   3.485  -1.800
  Start of MODEL   13
 9663    HD2  ARG  86           HD2      ARG  86 -16.419   3.080  -2.360
  Start of MODEL   13
 9664    HD3  ARG  86           HD3      ARG  86 -16.892   4.742  -1.997
  Start of MODEL   13
 9665    HE   ARG  86           HE       ARG  86 -14.955   4.703  -4.067
  Start of MODEL   13
 9666   HH11  ARG  86          HH11      ARG  86 -18.341   3.984  -3.494
  Start of MODEL   13
 9667   HH12  ARG  86          HH12      ARG  86 -18.810   4.339  -5.127
  Start of MODEL   13
 9668   HH21  ARG  86          HH21      ARG  86 -15.568   5.204  -6.167
  Start of MODEL   13
 9669   HH22  ARG  86          HH22      ARG  86 -17.238   5.046  -6.649
  Start of MODEL   13
 9670    H    ALA  87           H        ALA  87 -14.978   7.205   1.157
  Start of MODEL   13
 9671    HA   ALA  87           HA       ALA  87 -14.208   8.418  -1.265
  Start of MODEL   13
 9672    HB1  ALA  87           HB1      ALA  87 -15.052   9.691   1.339
  Start of MODEL   13
 9673    HB3  ALA  87           HB2      ALA  87 -16.108   9.226   0.005
  Start of MODEL   13
 9674    HB2  ALA  87           HB3      ALA  87 -14.933  10.524  -0.209
  Start of MODEL   13
 9675    H    SER  88           H        SER  88 -12.828   8.550   1.990
  Start of MODEL   13
 9676    HA   SER  88           HA       SER  88 -10.802  10.418   1.395
  Start of MODEL   13
 9677    HB2  SER  88           HB2      SER  88 -10.836   8.248   3.507
  Start of MODEL   13
 9678    HB3  SER  88           HB3      SER  88  -9.741   9.631   3.475
  Start of MODEL   13
 9679    HG   SER  88           HG       SER  88 -11.429  10.993   3.862
  Start of MODEL   13
 9680    H    ALA  89           H        ALA  89 -10.910   6.885   1.317
  Start of MODEL   13
 9681    HA   ALA  89           HA       ALA  89  -8.220   6.430   0.628
  Start of MODEL   13
 9682    HB1  ALA  89           HB1      ALA  89 -10.644   4.780  -0.078
  Start of MODEL   13
 9683    HB3  ALA  89           HB2      ALA  89  -9.709   4.654   1.413
  Start of MODEL   13
 9684    HB2  ALA  89           HB3      ALA  89  -8.968   4.234  -0.132
  Start of MODEL   13
 9685    H    GLU  90           H        GLU  90 -11.097   6.926  -1.342
  Start of MODEL   13
 9686    HA   GLU  90           HA       GLU  90  -9.803   6.356  -3.793
  Start of MODEL   13
 9687    HB2  GLU  90           HB2      GLU  90 -12.288   6.204  -3.294
  Start of MODEL   13
 9688    HB3  GLU  90           HB3      GLU  90 -12.335   7.952  -3.504
  Start of MODEL   13
 9689    HG2  GLU  90           HG2      GLU  90 -11.560   7.758  -5.761
  Start of MODEL   13
 9690    HG3  GLU  90           HG3      GLU  90 -11.302   6.024  -5.567
  Start of MODEL   13
 9691    H    ARG  91           H        ARG  91 -10.455   9.376  -2.037
  Start of MODEL   13
 9692    HA   ARG  91           HA       ARG  91  -9.614  11.134  -4.057
  Start of MODEL   13
 9693    HB2  ARG  91           HB2      ARG  91  -9.257  11.421  -1.067
  Start of MODEL   13
 9694    HB3  ARG  91           HB3      ARG  91  -9.056  12.717  -2.235
  Start of MODEL   13
 9695    HG2  ARG  91           HG2      ARG  91 -11.571  11.301  -1.432
  Start of MODEL   13
 9696    HG3  ARG  91           HG3      ARG  91 -11.175  13.010  -1.261
  Start of MODEL   13
 9697    HD2  ARG  91           HD2      ARG  91 -11.093  13.135  -3.779
  Start of MODEL   13
 9698    HD3  ARG  91           HD3      ARG  91 -11.767  11.504  -3.806
  Start of MODEL   13
 9699    HE   ARG  91           HE       ARG  91 -13.185  13.657  -2.391
  Start of MODEL   13
 9700   HH11  ARG  91          HH11      ARG  91 -13.097  11.269  -4.970
  Start of MODEL   13
 9701   HH12  ARG  91          HH12      ARG  91 -14.773  11.483  -5.364
  Start of MODEL   13
 9702   HH21  ARG  91          HH21      ARG  91 -15.357  13.943  -2.959
  Start of MODEL   13
 9703   HH22  ARG  91          HH22      ARG  91 -16.041  13.027  -4.271
  Start of MODEL   13
 9704    H    ALA  92           H        ALA  92  -7.832   9.365  -1.587
  Start of MODEL   13
 9705    HA   ALA  92           HA       ALA  92  -5.266  10.310  -2.204
  Start of MODEL   13
 9706    HB1  ALA  92           HB1      ALA  92  -5.834   9.036  -0.165
  Start of MODEL   13
 9707    HB3  ALA  92           HB2      ALA  92  -4.436   8.379  -1.014
  Start of MODEL   13
 9708    HB2  ALA  92           HB3      ALA  92  -6.003   7.582  -1.149
  Start of MODEL   13
 9709    H    CYS  93           H        CYS  93  -7.240   7.781  -3.685
  Start of MODEL   13
 9710    HA   CYS  93           HA       CYS  93  -5.063   6.793  -5.287
  Start of MODEL   13
 9711    HB2  CYS  93           HB2      CYS  93  -8.029   6.214  -5.409
  Start of MODEL   13
 9712    HB3  CYS  93           HB3      CYS  93  -6.785   5.343  -6.298
  Start of MODEL   13
 9713    HG   CYS  93           HG       CYS  93  -6.979   5.451  -2.881
  Start of MODEL   13
 9714    H    LYS  94           H        LYS  94  -7.174   9.434  -5.510
  Start of MODEL   13
 9715    HA   LYS  94           HA       LYS  94  -7.563   9.587  -8.302
  Start of MODEL   13
 9716    HB2  LYS  94           HB2      LYS  94  -8.669  10.951  -6.393
  Start of MODEL   13
 9717    HB3  LYS  94           HB3      LYS  94  -7.253  11.979  -6.479
  Start of MODEL   13
 9718    HG2  LYS  94           HG2      LYS  94  -9.121  11.448  -8.783
  Start of MODEL   13
 9719    HG3  LYS  94           HG3      LYS  94  -9.227  12.843  -7.713
  Start of MODEL   13
 9720    HD2  LYS  94           HD2      LYS  94  -6.911  12.143  -9.519
  Start of MODEL   13
 9721    HD3  LYS  94           HD3      LYS  94  -8.102  13.413  -9.795
  Start of MODEL   13
 9722    HE2  LYS  94           HE2      LYS  94  -7.335  14.597  -7.819
  Start of MODEL   13
 9723    HE3  LYS  94           HE3      LYS  94  -6.196  13.298  -7.457
  Start of MODEL   13
 9724    HZ1  LYS  94           HZ1      LYS  94  -6.137  15.039  -9.872
  Start of MODEL   13
 9725    HZ3  LYS  94           HZ2      LYS  94  -5.053  13.779  -9.546
  Start of MODEL   13
 9726    HZ2  LYS  94           HZ3      LYS  94  -5.084  15.147  -8.546
  Start of MODEL   13
 9727    H    ASP  95           H        ASP  95  -5.006  10.670  -6.145
  Start of MODEL   13
 9728    HA   ASP  95           HA       ASP  95  -3.448  11.631  -8.441
  Start of MODEL   13
 9729    HB2  ASP  95           HB2      ASP  95  -3.803  13.086  -6.382
  Start of MODEL   13
 9730    HB3  ASP  95           HB3      ASP  95  -2.796  11.946  -5.502
  Start of MODEL   13
 9731    HA   PRO  96           HA       PRO  96  -1.944   7.411  -7.865
  Start of MODEL   13
 9732    HB2  PRO  96           HB2      PRO  96  -0.850   7.116 -10.317
  Start of MODEL   13
 9733    HB3  PRO  96           HB3      PRO  96  -2.591   7.017 -10.028
  Start of MODEL   13
 9734    HG2  PRO  96           HG2      PRO  96  -0.973   9.318 -11.058
  Start of MODEL   13
 9735    HG3  PRO  96           HG3      PRO  96  -2.530   8.696 -11.639
  Start of MODEL   13
 9736    HD2  PRO  96           HD2      PRO  96  -2.339  10.868 -10.032
  Start of MODEL   13
 9737    HD3  PRO  96           HD3      PRO  96  -3.721   9.754  -9.977
  Start of MODEL   13
 9738    H    ASN  97           H        ASN  97  -0.116  10.266  -8.322
  Start of MODEL   13
 9739    HA   ASN  97           HA       ASN  97   2.337   8.762  -7.721
  Start of MODEL   13
 9740    HB2  ASN  97           HB2      ASN  97   2.005  10.918  -9.793
  Start of MODEL   13
 9741    HB3  ASN  97           HB3      ASN  97   3.576  10.497  -9.120
  Start of MODEL   13
 9742   HD21  ASN  97          HD21      ASN  97   2.984   7.683  -8.861
  Start of MODEL   13
 9743   HD22  ASN  97          HD22      ASN  97   3.012   7.029 -10.460
  Start of MODEL   13
 9744    HA   PRO  98           HA       PRO  98   1.906  12.264  -4.694
  Start of MODEL   13
 9745    HB2  PRO  98           HB2      PRO  98   2.086  10.160  -2.674
  Start of MODEL   13
 9746    HB3  PRO  98           HB3      PRO  98   0.856  11.411  -2.869
  Start of MODEL   13
 9747    HG2  PRO  98           HG2      PRO  98   0.348   8.806  -3.333
  Start of MODEL   13
 9748    HG3  PRO  98           HG3      PRO  98  -0.439  10.105  -4.247
  Start of MODEL   13
 9749    HD2  PRO  98           HD2      PRO  98   1.892   8.387  -5.024
  Start of MODEL   13
 9750    HD3  PRO  98           HD3      PRO  98   0.478   8.868  -5.987
  Start of MODEL   13
 9751    H    ILE  99           H        ILE  99   3.715  13.193  -3.921
  Start of MODEL   13
 9752    HA   ILE  99           HA       ILE  99   6.200  11.728  -4.017
  Start of MODEL   13
 9753    HB   ILE  99           HB       ILE  99   5.660  14.600  -3.247
  Start of MODEL   13
 9754   HD12  ILE  99          HD11      ILE  99   6.814  13.377  -7.171
  Start of MODEL   13
 9755   HD11  ILE  99          HD12      ILE  99   6.446  12.139  -5.970
  Start of MODEL   13
 9756   HD13  ILE  99          HD13      ILE  99   7.939  13.069  -5.846
  Start of MODEL   13
 9757    H    ILE 100           H        ILE 100   6.724  10.455  -2.397
  Start of MODEL   13
 9758    HA   ILE 100           HA       ILE 100   6.208  11.367   0.362
  Start of MODEL   13
 9759    HB   ILE 100           HB       ILE 100   6.207   8.513  -0.647
  Start of MODEL   13
 9760   HD11  ILE 100          HD11      ILE 100   3.597   7.867   0.930
  Start of MODEL   13
 9761   HD13  ILE 100          HD12      ILE 100   3.841   7.449  -0.768
  Start of MODEL   13
 9762   HD12  ILE 100          HD13      ILE 100   2.460   8.437  -0.292
  Start of MODEL   13
 9763    H    ASP 101           H        ASP 101   7.963  11.720   1.470
  Start of MODEL   13
 9764    HA   ASP 101           HA       ASP 101  10.129  11.822   2.148
  Start of MODEL   13
 9765    HB2  ASP 101           HB2      ASP 101  10.061   8.976   1.154
  Start of MODEL   13
 9766    HB3  ASP 101           HB3      ASP 101  11.512   9.682   1.850
  Start of MODEL   13
 9767    H    GLY 102           H        GLY 102   9.440  12.828  -0.407
  Start of MODEL   13
 9768    HA2  GLY 102           HA2      GLY 102  10.522  13.808  -2.182
  Start of MODEL   13
 9769    HA3  GLY 102           HA3      GLY 102  12.028  13.175  -1.540
  Start of MODEL   13
 9770    H    ARG 103           H        ARG 103   9.662  10.773  -2.068
  Start of MODEL   13
 9771    HA   ARG 103           HA       ARG 103  10.861  10.102  -4.678
  Start of MODEL   13
 9772    HB2  ARG 103           HB2      ARG 103  11.549   8.546  -2.935
  Start of MODEL   13
 9773    HB3  ARG 103           HB3      ARG 103   9.873   8.278  -2.479
  Start of MODEL   13
 9774    HG2  ARG 103           HG2      ARG 103  10.614   6.406  -3.751
  Start of MODEL   13
 9775    HG3  ARG 103           HG3      ARG 103   9.480   7.324  -4.744
  Start of MODEL   13
 9776    HD2  ARG 103           HD2      ARG 103  11.334   8.346  -5.944
  Start of MODEL   13
 9777    HD3  ARG 103           HD3      ARG 103  12.488   7.487  -4.923
  Start of MODEL   13
 9778    HE   ARG 103           HE       ARG 103  10.710   5.676  -6.206
  Start of MODEL   13
 9779   HH11  ARG 103          HH11      ARG 103  13.492   7.714  -6.803
  Start of MODEL   13
 9780   HH12  ARG 103          HH12      ARG 103  14.121   6.713  -8.071
  Start of MODEL   13
 9781   HH21  ARG 103          HH21      ARG 103  11.547   4.342  -7.888
  Start of MODEL   13
 9782   HH22  ARG 103          HH22      ARG 103  13.021   4.790  -8.695
  Start of MODEL   13
 9783    H    LYS 104           H        LYS 104   9.500   9.460  -6.311
  Start of MODEL   13
 9784    HA   LYS 104           HA       LYS 104   6.717  10.115  -6.070
  Start of MODEL   13
 9785    HB2  LYS 104           HB2      LYS 104   7.879  10.592  -8.151
  Start of MODEL   13
 9786    HB3  LYS 104           HB3      LYS 104   8.321   8.902  -8.330
  Start of MODEL   13
 9787    HG2  LYS 104           HG2      LYS 104   5.910   8.345  -8.521
  Start of MODEL   13
 9788    HG3  LYS 104           HG3      LYS 104   5.552  10.073  -8.504
  Start of MODEL   13
 9789    HD2  LYS 104           HD2      LYS 104   7.348   8.709 -10.506
  Start of MODEL   13
 9790    HD3  LYS 104           HD3      LYS 104   5.653   9.105 -10.788
  Start of MODEL   13
 9791    HE2  LYS 104           HE2      LYS 104   6.086  11.434 -10.637
  Start of MODEL   13
 9792    HE3  LYS 104           HE3      LYS 104   7.718  11.155 -10.031
  Start of MODEL   13
 9793    HZ1  LYS 104           HZ1      LYS 104   6.773  10.375 -12.740
  Start of MODEL   13
 9794    HZ3  LYS 104           HZ2      LYS 104   8.359  10.261 -12.143
  Start of MODEL   13
 9795    HZ2  LYS 104           HZ3      LYS 104   7.659  11.782 -12.392
  Start of MODEL   13
 9796    H    ALA 105           H        ALA 105   5.227   8.767  -5.294
  Start of MODEL   13
 9797    HA   ALA 105           HA       ALA 105   5.735   5.878  -5.446
  Start of MODEL   13
 9798    HB3  ALA 105           HB1      ALA 105   5.380   6.795  -3.203
  Start of MODEL   13
 9799    HB2  ALA 105           HB2      ALA 105   4.105   5.663  -3.653
  Start of MODEL   13
 9800    HB1  ALA 105           HB3      ALA 105   3.800   7.398  -3.703
  Start of MODEL   13
 9801    H    ASN 106           H        ASN 106   3.942   4.488  -5.911
  Start of MODEL   13
 9802    HA   ASN 106           HA       ASN 106   1.958   5.704  -7.727
  Start of MODEL   13
 9803    HB2  ASN 106           HB2      ASN 106   3.277   2.981  -7.767
  Start of MODEL   13
 9804    HB3  ASN 106           HB3      ASN 106   1.822   3.337  -8.691
  Start of MODEL   13
 9805   HD21  ASN 106          HD21      ASN 106   2.935   2.892 -10.604
  Start of MODEL   13
 9806   HD22  ASN 106          HD22      ASN 106   4.036   4.036 -11.285
  Start of MODEL   13
 9807    H    VAL 107           H        VAL 107  -0.014   5.786  -6.805
  Start of MODEL   13
 9808    HA   VAL 107           HA       VAL 107  -0.661   3.744  -4.786
  Start of MODEL   13
 9809    HB   VAL 107           HB       VAL 107  -1.721   6.561  -5.023
  Start of MODEL   13
 9810    H    ASN 108           H        ASN 108  -2.330   2.460  -5.086
  Start of MODEL   13
 9811    HA   ASN 108           HA       ASN 108  -4.696   3.401  -6.478
  Start of MODEL   13
 9812    HB2  ASN 108           HB2      ASN 108  -4.843   1.359  -7.878
  Start of MODEL   13
 9813    HB3  ASN 108           HB3      ASN 108  -3.446   2.345  -8.297
  Start of MODEL   13
 9814   HD21  ASN 108          HD21      ASN 108  -4.539  -0.639  -6.902
  Start of MODEL   13
 9815   HD22  ASN 108          HD22      ASN 108  -2.998  -1.419  -6.871
  Start of MODEL   13
 9816    H    LEU 109           H        LEU 109  -6.600   2.263  -5.824
  Start of MODEL   13
 9817    HA   LEU 109           HA       LEU 109  -6.673   0.995  -3.367
  Start of MODEL   13
 9818    HB2  LEU 109           HB2      LEU 109  -8.524   0.688  -5.732
  Start of MODEL   13
 9819    HB3  LEU 109           HB3      LEU 109  -8.849  -0.020  -4.163
  Start of MODEL   13
 9820    HG   LEU 109           HG       LEU 109  -8.537   2.936  -4.679
  Start of MODEL   13
 9821   HD11  LEU 109          HD11      LEU 109 -11.022   1.298  -4.211
  Start of MODEL   13
 9822   HD13  LEU 109          HD12      LEU 109 -10.544   2.033  -5.738
  Start of MODEL   13
 9823   HD12  LEU 109          HD13      LEU 109 -10.948   3.053  -4.359
  Start of MODEL   13
 9824   HD21  LEU 109          HD21      LEU 109  -7.902   2.297  -2.425
  Start of MODEL   13
 9825   HD23  LEU 109          HD22      LEU 109  -9.407   1.399  -2.234
  Start of MODEL   13
 9826   HD22  LEU 109          HD23      LEU 109  -9.443   3.155  -2.405
  Start of MODEL   13
 9827    H    ALA 110           H        ALA 110  -6.352  -1.054  -2.662
  Start of MODEL   13
 9828    HA   ALA 110           HA       ALA 110  -4.365  -2.448  -4.020
  Start of MODEL   13
 9829    HB2  ALA 110           HB1      ALA 110  -6.077  -3.496  -1.776
  Start of MODEL   13
 9830    HB1  ALA 110           HB2      ALA 110  -4.683  -2.430  -1.578
  Start of MODEL   13
 9831    HB3  ALA 110           HB3      ALA 110  -4.468  -4.054  -2.236
  Start of MODEL   13
 9832    H    TYR 111           H        TYR 111  -7.855  -3.061  -3.976
  Start of MODEL   13
 9833    HA   TYR 111           HA       TYR 111  -7.593  -5.706  -5.010
  Start of MODEL   13
 9834    HB2  TYR 111           HB2      TYR 111  -9.951  -5.785  -5.113
  Start of MODEL   13
 9835    HB3  TYR 111           HB3      TYR 111  -9.570  -4.819  -3.695
  Start of MODEL   13
 9836    HD1  TYR 111           HD1      TYR 111  -9.512  -2.195  -4.148
  Start of MODEL   13
 9837    HD2  TYR 111           HD2      TYR 111 -11.578  -5.029  -6.553
  Start of MODEL   13
 9838    HE1  TYR 111           HE1      TYR 111 -10.981  -0.409  -4.975
  Start of MODEL   13
 9839    HE2  TYR 111           HE2      TYR 111 -13.056  -3.250  -7.390
  Start of MODEL   13
 9840    HH   TYR 111           HH       TYR 111 -12.420   0.083  -6.867
  Start of MODEL   13
 9841    H    LEU 112           H        LEU 112  -7.345  -2.647  -6.450
  Start of MODEL   13
 9842    HA   LEU 112           HA       LEU 112  -8.248  -3.354  -9.063
  Start of MODEL   13
 9843    HB2  LEU 112           HB2      LEU 112  -6.384  -1.148  -8.183
  Start of MODEL   13
 9844    HB3  LEU 112           HB3      LEU 112  -7.107  -1.284  -9.775
  Start of MODEL   13
 9845    HG   LEU 112           HG       LEU 112  -8.571  -0.809  -7.177
  Start of MODEL   13
 9846   HD13  LEU 112          HD11      LEU 112  -7.409   1.159  -7.971
  Start of MODEL   13
 9847   HD12  LEU 112          HD12      LEU 112  -9.145   1.347  -8.222
  Start of MODEL   13
 9848   HD11  LEU 112          HD13      LEU 112  -8.096   0.946  -9.581
  Start of MODEL   13
 9849   HD22  LEU 112          HD21      LEU 112 -10.579  -0.665  -8.518
  Start of MODEL   13
 9850   HD21  LEU 112          HD22      LEU 112  -9.833  -2.252  -8.710
  Start of MODEL   13
 9851   HD23  LEU 112          HD23      LEU 112  -9.661  -1.035  -9.976
  Start of MODEL   13
 9852    H    GLY 113           H        GLY 113  -5.514  -4.233  -7.299
  Start of MODEL   13
 9853    HA2  GLY 113           HA2      GLY 113  -4.239  -5.245  -9.720
  Start of MODEL   13
 9854    HA3  GLY 113           HA3      GLY 113  -3.283  -4.181  -8.698
  Start of MODEL   13
 9855    H    ALA 114           H        ALA 114  -5.536  -6.077  -7.007
  Start of MODEL   13
 9856    HA   ALA 114           HA       ALA 114  -3.434  -7.471  -5.634
  Start of MODEL   13
 9857    HB1  ALA 114           HB1      ALA 114  -6.426  -7.808  -5.394
  Start of MODEL   13
 9858    HB3  ALA 114           HB2      ALA 114  -5.448  -6.662  -4.477
  Start of MODEL   13
 9859    HB2  ALA 114           HB3      ALA 114  -5.206  -8.394  -4.263
  Start of MODEL   13
 9860    H    LYS 115           H        LYS 115  -2.658  -9.411  -6.064
  Start of MODEL   13
 9861    HA   LYS 115           HA       LYS 115  -3.631 -10.795  -8.400
  Start of MODEL   13
 9862    HB2  LYS 115           HB2      LYS 115  -1.271 -11.472  -6.638
  Start of MODEL   13
 9863    HB3  LYS 115           HB3      LYS 115  -1.626 -12.123  -8.241
  Start of MODEL   13
 9864    HG2  LYS 115           HG2      LYS 115  -1.375  -9.899  -9.207
  Start of MODEL   13
 9865    HG3  LYS 115           HG3      LYS 115  -1.030  -9.238  -7.611
  Start of MODEL   13
 9866    HD2  LYS 115           HD2      LYS 115   0.966 -10.700  -7.486
  Start of MODEL   13
 9867    HD3  LYS 115           HD3      LYS 115   0.628 -11.251  -9.131
  Start of MODEL   13
 9868    HE2  LYS 115           HE2      LYS 115   0.790  -8.908  -9.904
  Start of MODEL   13
 9869    HE3  LYS 115           HE3      LYS 115   1.224  -8.421  -8.268
  Start of MODEL   13
 9870    HZ3  LYS 115           HZ1      LYS 115   3.191  -8.638  -9.573
  Start of MODEL   13
 9871    HZ2  LYS 115           HZ2      LYS 115   2.776 -10.201 -10.068
  Start of MODEL   13
 9872    HZ1  LYS 115           HZ3      LYS 115   3.177  -9.901  -8.444
  Start of MODEL   13
 9873    HA   PRO 116           HA       PRO 116  -6.071 -13.743  -6.431
  Start of MODEL   13
 9874    HB2  PRO 116           HB2      PRO 116  -6.030 -15.742  -8.210
  Start of MODEL   13
 9875    HB3  PRO 116           HB3      PRO 116  -6.770 -14.182  -8.575
  Start of MODEL   13
 9876    HG2  PRO 116           HG2      PRO 116  -4.094 -15.242  -9.388
  Start of MODEL   13
 9877    HG3  PRO 116           HG3      PRO 116  -5.264 -14.307 -10.336
  Start of MODEL   13
 9878    HD2  PRO 116           HD2      PRO 116  -3.050 -13.224  -9.118
  Start of MODEL   13
 9879    HD3  PRO 116           HD3      PRO 116  -4.509 -12.307  -9.499
  Start of MODEL   13
 9880    H    ARG 117           H        ARG 117  -6.213 -15.850  -5.465
  Start of MODEL   13
 9881    HA   ARG 117           HA       ARG 117  -5.465 -17.521  -4.141
  Start of MODEL   13
 9882    HB2  ARG 117           HB2      ARG 117  -4.644 -18.488  -6.248
  Start of MODEL   13
 9883    HB3  ARG 117           HB3      ARG 117  -3.139 -17.594  -6.081
  Start of MODEL   13
 9884    HG2  ARG 117           HG2      ARG 117  -2.965 -19.986  -5.457
  Start of MODEL   13
 9885    HG3  ARG 117           HG3      ARG 117  -2.509 -18.876  -4.163
  Start of MODEL   13
 9886    HD2  ARG 117           HD2      ARG 117  -4.974 -19.150  -3.399
  Start of MODEL   13
 9887    HD3  ARG 117           HD3      ARG 117  -4.954 -20.594  -4.414
  Start of MODEL   13
 9888    HE   ARG 117           HE       ARG 117  -2.705 -20.787  -2.844
  Start of MODEL   13
 9889   HH11  ARG 117          HH11      ARG 117  -6.168 -20.638  -2.278
  Start of MODEL   13
 9890   HH12  ARG 117          HH12      ARG 117  -6.058 -21.376  -0.712
  Start of MODEL   13
 9891   HH21  ARG 117          HH21      ARG 117  -2.571 -21.775  -0.819
  Start of MODEL   13
 9892   HH22  ARG 117          HH22      ARG 117  -4.011 -22.033   0.117
  Start of MODEL   13
 9893    H    THR 118           H        THR 118  -4.940 -14.843  -3.475
  Start of MODEL   13
 9894    HA   THR 118           HA       THR 118  -2.339 -14.618  -2.293
  Start of MODEL   13
 9895    HB   THR 118           HB       THR 118  -3.630 -12.627  -2.981
  Start of MODEL   13
 9896    HG1  THR 118           HG1      THR 118  -2.066 -12.448  -1.268
  Start of MODEL   13
 9897   HG23  THR 118          HG21      THR 118  -5.871 -13.311  -2.453
  Start of MODEL   13
 9898   HG22  THR 118          HG22      THR 118  -5.500 -11.856  -1.527
  Start of MODEL   13
 9899   HG21  THR 118          HG23      THR 118  -5.477 -13.434  -0.740
  Start of MODEL   13
 9900    H    ASN 119           H        ASN 119  -4.904 -16.508  -1.563
  Start of MODEL   13
 9901    HA   ASN 119           HA       ASN 119  -5.053 -16.293   1.268
  Start of MODEL   13
 9902    HB2  ASN 119           HB2      ASN 119  -6.817 -17.326  -0.187
  Start of MODEL   13
 9903    HB3  ASN 119           HB3      ASN 119  -5.729 -18.679  -0.474
  Start of MODEL   13
 9904   HD21  ASN 119          HD21      ASN 119  -7.830 -17.107   1.760
  Start of MODEL   13
 9905   HD22  ASN 119          HD22      ASN 119  -7.869 -18.377   2.937
  Start of MODEL   13
 9906    H    VAL 120           H        VAL 120  -3.119 -16.466   2.301
  Start of MODEL   13
 9907    HA   VAL 120           HA       VAL 120  -1.272 -18.607   1.549
  Start of MODEL   13
 9908    HB   VAL 120           HB       VAL 120  -0.871 -16.282   3.436
  Start of MODEL   13
 9909    H    GLN 121           H        GLN 121  -2.693 -17.211   4.487
  Start of MODEL   13
 9910    HA   GLN 121           HA       GLN 121  -3.195 -18.036   6.518
  Start of MODEL   13
 9911    HB2  GLN 121           HB2      GLN 121  -3.160 -20.729   5.138
  Start of MODEL   13
 9912    HB3  GLN 121           HB3      GLN 121  -3.798 -20.415   6.746
  Start of MODEL   13
 9913    HG2  GLN 121           HG2      GLN 121  -5.396 -18.792   5.673
  Start of MODEL   13
 9914    HG3  GLN 121           HG3      GLN 121  -4.857 -19.421   4.117
  Start of MODEL   13
 9915   HE21  GLN 121          HE21      GLN 121  -6.621 -20.093   7.038
  Start of MODEL   13
 9916   HE22  GLN 121          HE22      GLN 121  -7.409 -21.527   6.461
  Start of MODEL   13
 9917    H5'   DG   1           H5'       DG   1  11.885  -7.354  -3.765
  Start of MODEL   13
 9918    H4'   DG   1           H4'       DG   1  11.398  -4.755  -4.120
  Start of MODEL   13
 9919    H3'   DG   1           H3'       DG   1  13.326  -6.293  -5.116
  Start of MODEL   13
 9920    H2'   DG   1           H2'       DG   1  14.666  -6.461  -3.105
  Start of MODEL   13
 9921    H1'   DG   1           H1'       DG   1  14.360  -3.452  -2.748
  Start of MODEL   13
 9922    H8    DG   1           H8        DG   1  13.427  -6.468  -0.541
  Start of MODEL   13
 9923    H1    DG   1           H1        DG   1  17.874  -2.512   1.869
  Start of MODEL   13
 9924    H22   DG   1           H21       DG   1  17.677  -0.928  -1.200
  Start of MODEL   13
 9925    H21   DG   1           H22       DG   1  18.419  -0.998   0.382
  Start of MODEL   13
 9926   HO5'   DG   1           H5T       DG   1   9.933  -5.587  -3.097
  Start of MODEL   13
 9927   H5''   DG   1          5H''       DG   1  12.072  -6.760  -2.116
  Start of MODEL   13
 9928   H2''   DG   1          2H''       DG   1  15.484  -5.176  -3.984
  Start of MODEL   13
 9929    H5'   DG   2           H5'       DG   2  13.504  -3.575  -9.450
  Start of MODEL   13
 9930    H4'   DG   2           H4'       DG   2  11.942  -1.992  -9.486
  Start of MODEL   13
 9931    H3'   DG   2           H3'       DG   2  14.071  -1.061 -10.909
  Start of MODEL   13
 9932    H2'   DG   2           H2'       DG   2  14.965   0.407  -9.247
  Start of MODEL   13
 9933    H1'   DG   2           H1'       DG   2  12.092   1.105  -8.455
  Start of MODEL   13
 9934    H8    DG   2           H8        DG   2  15.542   1.936  -7.805
  Start of MODEL   13
 9935    H1    DG   2           H1        DG   2  12.083   1.898  -2.401
  Start of MODEL   13
 9936    H22   DG   2           H21       DG   2   9.779   0.097  -4.274
  Start of MODEL   13
 9937    H21   DG   2           H22       DG   2  10.190   0.808  -2.731
  Start of MODEL   13
 9938   H5''   DG   2          5H''       DG   2  14.834  -2.421  -9.228
  Start of MODEL   13
 9939   H2''   DG   2          2H''       DG   2  13.850   1.503 -10.059
  Start of MODEL   13
 9940    H5'   DT   3           H5'       DT   3  10.482  -3.225 -10.164
  Start of MODEL   13
 9941    H4'   DT   3           H4'       DT   3   8.283  -4.016 -10.072
  Start of MODEL   13
 9942    H3'   DT   3           H3'       DT   3   7.831  -3.464 -12.656
  Start of MODEL   13
 9943    H2'   DT   3           H2'       DT   3   7.823  -1.046 -12.389
  Start of MODEL   13
 9944    H1'   DT   3           H1'       DT   3   6.038  -1.546  -9.946
  Start of MODEL   13
 9945    H3    DT   3           H3        DT   3   5.808   3.093 -10.798
  Start of MODEL   13
 9946    H71   DT   3           H71       DT   3   9.194   3.419  -7.734
  Start of MODEL   13
 9947    H73   DT   3           H72       DT   3  10.377   2.594  -8.772
  Start of MODEL   13
 9948    H72   DT   3           H73       DT   3   9.660   1.733  -7.386
  Start of MODEL   13
 9949    H6    DT   3           H6        DT   3   8.871  -0.044  -8.928
  Start of MODEL   13
 9950   H5''   DT   3          5H''       DT   3  10.034  -3.605 -11.841
  Start of MODEL   13
 9951   H2''   DT   3          2H''       DT   3   6.108  -1.444 -12.395
  Start of MODEL   13
 9952    H5'   DG   4           H5'       DG   4   7.311  -5.621  -9.283
  Start of MODEL   13
 9953    H4'   DG   4           H4'       DG   4   6.303  -5.164  -7.140
  Start of MODEL   13
 9954    H3'   DG   4           H3'       DG   4   3.853  -6.293  -8.248
  Start of MODEL   13
 9955    H2'   DG   4           H2'       DG   4   2.733  -4.253  -8.413
  Start of MODEL   13
 9956    H1'   DG   4           H1'       DG   4   4.935  -2.920  -6.765
  Start of MODEL   13
 9957    H8    DG   4           H8        DG   4   4.577  -0.456  -6.907
  Start of MODEL   13
 9958    H1    DG   4           H1        DG   4   1.802  -0.831 -12.678
  Start of MODEL   13
 9959    H22   DG   4           H21       DG   4   2.367  -4.236 -12.401
  Start of MODEL   13
 9960    H21   DG   4           H22       DG   4   1.741  -2.916 -13.361
  Start of MODEL   13
 9961   H5''   DG   4          5H''       DG   4   6.369  -7.010  -8.707
  Start of MODEL   13
 9962   H2''   DG   4          2H''       DG   4   2.885  -4.137  -6.661
  Start of MODEL   13
 9963    H5'   DT   5           H5'       DT   5   3.117  -9.599  -4.027
  Start of MODEL   13
 9964    H4'   DT   5           H4'       DT   5   3.148  -7.782  -2.247
  Start of MODEL   13
 9965    H3'   DT   5           H3'       DT   5   1.367  -9.781  -2.512
  Start of MODEL   13
 9966    H2'   DT   5           H2'       DT   5  -0.155  -8.583  -3.972
  Start of MODEL   13
 9967    H1'   DT   5           H1'       DT   5   0.230  -6.219  -2.060
  Start of MODEL   13
 9968    H3    DT   5           H3        DT   5  -3.199  -4.351  -4.409
  Start of MODEL   13
 9969    H71   DT   5           H71       DT   5  -0.577  -4.286  -8.206
  Start of MODEL   13
 9970    H72   DT   5           H72       DT   5   0.751  -3.468  -7.345
  Start of MODEL   13
 9971    H73   DT   5           H73       DT   5   0.883  -5.194  -7.754
  Start of MODEL   13
 9972    H6    DT   5           H6        DT   5   1.185  -5.897  -5.449
  Start of MODEL   13
 9973   H5''   DT   5          5H''       DT   5   2.283  -8.418  -5.056
  Start of MODEL   13
 9974   H2''   DT   5          2H''       DT   5  -0.890  -8.367  -2.389
  Start of MODEL   13
 9975    H5'   DG   6           H5'       DG   6   2.483  -7.413   1.478
  Start of MODEL   13
 9976    H4'   DG   6           H4'       DG   6   3.291  -7.919   3.848
  Start of MODEL   13
 9977    H3'   DG   6           H3'       DG   6   1.776 -10.180   3.781
  Start of MODEL   13
 9978    H2'   DG   6           H2'       DG   6  -0.383  -9.186   3.754
  Start of MODEL   13
 9979    H1'   DG   6           H1'       DG   6   0.598  -6.958   5.598
  Start of MODEL   13
 9980    H8    DG   6           H8        DG   6  -1.296  -7.682   2.300
  Start of MODEL   13
 9981    H1    DG   6           H1        DG   6  -3.646  -2.901   5.881
  Start of MODEL   13
 9982    H22   DG   6           H21       DG   6  -0.965  -3.579   7.977
  Start of MODEL   13
 9983    H21   DG   6           H22       DG   6  -2.386  -2.606   7.670
  Start of MODEL   13
 9984   H5''   DG   6          5H''       DG   6   3.218  -8.995   1.814
  Start of MODEL   13
 9985   H2''   DG   6          2H''       DG   6  -0.119  -9.241   5.488
  Start of MODEL   13
 9986    H5'   DC   7           H5'       DC   7   1.158  -9.409   7.625
  Start of MODEL   13
 9987    H4'   DC   7           H4'       DC   7   0.012 -10.795   9.496
  Start of MODEL   13
 9988    H3'   DC   7           H3'       DC   7   2.208 -12.585   8.939
  Start of MODEL   13
 9989   HO3'   DC   7           H3T       DC   7   0.008 -12.355  10.681
  Start of MODEL   13
 9990    H2'   DC   7           H2'       DC   7   1.014 -13.898   7.413
  Start of MODEL   13
 9991    H1'   DC   7           H1'       DC   7  -1.563 -12.676   8.538
  Start of MODEL   13
 9992    H42   DC   7           H41       DC   7  -2.956 -14.425   2.307
  Start of MODEL   13
 9993    H41   DC   7           H42       DC   7  -4.183 -15.147   3.326
  Start of MODEL   13
 9994    H5    DC   7           H5        DC   7  -1.049 -13.224   3.199
  Start of MODEL   13
 9995    H6    DC   7           H6        DC   7   0.021 -12.424   5.243
  Start of MODEL   13
 9996   H5''   DC   7          5H''       DC   7   1.927  -9.643   9.205
  Start of MODEL   13
 9997   H2''   DC   7          2H''       DC   7   0.097 -14.429   8.818
  Start of MODEL   14
 9998    H1   GLY  25           HT1      GLY  25 -10.039  -8.371   0.335
  Start of MODEL   14
 9999    H2   GLY  25           HT2      GLY  25 -11.528  -7.610   0.078
  Start of MODEL   14
10000    H3   GLY  25           HT3      GLY  25 -10.286  -6.783   0.884
  Start of MODEL   14
10001    HA3  GLY  25           HA2      GLY  25  -8.947  -6.781  -1.123
  Start of MODEL   14
10002    HA2  GLY  25           HA3      GLY  25 -10.500  -5.996  -1.391
  Start of MODEL   14
10003    H    ALA  26           H        ALA  26  -8.498  -8.718  -2.119
  Start of MODEL   14
10004    HA   ALA  26           HA       ALA  26 -10.358  -9.543  -4.211
  Start of MODEL   14
10005    HB1  ALA  26           HB1      ALA  26  -7.494 -10.379  -3.731
  Start of MODEL   14
10006    HB3  ALA  26           HB2      ALA  26  -8.031  -9.157  -4.887
  Start of MODEL   14
10007    HB2  ALA  26           HB3      ALA  26  -8.492 -10.847  -5.105
  Start of MODEL   14
10008    H    MET  27           H        MET  27 -11.380 -11.448  -4.185
  Start of MODEL   14
10009    HA   MET  27           HA       MET  27 -12.162 -13.465  -3.521
  Start of MODEL   14
10010    HB2  MET  27           HB2      MET  27  -9.518 -13.594  -2.084
  Start of MODEL   14
10011    HB3  MET  27           HB3      MET  27 -10.697 -14.894  -2.006
  Start of MODEL   14
10012    HG2  MET  27           HG2      MET  27  -9.461 -13.841  -4.539
  Start of MODEL   14
10013    HG3  MET  27           HG3      MET  27  -8.922 -15.275  -3.670
  Start of MODEL   14
10014    HE2  MET  27           HE1      MET  27 -10.553 -17.040  -6.686
  Start of MODEL   14
10015    HE1  MET  27           HE2      MET  27  -9.169 -16.975  -5.597
  Start of MODEL   14
10016    HE3  MET  27           HE3      MET  27  -9.512 -15.618  -6.668
  Start of MODEL   14
10017    H    GLY  28           H        GLY  28 -13.922 -12.542  -2.470
  Start of MODEL   14
10018    HA2  GLY  28           HA2      GLY  28 -15.317 -13.041  -0.650
  Start of MODEL   14
10019    HA3  GLY  28           HA3      GLY  28 -13.899 -13.279   0.355
  Start of MODEL   14
10020    H    SER  29           H        SER  29 -12.827 -11.423   1.209
  Start of MODEL   14
10021    HA   SER  29           HA       SER  29 -14.645  -9.807   2.539
  Start of MODEL   14
10022    HB2  SER  29           HB2      SER  29 -11.739  -9.113   2.164
  Start of MODEL   14
10023    HB3  SER  29           HB3      SER  29 -12.766  -8.796   3.563
  Start of MODEL   14
10024    HG   SER  29           HG       SER  29 -12.830 -11.023   3.970
  Start of MODEL   14
10025    H    ARG  30           H        ARG  30 -15.845  -8.179   1.792
  Start of MODEL   14
10026    HA   ARG  30           HA       ARG  30 -14.796  -6.587  -0.416
  Start of MODEL   14
10027    HB2  ARG  30           HB2      ARG  30 -17.148  -5.723  -0.611
  Start of MODEL   14
10028    HB3  ARG  30           HB3      ARG  30 -16.928  -7.429  -0.952
  Start of MODEL   14
10029    HG2  ARG  30           HG2      ARG  30 -18.946  -7.146   0.289
  Start of MODEL   14
10030    HG3  ARG  30           HG3      ARG  30 -17.767  -7.941   1.327
  Start of MODEL   14
10031    HD2  ARG  30           HD2      ARG  30 -17.536  -6.121   2.687
  Start of MODEL   14
10032    HD3  ARG  30           HD3      ARG  30 -17.968  -4.980   1.417
  Start of MODEL   14
10033    HE   ARG  30           HE       ARG  30 -20.306  -5.761   1.712
  Start of MODEL   14
10034   HH11  ARG  30          HH11      ARG  30 -18.039  -6.315   4.348
  Start of MODEL   14
10035   HH12  ARG  30          HH12      ARG  30 -19.264  -6.185   5.569
  Start of MODEL   14
10036   HH21  ARG  30          HH21      ARG  30 -21.895  -5.635   3.339
  Start of MODEL   14
10037   HH22  ARG  30          HH22      ARG  30 -21.448  -5.828   5.005
  Start of MODEL   14
10038    H    ASP  31           H        ASP  31 -15.162  -6.407   2.911
  Start of MODEL   14
10039    HA   ASP  31           HA       ASP  31 -15.783  -3.707   3.331
  Start of MODEL   14
10040    HB2  ASP  31           HB2      ASP  31 -13.991  -5.496   4.998
  Start of MODEL   14
10041    HB3  ASP  31           HB3      ASP  31 -14.760  -4.007   5.544
  Start of MODEL   14
10042    H    THR  32           H        THR  32 -12.869  -5.275   2.340
  Start of MODEL   14
10043    HA   THR  32           HA       THR  32 -11.327  -2.825   2.714
  Start of MODEL   14
10044    HB   THR  32           HB       THR  32  -9.468  -4.497   1.812
  Start of MODEL   14
10045    HG1  THR  32           HG1      THR  32 -10.897  -6.391   3.293
  Start of MODEL   14
10046   HG23  THR  32          HG21      THR  32  -9.393  -3.381   3.967
  Start of MODEL   14
10047   HG22  THR  32          HG22      THR  32  -8.974  -5.084   4.160
  Start of MODEL   14
10048   HG21  THR  32          HG23      THR  32 -10.579  -4.510   4.621
  Start of MODEL   14
10049    H    MET  33           H        MET  33 -13.225  -4.074   0.300
  Start of MODEL   14
10050    HA   MET  33           HA       MET  33 -11.674  -4.062  -1.970
  Start of MODEL   14
10051    HB2  MET  33           HB2      MET  33 -14.549  -3.451  -1.496
  Start of MODEL   14
10052    HB3  MET  33           HB3      MET  33 -13.867  -3.124  -3.084
  Start of MODEL   14
10053    HG2  MET  33           HG2      MET  33 -13.136  -5.448  -3.237
  Start of MODEL   14
10054    HG3  MET  33           HG3      MET  33 -13.854  -5.769  -1.661
  Start of MODEL   14
10055    HE2  MET  33           HE1      MET  33 -16.293  -4.580  -5.394
  Start of MODEL   14
10056    HE1  MET  33           HE2      MET  33 -14.545  -4.799  -5.403
  Start of MODEL   14
10057    HE3  MET  33           HE3      MET  33 -15.262  -3.454  -4.514
  Start of MODEL   14
10058    H    PHE  34           H        PHE  34 -13.365  -1.151  -0.635
  Start of MODEL   14
10059    HA   PHE  34           HA       PHE  34 -11.796   0.397  -2.560
  Start of MODEL   14
10060    HB2  PHE  34           HB2      PHE  34 -14.384   0.976  -1.136
  Start of MODEL   14
10061    HB3  PHE  34           HB3      PHE  34 -13.468   2.216  -1.978
  Start of MODEL   14
10062    HD1  PHE  34           HD1      PHE  34 -15.422  -0.857  -2.373
  Start of MODEL   14
10063    HD2  PHE  34           HD2      PHE  34 -13.464   2.353  -4.362
  Start of MODEL   14
10064    HE1  PHE  34           HE1      PHE  34 -16.521  -1.499  -4.472
  Start of MODEL   14
10065    HE2  PHE  34           HE2      PHE  34 -14.563   1.718  -6.473
  Start of MODEL   14
10066    HZ   PHE  34           HZ       PHE  34 -16.130  -0.125  -6.529
  Start of MODEL   14
10067    H    THR  35           H        THR  35 -11.613  -0.553   0.556
  Start of MODEL   14
10068    HA   THR  35           HA       THR  35 -10.798   2.061   1.594
  Start of MODEL   14
10069    HB   THR  35           HB       THR  35 -10.786   0.918   3.818
  Start of MODEL   14
10070    HG1  THR  35           HG1      THR  35 -12.246  -1.169   3.434
  Start of MODEL   14
10071   HG22  THR  35          HG21      THR  35 -13.247   0.747   3.992
  Start of MODEL   14
10072   HG21  THR  35          HG22      THR  35 -13.356   0.794   2.233
  Start of MODEL   14
10073   HG23  THR  35          HG23      THR  35 -12.736   2.188   3.114
  Start of MODEL   14
10074    H    LYS  36           H        LYS  36  -9.486  -0.987   0.556
  Start of MODEL   14
10075    HA   LYS  36           HA       LYS  36  -7.042  -0.694   2.061
  Start of MODEL   14
10076    HB2  LYS  36           HB2      LYS  36  -8.253  -2.879   1.490
  Start of MODEL   14
10077    HB3  LYS  36           HB3      LYS  36  -7.680  -2.643  -0.151
  Start of MODEL   14
10078    HG2  LYS  36           HG2      LYS  36  -5.350  -2.641   0.764
  Start of MODEL   14
10079    HG3  LYS  36           HG3      LYS  36  -6.039  -3.133   2.317
  Start of MODEL   14
10080    HD2  LYS  36           HD2      LYS  36  -7.151  -5.032   1.077
  Start of MODEL   14
10081    HD3  LYS  36           HD3      LYS  36  -6.150  -4.603  -0.310
  Start of MODEL   14
10082    HE2  LYS  36           HE2      LYS  36  -4.995  -6.333   0.772
  Start of MODEL   14
10083    HE3  LYS  36           HE3      LYS  36  -4.159  -4.857   1.247
  Start of MODEL   14
10084    HZ3  LYS  36           HZ1      LYS  36  -5.255  -4.887   3.354
  Start of MODEL   14
10085    HZ2  LYS  36           HZ2      LYS  36  -4.567  -6.416   3.108
  Start of MODEL   14
10086    HZ1  LYS  36           HZ3      LYS  36  -6.235  -6.195   2.903
  Start of MODEL   14
10087    H    ILE  37           H        ILE  37  -5.625   0.758   1.359
  Start of MODEL   14
10088    HA   ILE  37           HA       ILE  37  -5.333   1.274  -1.507
  Start of MODEL   14
10089    HB   ILE  37           HB       ILE  37  -4.234   2.764   0.885
  Start of MODEL   14
10090   HD12  ILE  37          HD11      ILE  37  -6.796   5.460   0.200
  Start of MODEL   14
10091   HD11  ILE  37          HD12      ILE  37  -5.127   5.456  -0.368
  Start of MODEL   14
10092   HD13  ILE  37          HD13      ILE  37  -5.491   5.038   1.305
  Start of MODEL   14
10093    H    PHE  38           H        PHE  38  -3.620   0.546  -2.609
  Start of MODEL   14
10094    HA   PHE  38           HA       PHE  38  -1.376  -0.586  -1.088
  Start of MODEL   14
10095    HB2  PHE  38           HB2      PHE  38  -2.371  -2.189  -2.624
  Start of MODEL   14
10096    HB3  PHE  38           HB3      PHE  38  -2.221  -1.051  -3.959
  Start of MODEL   14
10097    HD1  PHE  38           HD1      PHE  38  -0.376  -1.142  -5.332
  Start of MODEL   14
10098    HD2  PHE  38           HD2      PHE  38  -0.149  -2.863  -1.447
  Start of MODEL   14
10099    HE1  PHE  38           HE1      PHE  38   1.841  -2.054  -5.870
  Start of MODEL   14
10100    HE2  PHE  38           HE2      PHE  38   2.073  -3.771  -1.977
  Start of MODEL   14
10101    HZ   PHE  38           HZ       PHE  38   3.088  -3.347  -4.152
  Start of MODEL   14
10102    H    VAL  39           H        VAL  39   0.552   0.407  -1.136
  Start of MODEL   14
10103    HA   VAL  39           HA       VAL  39   0.876   2.599  -3.077
  Start of MODEL   14
10104    HB   VAL  39           HB       VAL  39   2.417   2.395  -0.506
  Start of MODEL   14
10105    H    GLY  40           H        GLY  40   2.644   2.631  -4.329
  Start of MODEL   14
10106    HA2  GLY  40           HA2      GLY  40   4.552   0.393  -4.020
  Start of MODEL   14
10107    HA3  GLY  40           HA3      GLY  40   3.808   0.731  -5.576
  Start of MODEL   14
10108    H    GLY  41           H        GLY  41   6.643   0.749  -4.808
  Start of MODEL   14
10109    HA2  GLY  41           HA2      GLY  41   8.407   1.951  -5.722
  Start of MODEL   14
10110    HA3  GLY  41           HA3      GLY  41   7.278   3.224  -6.153
  Start of MODEL   14
10111    H    LEU  42           H        LEU  42   7.050   2.224  -2.925
  Start of MODEL   14
10112    HA   LEU  42           HA       LEU  42   7.812   4.747  -1.901
  Start of MODEL   14
10113    HB2  LEU  42           HB2      LEU  42   7.315   2.086  -0.573
  Start of MODEL   14
10114    HB3  LEU  42           HB3      LEU  42   7.684   3.542   0.325
  Start of MODEL   14
10115    HG   LEU  42           HG       LEU  42   5.305   3.206  -1.493
  Start of MODEL   14
10116   HD13  LEU  42          HD11      LEU  42   5.152   1.754   0.463
  Start of MODEL   14
10117   HD12  LEU  42          HD12      LEU  42   4.006   3.087   0.580
  Start of MODEL   14
10118   HD11  LEU  42          HD13      LEU  42   5.498   3.123   1.518
  Start of MODEL   14
10119   HD23  LEU  42          HD21      LEU  42   6.025   5.378   0.473
  Start of MODEL   14
10120   HD22  LEU  42          HD22      LEU  42   4.541   5.285  -0.473
  Start of MODEL   14
10121   HD21  LEU  42          HD23      LEU  42   6.088   5.518  -1.283
  Start of MODEL   14
10122    HA   PRO  43           HA       PRO  43  12.252   4.150  -1.620
  Start of MODEL   14
10123    HB2  PRO  43           HB2      PRO  43  12.600   6.112   0.301
  Start of MODEL   14
10124    HB3  PRO  43           HB3      PRO  43  12.588   6.402  -1.441
  Start of MODEL   14
10125    HG2  PRO  43           HG2      PRO  43  10.411   6.767   0.561
  Start of MODEL   14
10126    HG3  PRO  43           HG3      PRO  43  10.831   7.771  -0.836
  Start of MODEL   14
10127    HD2  PRO  43           HD2      PRO  43   8.740   6.084  -0.877
  Start of MODEL   14
10128    HD3  PRO  43           HD3      PRO  43   9.733   6.377  -2.323
  Start of MODEL   14
10129    H    TYR  44           H        TYR  44  13.606   3.132  -0.103
  Start of MODEL   14
10130    HA   TYR  44           HA       TYR  44  12.265   1.534   1.794
  Start of MODEL   14
10131    HB2  TYR  44           HB2      TYR  44  15.210   2.035   1.354
  Start of MODEL   14
10132    HB3  TYR  44           HB3      TYR  44  14.591   0.860   2.507
  Start of MODEL   14
10133    HD1  TYR  44           HD1      TYR  44  12.417  -0.429   1.084
  Start of MODEL   14
10134    HD2  TYR  44           HD2      TYR  44  16.197   0.855  -0.394
  Start of MODEL   14
10135    HE1  TYR  44           HE1      TYR  44  12.270  -2.087  -0.727
  Start of MODEL   14
10136    HE2  TYR  44           HE2      TYR  44  16.065  -0.807  -2.209
  Start of MODEL   14
10137    HH   TYR  44           HH       TYR  44  14.883  -2.991  -2.625
  Start of MODEL   14
10138    H    HIS  45           H        HIS  45  13.468   4.706   2.050
  Start of MODEL   14
10139    HA   HIS  45           HA       HIS  45  13.898   4.754   4.873
  Start of MODEL   14
10140    HB2  HIS  45           HB2      HIS  45  13.031   7.168   3.300
  Start of MODEL   14
10141    HB3  HIS  45           HB3      HIS  45  14.034   7.103   4.738
  Start of MODEL   14
10142    HD1  HIS  45           HD1      HIS  45  16.529   6.794   4.419
  Start of MODEL   14
10143    HD2  HIS  45           HD2      HIS  45  14.341   6.572   0.898
  Start of MODEL   14
10144    HE1  HIS  45           HE1      HIS  45  18.232   6.909   2.568
  Start of MODEL   14
10145    HE2  HIS  45           HE2      HIS  45  16.873   6.948   0.442
  Start of MODEL   14
10146    H    THR  46           H        THR  46  11.042   4.992   2.880
  Start of MODEL   14
10147    HA   THR  46           HA       THR  46   9.328   6.385   4.445
  Start of MODEL   14
10148    HB   THR  46           HB       THR  46   8.535   3.856   3.003
  Start of MODEL   14
10149    HG1  THR  46           HG1      THR  46   9.526   4.897   1.402
  Start of MODEL   14
10150   HG21  THR  46          HG21      THR  46   7.050   6.451   3.447
  Start of MODEL   14
10151   HG23  THR  46          HG22      THR  46   6.788   4.958   4.350
  Start of MODEL   14
10152   HG22  THR  46          HG23      THR  46   6.436   5.016   2.623
  Start of MODEL   14
10153    H    SER  47           H        SER  47   8.452   6.126   6.386
  Start of MODEL   14
10154    HA   SER  47           HA       SER  47   8.482   3.458   7.611
  Start of MODEL   14
10155    HB2  SER  47           HB2      SER  47   8.370   4.688   9.782
  Start of MODEL   14
10156    HB3  SER  47           HB3      SER  47   9.824   5.062   8.859
  Start of MODEL   14
10157    HG   SER  47           HG       SER  47   9.224   7.067   8.928
  Start of MODEL   14
10158    H    ASP  48           H        ASP  48   6.639   2.956   8.982
  Start of MODEL   14
10159    HA   ASP  48           HA       ASP  48   4.179   3.210   7.780
  Start of MODEL   14
10160    HB2  ASP  48           HB2      ASP  48   4.506   2.940  10.768
  Start of MODEL   14
10161    HB3  ASP  48           HB3      ASP  48   3.251   2.250   9.743
  Start of MODEL   14
10162    H    LYS  49           H        LYS  49   5.680   5.270  10.168
  Start of MODEL   14
10163    HA   LYS  49           HA       LYS  49   3.518   6.871  10.901
  Start of MODEL   14
10164    HB2  LYS  49           HB2      LYS  49   5.838   6.777  11.928
  Start of MODEL   14
10165    HB3  LYS  49           HB3      LYS  49   6.383   7.790  10.602
  Start of MODEL   14
10166    HG2  LYS  49           HG2      LYS  49   4.725   9.505  11.319
  Start of MODEL   14
10167    HG3  LYS  49           HG3      LYS  49   4.375   8.500  12.726
  Start of MODEL   14
10168    HD2  LYS  49           HD2      LYS  49   7.038   9.718  12.004
  Start of MODEL   14
10169    HD3  LYS  49           HD3      LYS  49   5.968  10.243  13.304
  Start of MODEL   14
10170    HE2  LYS  49           HE2      LYS  49   7.424   7.610  13.096
  Start of MODEL   14
10171    HE3  LYS  49           HE3      LYS  49   7.775   8.921  14.219
  Start of MODEL   14
10172    HZ3  LYS  49           HZ1      LYS  49   6.559   7.363  15.440
  Start of MODEL   14
10173    HZ2  LYS  49           HZ2      LYS  49   5.443   7.101  14.197
  Start of MODEL   14
10174    HZ1  LYS  49           HZ3      LYS  49   5.423   8.564  15.057
  Start of MODEL   14
10175    H    THR  50           H        THR  50   5.886   7.289   8.270
  Start of MODEL   14
10176    HA   THR  50           HA       THR  50   4.913   9.777   7.362
  Start of MODEL   14
10177    HB   THR  50           HB       THR  50   6.394   7.657   5.780
  Start of MODEL   14
10178    HG1  THR  50           HG1      THR  50   7.286   9.767   7.481
  Start of MODEL   14
10179   HG21  THR  50          HG21      THR  50   6.198  10.635   5.307
  Start of MODEL   14
10180   HG23  THR  50          HG22      THR  50   5.364   9.398   4.370
  Start of MODEL   14
10181   HG22  THR  50          HG23      THR  50   7.124   9.481   4.348
  Start of MODEL   14
10182    H    LEU  51           H        LEU  51   4.064   6.448   6.500
  Start of MODEL   14
10183    HA   LEU  51           HA       LEU  51   2.384   7.200   4.301
  Start of MODEL   14
10184    HB2  LEU  51           HB2      LEU  51   2.520   4.682   5.958
  Start of MODEL   14
10185    HB3  LEU  51           HB3      LEU  51   1.393   4.890   4.633
  Start of MODEL   14
10186    HG   LEU  51           HG       LEU  51   4.406   4.860   4.439
  Start of MODEL   14
10187   HD12  LEU  51          HD11      LEU  51   3.994   2.849   3.075
  Start of MODEL   14
10188   HD11  LEU  51          HD12      LEU  51   2.277   2.963   3.457
  Start of MODEL   14
10189   HD13  LEU  51          HD13      LEU  51   3.447   2.661   4.741
  Start of MODEL   14
10190   HD22  LEU  51          HD21      LEU  51   4.073   5.052   2.024
  Start of MODEL   14
10191   HD21  LEU  51          HD22      LEU  51   3.461   6.473   2.871
  Start of MODEL   14
10192   HD23  LEU  51          HD23      LEU  51   2.339   5.247   2.276
  Start of MODEL   14
10193    H    HIS  52           H        HIS  52   1.816   6.304   7.651
  Start of MODEL   14
10194    HA   HIS  52           HA       HIS  52  -0.907   6.697   7.797
  Start of MODEL   14
10195    HB2  HIS  52           HB2      HIS  52   0.507   5.812   9.649
  Start of MODEL   14
10196    HB3  HIS  52           HB3      HIS  52   1.085   7.444   9.955
  Start of MODEL   14
10197    HD1  HIS  52           HD1      HIS  52  -0.051   8.437  11.912
  Start of MODEL   14
10198    HD2  HIS  52           HD2      HIS  52  -2.550   5.868   9.803
  Start of MODEL   14
10199    HE1  HIS  52           HE1      HIS  52  -2.254   8.484  13.126
  Start of MODEL   14
10200    HE2  HIS  52           HE2      HIS  52  -3.737   6.869  11.880
  Start of MODEL   14
10201    H    GLU  53           H        GLU  53   1.601   9.168   8.500
  Start of MODEL   14
10202    HA   GLU  53           HA       GLU  53  -0.190  11.223   8.987
  Start of MODEL   14
10203    HB2  GLU  53           HB2      GLU  53   1.645  12.610   9.154
  Start of MODEL   14
10204    HB3  GLU  53           HB3      GLU  53   2.343  11.020   9.429
  Start of MODEL   14
10205    HG2  GLU  53           HG2      GLU  53   3.742  11.325   7.807
  Start of MODEL   14
10206    HG3  GLU  53           HG3      GLU  53   2.419  11.505   6.667
  Start of MODEL   14
10207    H    TYR  54           H        TYR  54   1.231  10.166   5.955
  Start of MODEL   14
10208    HA   TYR  54           HA       TYR  54   0.574  12.497   4.469
  Start of MODEL   14
10209    HB2  TYR  54           HB2      TYR  54   2.325  10.641   3.986
  Start of MODEL   14
10210    HB3  TYR  54           HB3      TYR  54   0.983   9.773   3.255
  Start of MODEL   14
10211    HD1  TYR  54           HD1      TYR  54   0.048  10.468   1.172
  Start of MODEL   14
10212    HD2  TYR  54           HD2      TYR  54   3.189  12.702   2.967
  Start of MODEL   14
10213    HE1  TYR  54           HE1      TYR  54   0.366  11.695  -0.933
  Start of MODEL   14
10214    HE2  TYR  54           HE2      TYR  54   3.523  13.938   0.864
  Start of MODEL   14
10215    HH   TYR  54           HH       TYR  54   1.272  13.859  -1.681
  Start of MODEL   14
10216    H    PHE  55           H        PHE  55  -0.852   9.222   4.445
  Start of MODEL   14
10217    HA   PHE  55           HA       PHE  55  -3.013   9.992   2.782
  Start of MODEL   14
10218    HB2  PHE  55           HB2      PHE  55  -2.490   7.529   4.421
  Start of MODEL   14
10219    HB3  PHE  55           HB3      PHE  55  -3.941   7.726   3.440
  Start of MODEL   14
10220    HD1  PHE  55           HD1      PHE  55  -0.367   7.057   3.416
  Start of MODEL   14
10221    HD2  PHE  55           HD2      PHE  55  -3.769   7.901   0.999
  Start of MODEL   14
10222    HE1  PHE  55           HE1      PHE  55   0.858   6.278   1.430
  Start of MODEL   14
10223    HE2  PHE  55           HE2      PHE  55  -2.548   7.121  -0.993
  Start of MODEL   14
10224    HZ   PHE  55           HZ       PHE  55  -0.240   6.308  -0.778
  Start of MODEL   14
10225    H    GLU  56           H        GLU  56  -2.602   9.960   6.239
  Start of MODEL   14
10226    HA   GLU  56           HA       GLU  56  -5.305   9.991   7.007
  Start of MODEL   14
10227    HB2  GLU  56           HB2      GLU  56  -2.713  10.653   8.218
  Start of MODEL   14
10228    HB3  GLU  56           HB3      GLU  56  -4.082  11.499   8.936
  Start of MODEL   14
10229    HG2  GLU  56           HG2      GLU  56  -4.418   8.605   8.531
  Start of MODEL   14
10230    HG3  GLU  56           HG3      GLU  56  -3.185   9.073   9.696
  Start of MODEL   14
10231    H    GLN  57           H        GLN  57  -3.353  12.390   5.496
  Start of MODEL   14
10232    HA   GLN  57           HA       GLN  57  -4.834  14.694   6.180
  Start of MODEL   14
10233    HB2  GLN  57           HB2      GLN  57  -3.324  14.147   3.620
  Start of MODEL   14
10234    HB3  GLN  57           HB3      GLN  57  -3.799  15.728   4.225
  Start of MODEL   14
10235    HG2  GLN  57           HG2      GLN  57  -1.847  13.845   5.532
  Start of MODEL   14
10236    HG3  GLN  57           HG3      GLN  57  -1.441  15.289   4.609
  Start of MODEL   14
10237   HE21  GLN  57          HE21      GLN  57  -0.865  14.557   7.379
  Start of MODEL   14
10238   HE22  GLN  57          HE22      GLN  57  -1.507  15.843   8.349
  Start of MODEL   14
10239    H    PHE  58           H        PHE  58  -5.602  12.016   4.198
  Start of MODEL   14
10240    HA   PHE  58           HA       PHE  58  -7.583  13.487   2.642
  Start of MODEL   14
10241    HB2  PHE  58           HB2      PHE  58  -6.751  10.578   2.583
  Start of MODEL   14
10242    HB3  PHE  58           HB3      PHE  58  -8.014  11.262   1.570
  Start of MODEL   14
10243    HD1  PHE  58           HD1      PHE  58  -4.391  11.483   2.335
  Start of MODEL   14
10244    HD2  PHE  58           HD2      PHE  58  -7.499  12.312  -0.451
  Start of MODEL   14
10245    HE1  PHE  58           HE1      PHE  58  -2.707  12.098   0.650
  Start of MODEL   14
10246    HE2  PHE  58           HE2      PHE  58  -5.817  12.941  -2.144
  Start of MODEL   14
10247    HZ   PHE  58           HZ       PHE  58  -3.421  12.827  -1.590
  Start of MODEL   14
10248    H    GLY  59           H        GLY  59  -7.333  11.517   5.447
  Start of MODEL   14
10249    HA2  GLY  59           HA2      GLY  59  -9.771  11.973   6.530
  Start of MODEL   14
10250    HA3  GLY  59           HA3      GLY  59 -10.072  10.628   5.437
  Start of MODEL   14
10251    H    ASP  60           H        ASP  60 -10.663   9.741   7.648
  Start of MODEL   14
10252    HA   ASP  60           HA       ASP  60  -8.641   9.146   9.536
  Start of MODEL   14
10253    HB2  ASP  60           HB2      ASP  60 -11.395   7.967   9.131
  Start of MODEL   14
10254    HB3  ASP  60           HB3      ASP  60 -10.352   7.579  10.493
  Start of MODEL   14
10255    H    ILE  61           H        ILE  61  -7.218   7.572   9.605
  Start of MODEL   14
10256    HA   ILE  61           HA       ILE  61  -7.407   5.397   7.658
  Start of MODEL   14
10257    HB   ILE  61           HB       ILE  61  -5.162   6.579   9.231
  Start of MODEL   14
10258   HD12  ILE  61          HD11      ILE  61  -3.215   5.807   6.705
  Start of MODEL   14
10259   HD11  ILE  61          HD12      ILE  61  -3.260   7.253   7.709
  Start of MODEL   14
10260   HD13  ILE  61          HD13      ILE  61  -3.569   7.373   5.977
  Start of MODEL   14
10261    H    GLU  62           H        GLU  62  -7.564   3.328   8.144
  Start of MODEL   14
10262    HA   GLU  62           HA       GLU  62  -8.335   2.428  10.764
  Start of MODEL   14
10263    HB2  GLU  62           HB2      GLU  62  -7.792   1.081   8.117
  Start of MODEL   14
10264    HB3  GLU  62           HB3      GLU  62  -8.243   0.181   9.545
  Start of MODEL   14
10265    HG2  GLU  62           HG2      GLU  62  -9.950   2.402   8.499
  Start of MODEL   14
10266    HG3  GLU  62           HG3      GLU  62 -10.046   0.775   7.826
  Start of MODEL   14
10267    H    GLU  63           H        GLU  63  -5.684   1.878   8.521
  Start of MODEL   14
10268    HA   GLU  63           HA       GLU  63  -3.744   1.499  10.607
  Start of MODEL   14
10269    HB2  GLU  63           HB2      GLU  63  -4.827  -0.737  10.553
  Start of MODEL   14
10270    HB3  GLU  63           HB3      GLU  63  -4.420  -0.871   8.848
  Start of MODEL   14
10271    HG2  GLU  63           HG2      GLU  63  -2.851  -2.118  10.174
  Start of MODEL   14
10272    HG3  GLU  63           HG3      GLU  63  -2.040  -0.750   9.420
  Start of MODEL   14
10273    H    ALA  64           H        ALA  64  -1.660   1.845   9.821
  Start of MODEL   14
10274    HA   ALA  64           HA       ALA  64  -1.325   1.947   6.917
  Start of MODEL   14
10275    HB3  ALA  64           HB1      ALA  64  -1.848   4.233   7.538
  Start of MODEL   14
10276    HB2  ALA  64           HB2      ALA  64  -0.143   4.113   7.099
  Start of MODEL   14
10277    HB1  ALA  64           HB3      ALA  64  -0.611   4.200   8.797
  Start of MODEL   14
10278    H    VAL  65           H        VAL  65   0.332   0.691   6.458
  Start of MODEL   14
10279    HA   VAL  65           HA       VAL  65   2.645   0.618   8.270
  Start of MODEL   14
10280    HB   VAL  65           HB       VAL  65   2.781  -1.849   8.068
  Start of MODEL   14
10281    H    VAL  66           H        VAL  66   4.592   0.128   7.336
  Start of MODEL   14
10282    HA   VAL  66           HA       VAL  66   4.674  -0.010   4.407
  Start of MODEL   14
10283    HB   VAL  66           HB       VAL  66   6.946   0.274   6.399
  Start of MODEL   14
10284    H    ILE  67           H        ILE  67   5.428  -1.863   3.336
  Start of MODEL   14
10285    HA   ILE  67           HA       ILE  67   5.018  -4.210   4.993
  Start of MODEL   14
10286    HB   ILE  67           HB       ILE  67   5.185  -3.925   1.994
  Start of MODEL   14
10287   HD12  ILE  67          HD11      ILE  67   1.605  -4.146   4.288
  Start of MODEL   14
10288   HD11  ILE  67          HD12      ILE  67   3.155  -3.902   5.090
  Start of MODEL   14
10289   HD13  ILE  67          HD13      ILE  67   2.740  -5.486   4.439
  Start of MODEL   14
10290    H    THR  68           H        THR  68   6.532  -5.432   5.680
  Start of MODEL   14
10291    HA   THR  68           HA       THR  68   9.156  -5.411   4.364
  Start of MODEL   14
10292    HB   THR  68           HB       THR  68  10.162  -5.817   6.595
  Start of MODEL   14
10293    HG1  THR  68           HG1      THR  68   7.738  -5.033   7.801
  Start of MODEL   14
10294   HG23  THR  68          HG21      THR  68  10.062  -3.521   5.759
  Start of MODEL   14
10295   HG22  THR  68          HG22      THR  68   9.874  -3.561   7.515
  Start of MODEL   14
10296   HG21  THR  68          HG23      THR  68   8.462  -3.326   6.482
  Start of MODEL   14
10297    H    ASP  69           H        ASP  69  10.146  -7.492   4.191
  Start of MODEL   14
10298    HA   ASP  69           HA       ASP  69   8.562  -9.777   4.173
  Start of MODEL   14
10299    HB2  ASP  69           HB2      ASP  69  10.612  -9.886   3.002
  Start of MODEL   14
10300    HB3  ASP  69           HB3      ASP  69  11.535  -9.352   4.404
  Start of MODEL   14
10301    H    ARG  70           H        ARG  70   7.811 -11.079   5.751
  Start of MODEL   14
10302    HA   ARG  70           HA       ARG  70   7.860 -10.201   8.386
  Start of MODEL   14
10303    HB2  ARG  70           HB2      ARG  70   6.763 -12.305   9.005
  Start of MODEL   14
10304    HB3  ARG  70           HB3      ARG  70   6.018 -11.507   7.628
  Start of MODEL   14
10305    HG2  ARG  70           HG2      ARG  70   8.039 -13.666   7.247
  Start of MODEL   14
10306    HG3  ARG  70           HG3      ARG  70   6.343 -14.044   7.554
  Start of MODEL   14
10307    HD2  ARG  70           HD2      ARG  70   5.847 -13.640   5.427
  Start of MODEL   14
10308    HD3  ARG  70           HD3      ARG  70   6.486 -12.002   5.593
  Start of MODEL   14
10309    HE   ARG  70           HE       ARG  70   8.628 -12.808   4.865
  Start of MODEL   14
10310   HH11  ARG  70          HH11      ARG  70   6.037 -15.144   4.511
  Start of MODEL   14
10311   HH12  ARG  70          HH12      ARG  70   6.837 -16.017   3.249
  Start of MODEL   14
10312   HH21  ARG  70          HH21      ARG  70   9.668 -13.929   3.235
  Start of MODEL   14
10313   HH22  ARG  70          HH22      ARG  70   8.910 -15.319   2.495
  Start of MODEL   14
10314    H    ASN  71           H        ASN  71  10.181 -12.160   6.776
  Start of MODEL   14
10315    HA   ASN  71           HA       ASN  71  11.092 -13.410   9.236
  Start of MODEL   14
10316    HB2  ASN  71           HB2      ASN  71  12.001 -13.683   6.371
  Start of MODEL   14
10317    HB3  ASN  71           HB3      ASN  71  12.774 -14.511   7.717
  Start of MODEL   14
10318   HD21  ASN  71          HD21      ASN  71  12.268 -16.504   6.793
  Start of MODEL   14
10319   HD22  ASN  71          HD22      ASN  71  10.665 -17.155   6.828
  Start of MODEL   14
10320    H    THR  72           H        THR  72  12.525 -11.341   6.695
  Start of MODEL   14
10321    HA   THR  72           HA       THR  72  14.797 -10.780   8.434
  Start of MODEL   14
10322    HB   THR  72           HB       THR  72  15.626  -9.470   6.458
  Start of MODEL   14
10323    HG1  THR  72           HG1      THR  72  13.349 -10.634   5.165
  Start of MODEL   14
10324   HG22  THR  72          HG21      THR  72  16.109 -11.439   5.086
  Start of MODEL   14
10325   HG21  THR  72          HG22      THR  72  14.840 -12.337   5.919
  Start of MODEL   14
10326   HG23  THR  72          HG23      THR  72  16.272 -11.808   6.801
  Start of MODEL   14
10327    H    GLN  73           H        GLN  73  11.875  -9.362   7.445
  Start of MODEL   14
10328    HA   GLN  73           HA       GLN  73  10.721  -7.523   8.136
  Start of MODEL   14
10329    HB2  GLN  73           HB2      GLN  73  12.889  -7.332  10.226
  Start of MODEL   14
10330    HB3  GLN  73           HB3      GLN  73  11.348  -6.479  10.264
  Start of MODEL   14
10331    HG2  GLN  73           HG2      GLN  73  10.206  -8.692  10.245
  Start of MODEL   14
10332    HG3  GLN  73           HG3      GLN  73  11.787  -9.450  10.405
  Start of MODEL   14
10333   HE21  GLN  73          HE21      GLN  73  10.956  -6.444  11.950
  Start of MODEL   14
10334   HE22  GLN  73          HE22      GLN  73  10.933  -7.053  13.570
  Start of MODEL   14
10335    H    LYS  74           H        LYS  74  12.651  -7.332   6.089
  Start of MODEL   14
10336    HA   LYS  74           HA       LYS  74  13.712  -4.603   6.332
  Start of MODEL   14
10337    HB2  LYS  74           HB2      LYS  74  14.136  -6.631   4.125
  Start of MODEL   14
10338    HB3  LYS  74           HB3      LYS  74  14.963  -5.088   4.295
  Start of MODEL   14
10339    HG2  LYS  74           HG2      LYS  74  15.151  -7.347   6.274
  Start of MODEL   14
10340    HG3  LYS  74           HG3      LYS  74  16.327  -7.031   4.996
  Start of MODEL   14
10341    HD2  LYS  74           HD2      LYS  74  16.900  -4.912   5.966
  Start of MODEL   14
10342    HD3  LYS  74           HD3      LYS  74  15.574  -5.028   7.123
  Start of MODEL   14
10343    HE2  LYS  74           HE2      LYS  74  16.632  -6.922   8.193
  Start of MODEL   14
10344    HE3  LYS  74           HE3      LYS  74  17.930  -6.908   7.000
  Start of MODEL   14
10345    HZ1  LYS  74           HZ1      LYS  74  17.351  -4.591   8.761
  Start of MODEL   14
10346    HZ3  LYS  74           HZ2      LYS  74  18.738  -4.876   7.829
  Start of MODEL   14
10347    HZ2  LYS  74           HZ3      LYS  74  18.429  -5.831   9.196
  Start of MODEL   14
10348    H    SER  75           H        SER  75  12.918  -2.936   5.093
  Start of MODEL   14
10349    HA   SER  75           HA       SER  75  10.274  -3.039   4.234
  Start of MODEL   14
10350    HB2  SER  75           HB2      SER  75  12.355  -1.046   3.312
  Start of MODEL   14
10351    HB3  SER  75           HB3      SER  75  10.616  -0.787   3.463
  Start of MODEL   14
10352    HG   SER  75           HG       SER  75  11.373   0.048   5.306
  Start of MODEL   14
10353    H    ARG  76           H        ARG  76   9.313  -3.506   2.331
  Start of MODEL   14
10354    HA   ARG  76           HA       ARG  76  11.064  -4.614   0.249
  Start of MODEL   14
10355    HB2  ARG  76           HB2      ARG  76   8.068  -4.884   0.379
  Start of MODEL   14
10356    HB3  ARG  76           HB3      ARG  76   9.206  -5.882  -0.514
  Start of MODEL   14
10357    HG2  ARG  76           HG2      ARG  76  10.146  -6.484   1.815
  Start of MODEL   14
10358    HG3  ARG  76           HG3      ARG  76   8.620  -5.843   2.421
  Start of MODEL   14
10359    HD2  ARG  76           HD2      ARG  76   8.154  -8.094   2.176
  Start of MODEL   14
10360    HD3  ARG  76           HD3      ARG  76   7.549  -7.420   0.661
  Start of MODEL   14
10361    HE   ARG  76           HE       ARG  76  10.285  -8.463   0.706
  Start of MODEL   14
10362   HH11  ARG  76          HH11      ARG  76   6.959  -8.769  -0.375
  Start of MODEL   14
10363   HH12  ARG  76          HH12      ARG  76   7.293 -10.106  -1.430
  Start of MODEL   14
10364   HH21  ARG  76          HH21      ARG  76  10.732 -10.196  -0.694
  Start of MODEL   14
10365   HH22  ARG  76          HH22      ARG  76   9.460 -10.913  -1.634
  Start of MODEL   14
10366    H    GLY  77           H        GLY  77  10.310  -1.732   0.745
  Start of MODEL   14
10367    HA2  GLY  77           HA2      GLY  77  10.080   0.142  -0.572
  Start of MODEL   14
10368    HA3  GLY  77           HA3      GLY  77  10.163  -0.928  -1.957
  Start of MODEL   14
10369    H    TYR  78           H        TYR  78   7.585  -1.688   0.157
  Start of MODEL   14
10370    HA   TYR  78           HA       TYR  78   5.751   0.200  -1.041
  Start of MODEL   14
10371    HB2  TYR  78           HB2      TYR  78   4.221  -1.510  -1.909
  Start of MODEL   14
10372    HB3  TYR  78           HB3      TYR  78   5.774  -1.562  -2.723
  Start of MODEL   14
10373    HD1  TYR  78           HD1      TYR  78   3.465  -3.342  -0.529
  Start of MODEL   14
10374    HD2  TYR  78           HD2      TYR  78   7.281  -3.468  -2.399
  Start of MODEL   14
10375    HE1  TYR  78           HE1      TYR  78   3.619  -5.740  -0.028
  Start of MODEL   14
10376    HE2  TYR  78           HE2      TYR  78   7.450  -5.868  -1.906
  Start of MODEL   14
10377    HH   TYR  78           HH       TYR  78   6.537  -7.506  -0.374
  Start of MODEL   14
10378    H    GLY  79           H        GLY  79   3.445  -0.238  -0.152
  Start of MODEL   14
10379    HA2  GLY  79           HA2      GLY  79   3.446  -1.493   2.448
  Start of MODEL   14
10380    HA3  GLY  79           HA3      GLY  79   3.476   0.262   2.508
  Start of MODEL   14
10381    H    PHE  80           H        PHE  80   1.423  -0.484   3.723
  Start of MODEL   14
10382    HA   PHE  80           HA       PHE  80  -0.815  -0.339   1.835
  Start of MODEL   14
10383    HB2  PHE  80           HB2      PHE  80  -0.471  -2.306   4.080
  Start of MODEL   14
10384    HB3  PHE  80           HB3      PHE  80  -2.076  -1.838   3.529
  Start of MODEL   14
10385    HD1  PHE  80           HD1      PHE  80   0.984  -3.640   2.681
  Start of MODEL   14
10386    HD2  PHE  80           HD2      PHE  80  -2.890  -2.493   1.379
  Start of MODEL   14
10387    HE1  PHE  80           HE1      PHE  80   1.092  -5.328   0.902
  Start of MODEL   14
10388    HE2  PHE  80           HE2      PHE  80  -2.802  -4.172  -0.407
  Start of MODEL   14
10389    HZ   PHE  80           HZ       PHE  80  -0.799  -5.602  -0.642
  Start of MODEL   14
10390    H    VAL  81           H        VAL  81  -2.366   0.963   2.333
  Start of MODEL   14
10391    HA   VAL  81           HA       VAL  81  -2.667   1.837   5.138
  Start of MODEL   14
10392    HB   VAL  81           HB       VAL  81  -2.994   3.579   2.682
  Start of MODEL   14
10393    H    THR  82           H        THR  82  -4.576   1.330   5.948
  Start of MODEL   14
10394    HA   THR  82           HA       THR  82  -6.755   0.699   4.081
  Start of MODEL   14
10395    HB   THR  82           HB       THR  82  -6.583  -0.034   7.016
  Start of MODEL   14
10396    HG1  THR  82           HG1      THR  82  -5.254  -1.068   4.911
  Start of MODEL   14
10397   HG21  THR  82          HG21      THR  82  -8.305  -1.098   4.764
  Start of MODEL   14
10398   HG23  THR  82          HG22      THR  82  -8.845  -0.018   6.052
  Start of MODEL   14
10399   HG22  THR  82          HG23      THR  82  -8.327  -1.659   6.437
  Start of MODEL   14
10400    H    MET  83           H        MET  83  -8.083   2.395   3.838
  Start of MODEL   14
10401    HA   MET  83           HA       MET  83  -8.167   4.471   5.844
  Start of MODEL   14
10402    HB2  MET  83           HB2      MET  83  -9.640   4.265   3.212
  Start of MODEL   14
10403    HB3  MET  83           HB3      MET  83  -9.550   5.697   4.234
  Start of MODEL   14
10404    HG2  MET  83           HG2      MET  83  -7.213   4.364   2.887
  Start of MODEL   14
10405    HG3  MET  83           HG3      MET  83  -8.040   5.811   2.313
  Start of MODEL   14
10406    HE3  MET  83           HE1      MET  83  -7.771   8.211   3.390
  Start of MODEL   14
10407    HE2  MET  83           HE2      MET  83  -7.139   8.450   5.020
  Start of MODEL   14
10408    HE1  MET  83           HE3      MET  83  -8.612   7.517   4.776
  Start of MODEL   14
10409    H    LYS  84           H        LYS  84  -9.928   5.110   6.969
  Start of MODEL   14
10410    HA   LYS  84           HA       LYS  84 -11.690   3.052   7.802
  Start of MODEL   14
10411    HB2  LYS  84           HB2      LYS  84 -10.826   4.885   9.249
  Start of MODEL   14
10412    HB3  LYS  84           HB3      LYS  84 -11.876   6.007   8.398
  Start of MODEL   14
10413    HG2  LYS  84           HG2      LYS  84 -13.821   4.994   9.258
  Start of MODEL   14
10414    HG3  LYS  84           HG3      LYS  84 -12.925   3.582   9.821
  Start of MODEL   14
10415    HD2  LYS  84           HD2      LYS  84 -12.472   6.370  10.867
  Start of MODEL   14
10416    HD3  LYS  84           HD3      LYS  84 -13.579   5.218  11.615
  Start of MODEL   14
10417    HE2  LYS  84           HE2      LYS  84 -10.634   4.750  11.171
  Start of MODEL   14
10418    HE3  LYS  84           HE3      LYS  84 -11.344   5.287  12.691
  Start of MODEL   14
10419    HZ1  LYS  84           HZ1      LYS  84 -12.681   3.218  12.684
  Start of MODEL   14
10420    HZ3  LYS  84           HZ2      LYS  84 -11.015   2.940  12.788
  Start of MODEL   14
10421    HZ2  LYS  84           HZ3      LYS  84 -11.822   2.689  11.318
  Start of MODEL   14
10422    H    ASP  85           H        ASP  85 -11.881   5.262   5.213
  Start of MODEL   14
10423    HA   ASP  85           HA       ASP  85 -14.634   4.489   4.752
  Start of MODEL   14
10424    HB2  ASP  85           HB2      ASP  85 -14.906   6.577   5.989
  Start of MODEL   14
10425    HB3  ASP  85           HB3      ASP  85 -13.830   7.403   4.862
  Start of MODEL   14
10426    H    ARG  86           H        ARG  86 -15.330   4.720   2.615
  Start of MODEL   14
10427    HA   ARG  86           HA       ARG  86 -13.440   4.044   0.686
  Start of MODEL   14
10428    HB2  ARG  86           HB2      ARG  86 -15.798   3.423   0.570
  Start of MODEL   14
10429    HB3  ARG  86           HB3      ARG  86 -16.250   5.104   0.351
  Start of MODEL   14
10430    HG2  ARG  86           HG2      ARG  86 -14.937   5.092  -1.775
  Start of MODEL   14
10431    HG3  ARG  86           HG3      ARG  86 -14.740   3.352  -1.566
  Start of MODEL   14
10432    HD2  ARG  86           HD2      ARG  86 -17.271   4.908  -2.005
  Start of MODEL   14
10433    HD3  ARG  86           HD3      ARG  86 -16.595   3.610  -2.988
  Start of MODEL   14
10434    HE   ARG  86           HE       ARG  86 -17.101   2.574  -0.445
  Start of MODEL   14
10435   HH11  ARG  86          HH11      ARG  86 -18.886   3.821  -3.184
  Start of MODEL   14
10436   HH12  ARG  86          HH12      ARG  86 -20.327   2.918  -2.821
  Start of MODEL   14
10437   HH21  ARG  86          HH21      ARG  86 -18.971   1.407   0.056
  Start of MODEL   14
10438   HH22  ARG  86          HH22      ARG  86 -20.381   1.543  -0.960
  Start of MODEL   14
10439    H    ALA  87           H        ALA  87 -15.004   7.158   1.335
  Start of MODEL   14
10440    HA   ALA  87           HA       ALA  87 -14.239   8.377  -1.101
  Start of MODEL   14
10441    HB2  ALA  87           HB1      ALA  87 -14.873   9.747   1.512
  Start of MODEL   14
10442    HB1  ALA  87           HB2      ALA  87 -16.081   9.158   0.371
  Start of MODEL   14
10443    HB3  ALA  87           HB3      ALA  87 -14.972  10.444  -0.108
  Start of MODEL   14
10444    H    SER  88           H        SER  88 -12.810   8.383   2.123
  Start of MODEL   14
10445    HA   SER  88           HA       SER  88 -10.759  10.232   1.609
  Start of MODEL   14
10446    HB2  SER  88           HB2      SER  88 -10.660   7.911   3.540
  Start of MODEL   14
10447    HB3  SER  88           HB3      SER  88  -9.769   9.431   3.646
  Start of MODEL   14
10448    HG   SER  88           HG       SER  88 -12.049  10.360   3.616
  Start of MODEL   14
10449    H    ALA  89           H        ALA  89 -10.935   6.718   1.369
  Start of MODEL   14
10450    HA   ALA  89           HA       ALA  89  -8.258   6.258   0.629
  Start of MODEL   14
10451    HB2  ALA  89           HB1      ALA  89  -9.033   4.070  -0.115
  Start of MODEL   14
10452    HB1  ALA  89           HB2      ALA  89 -10.706   4.619  -0.018
  Start of MODEL   14
10453    HB3  ALA  89           HB3      ALA  89  -9.734   4.490   1.448
  Start of MODEL   14
10454    H    GLU  90           H        GLU  90 -11.179   6.807  -1.295
  Start of MODEL   14
10455    HA   GLU  90           HA       GLU  90  -9.898   6.281  -3.770
  Start of MODEL   14
10456    HB2  GLU  90           HB2      GLU  90 -12.325   6.040  -3.483
  Start of MODEL   14
10457    HB3  GLU  90           HB3      GLU  90 -12.469   7.782  -3.267
  Start of MODEL   14
10458    HG2  GLU  90           HG2      GLU  90 -11.881   8.221  -5.494
  Start of MODEL   14
10459    HG3  GLU  90           HG3      GLU  90 -11.242   6.596  -5.726
  Start of MODEL   14
10460    H    ARG  91           H        ARG  91 -10.533   9.292  -1.965
  Start of MODEL   14
10461    HA   ARG  91           HA       ARG  91  -9.706  11.067  -3.969
  Start of MODEL   14
10462    HB2  ARG  91           HB2      ARG  91  -9.347  11.334  -0.983
  Start of MODEL   14
10463    HB3  ARG  91           HB3      ARG  91  -9.177  12.641  -2.146
  Start of MODEL   14
10464    HG2  ARG  91           HG2      ARG  91 -11.669  11.669  -2.715
  Start of MODEL   14
10465    HG3  ARG  91           HG3      ARG  91 -11.563  11.474  -0.964
  Start of MODEL   14
10466    HD2  ARG  91           HD2      ARG  91 -12.491  13.635  -1.463
  Start of MODEL   14
10467    HD3  ARG  91           HD3      ARG  91 -10.880  13.840  -0.780
  Start of MODEL   14
10468    HE   ARG  91           HE       ARG  91 -10.295  13.901  -3.363
  Start of MODEL   14
10469   HH11  ARG  91          HH11      ARG  91 -12.944  15.467  -1.651
  Start of MODEL   14
10470   HH12  ARG  91          HH12      ARG  91 -13.029  16.796  -2.774
  Start of MODEL   14
10471   HH21  ARG  91          HH21      ARG  91 -10.430  15.661  -4.813
  Start of MODEL   14
10472   HH22  ARG  91          HH22      ARG  91 -11.618  16.903  -4.546
  Start of MODEL   14
10473    H    ALA  92           H        ALA  92  -7.880   9.335  -1.500
  Start of MODEL   14
10474    HA   ALA  92           HA       ALA  92  -5.329  10.307  -2.138
  Start of MODEL   14
10475    HB1  ALA  92           HB1      ALA  92  -6.042   7.570  -1.098
  Start of MODEL   14
10476    HB3  ALA  92           HB2      ALA  92  -5.834   9.015  -0.109
  Start of MODEL   14
10477    HB2  ALA  92           HB3      ALA  92  -4.464   8.348  -1.000
  Start of MODEL   14
10478    H    CYS  93           H        CYS  93  -7.262   7.749  -3.599
  Start of MODEL   14
10479    HA   CYS  93           HA       CYS  93  -5.085   6.765  -5.210
  Start of MODEL   14
10480    HB2  CYS  93           HB2      CYS  93  -8.035   6.125  -5.249
  Start of MODEL   14
10481    HB3  CYS  93           HB3      CYS  93  -6.795   5.259  -6.154
  Start of MODEL   14
10482    HG   CYS  93           HG       CYS  93  -7.184   5.361  -2.760
  Start of MODEL   14
10483    H    LYS  94           H        LYS  94  -7.187   9.383  -5.482
  Start of MODEL   14
10484    HA   LYS  94           HA       LYS  94  -7.777   9.348  -8.228
  Start of MODEL   14
10485    HB2  LYS  94           HB2      LYS  94  -8.958  10.825  -6.706
  Start of MODEL   14
10486    HB3  LYS  94           HB3      LYS  94  -7.473  11.698  -6.351
  Start of MODEL   14
10487    HG2  LYS  94           HG2      LYS  94  -8.910  12.930  -7.898
  Start of MODEL   14
10488    HG3  LYS  94           HG3      LYS  94  -7.365  12.505  -8.634
  Start of MODEL   14
10489    HD2  LYS  94           HD2      LYS  94  -8.469  10.554  -9.704
  Start of MODEL   14
10490    HD3  LYS  94           HD3      LYS  94 -10.010  11.116  -9.057
  Start of MODEL   14
10491    HE2  LYS  94           HE2      LYS  94  -9.720  11.797 -11.383
  Start of MODEL   14
10492    HE3  LYS  94           HE3      LYS  94  -9.791  13.195 -10.311
  Start of MODEL   14
10493    HZ2  LYS  94           HZ1      LYS  94  -8.029  13.260 -12.070
  Start of MODEL   14
10494    HZ1  LYS  94           HZ2      LYS  94  -7.238  12.012 -11.236
  Start of MODEL   14
10495    HZ3  LYS  94           HZ3      LYS  94  -7.476  13.512 -10.485
  Start of MODEL   14
10496    H    ASP  95           H        ASP  95  -4.955  10.619  -6.491
  Start of MODEL   14
10497    HA   ASP  95           HA       ASP  95  -3.706  11.065  -9.123
  Start of MODEL   14
10498    HB2  ASP  95           HB2      ASP  95  -3.846  13.035  -7.485
  Start of MODEL   14
10499    HB3  ASP  95           HB3      ASP  95  -2.655  12.167  -6.519
  Start of MODEL   14
10500    HA   PRO  96           HA       PRO  96  -1.794   7.234  -7.779
  Start of MODEL   14
10501    HB2  PRO  96           HB2      PRO  96  -0.773   6.555 -10.188
  Start of MODEL   14
10502    HB3  PRO  96           HB3      PRO  96  -2.480   6.357  -9.779
  Start of MODEL   14
10503    HG2  PRO  96           HG2      PRO  96  -1.151   8.537 -11.343
  Start of MODEL   14
10504    HG3  PRO  96           HG3      PRO  96  -2.668   7.684 -11.681
  Start of MODEL   14
10505    HD2  PRO  96           HD2      PRO  96  -2.585  10.146 -10.544
  Start of MODEL   14
10506    HD3  PRO  96           HD3      PRO  96  -3.868   8.969 -10.197
  Start of MODEL   14
10507    H    ASN  97           H        ASN  97  -0.244  10.134  -8.564
  Start of MODEL   14
10508    HA   ASN  97           HA       ASN  97   2.405   8.859  -8.241
  Start of MODEL   14
10509    HB2  ASN  97           HB2      ASN  97   1.592  11.144 -10.024
  Start of MODEL   14
10510    HB3  ASN  97           HB3      ASN  97   3.258  10.939  -9.515
  Start of MODEL   14
10511   HD21  ASN  97          HD21      ASN  97   1.324   8.111 -10.038
  Start of MODEL   14
10512   HD22  ASN  97          HD22      ASN  97   2.034   7.646 -11.549
  Start of MODEL   14
10513    HA   PRO  98           HA       PRO  98   1.832  12.221  -4.962
  Start of MODEL   14
10514    HB2  PRO  98           HB2      PRO  98   1.899  10.142  -2.931
  Start of MODEL   14
10515    HB3  PRO  98           HB3      PRO  98   0.665  11.373  -3.219
  Start of MODEL   14
10516    HG2  PRO  98           HG2      PRO  98   0.254   8.726  -3.667
  Start of MODEL   14
10517    HG3  PRO  98           HG3      PRO  98  -0.573  10.005  -4.571
  Start of MODEL   14
10518    HD2  PRO  98           HD2      PRO  98   1.792   8.348  -5.370
  Start of MODEL   14
10519    HD3  PRO  98           HD3      PRO  98   0.389   8.848  -6.337
  Start of MODEL   14
10520    H    ILE  99           H        ILE  99   3.642  13.091  -4.152
  Start of MODEL   14
10521    HA   ILE  99           HA       ILE  99   6.099  11.576  -4.205
  Start of MODEL   14
10522    HB   ILE  99           HB       ILE  99   5.642  14.437  -3.342
  Start of MODEL   14
10523   HD12  ILE  99          HD11      ILE  99   6.612  13.363  -7.352
  Start of MODEL   14
10524   HD11  ILE  99          HD12      ILE  99   6.381  12.081  -6.162
  Start of MODEL   14
10525   HD13  ILE  99          HD13      ILE  99   7.834  13.080  -6.113
  Start of MODEL   14
10526    H    ILE 100           H        ILE 100   6.741  10.369  -2.579
  Start of MODEL   14
10527    HA   ILE 100           HA       ILE 100   6.105  11.221   0.173
  Start of MODEL   14
10528    HB   ILE 100           HB       ILE 100   6.137   8.372  -0.851
  Start of MODEL   14
10529   HD11  ILE 100          HD11      ILE 100   3.495   7.745   0.715
  Start of MODEL   14
10530   HD13  ILE 100          HD12      ILE 100   3.774   7.290  -0.967
  Start of MODEL   14
10531   HD12  ILE 100          HD13      ILE 100   2.379   8.281  -0.543
  Start of MODEL   14
10532    H    ASP 101           H        ASP 101   7.841  11.528   1.375
  Start of MODEL   14
10533    HA   ASP 101           HA       ASP 101   9.975  11.556   2.164
  Start of MODEL   14
10534    HB2  ASP 101           HB2      ASP 101   9.443   9.108   2.486
  Start of MODEL   14
10535    HB3  ASP 101           HB3      ASP 101  10.234   8.793   0.946
  Start of MODEL   14
10536    H    GLY 102           H        GLY 102   9.438  12.697  -0.349
  Start of MODEL   14
10537    HA2  GLY 102           HA2      GLY 102  10.647  13.753  -2.002
  Start of MODEL   14
10538    HA3  GLY 102           HA3      GLY 102  12.089  13.001  -1.347
  Start of MODEL   14
10539    H    ARG 103           H        ARG 103   9.669  10.743  -2.148
  Start of MODEL   14
10540    HA   ARG 103           HA       ARG 103  10.875  10.314  -4.803
  Start of MODEL   14
10541    HB2  ARG 103           HB2      ARG 103  11.886   8.775  -3.135
  Start of MODEL   14
10542    HB3  ARG 103           HB3      ARG 103  10.289   8.129  -2.792
  Start of MODEL   14
10543    HG2  ARG 103           HG2      ARG 103  10.112   7.241  -5.027
  Start of MODEL   14
10544    HG3  ARG 103           HG3      ARG 103  11.627   8.021  -5.491
  Start of MODEL   14
10545    HD2  ARG 103           HD2      ARG 103  12.810   6.643  -3.809
  Start of MODEL   14
10546    HD3  ARG 103           HD3      ARG 103  11.289   5.828  -3.445
  Start of MODEL   14
10547    HE   ARG 103           HE       ARG 103  11.579   5.526  -6.143
  Start of MODEL   14
10548   HH11  ARG 103          HH11      ARG 103  13.595   4.794  -3.380
  Start of MODEL   14
10549   HH12  ARG 103          HH12      ARG 103  14.338   3.414  -4.119
  Start of MODEL   14
10550   HH21  ARG 103          HH21      ARG 103  12.537   3.730  -7.136
  Start of MODEL   14
10551   HH22  ARG 103          HH22      ARG 103  13.721   2.794  -6.276
  Start of MODEL   14
10552    H    LYS 104           H        LYS 104   9.501   9.608  -6.394
  Start of MODEL   14
10553    HA   LYS 104           HA       LYS 104   6.720  10.083  -5.947
  Start of MODEL   14
10554    HB2  LYS 104           HB2      LYS 104   7.680  10.723  -8.059
  Start of MODEL   14
10555    HB3  LYS 104           HB3      LYS 104   8.222   9.078  -8.363
  Start of MODEL   14
10556    HG2  LYS 104           HG2      LYS 104   5.965   8.312  -8.613
  Start of MODEL   14
10557    HG3  LYS 104           HG3      LYS 104   5.334   9.880  -8.109
  Start of MODEL   14
10558    HD2  LYS 104           HD2      LYS 104   7.019   9.423 -10.572
  Start of MODEL   14
10559    HD3  LYS 104           HD3      LYS 104   5.256   9.513 -10.570
  Start of MODEL   14
10560    HE2  LYS 104           HE2      LYS 104   5.372  11.796  -9.687
  Start of MODEL   14
10561    HE3  LYS 104           HE3      LYS 104   7.133  11.702  -9.669
  Start of MODEL   14
10562    HZ1  LYS 104           HZ1      LYS 104   7.052  11.369 -12.103
  Start of MODEL   14
10563    HZ3  LYS 104           HZ2      LYS 104   6.438  12.872 -11.610
  Start of MODEL   14
10564    HZ2  LYS 104           HZ3      LYS 104   5.374  11.632 -12.064
  Start of MODEL   14
10565    H    ALA 105           H        ALA 105   5.272   8.702  -5.289
  Start of MODEL   14
10566    HA   ALA 105           HA       ALA 105   5.823   5.824  -5.463
  Start of MODEL   14
10567    HB2  ALA 105           HB1      ALA 105   4.191   5.583  -3.651
  Start of MODEL   14
10568    HB1  ALA 105           HB2      ALA 105   3.932   7.328  -3.661
  Start of MODEL   14
10569    HB3  ALA 105           HB3      ALA 105   5.503   6.673  -3.200
  Start of MODEL   14
10570    H    ASN 106           H        ASN 106   3.975   4.429  -5.873
  Start of MODEL   14
10571    HA   ASN 106           HA       ASN 106   2.041   5.688  -7.720
  Start of MODEL   14
10572    HB2  ASN 106           HB2      ASN 106   3.268   2.927  -7.739
  Start of MODEL   14
10573    HB3  ASN 106           HB3      ASN 106   1.830   3.323  -8.673
  Start of MODEL   14
10574   HD21  ASN 106          HD21      ASN 106   4.478   2.482  -9.586
  Start of MODEL   14
10575   HD22  ASN 106          HD22      ASN 106   5.029   3.730 -10.642
  Start of MODEL   14
10576    H    VAL 107           H        VAL 107   0.092   5.852  -6.849
  Start of MODEL   14
10577    HA   VAL 107           HA       VAL 107  -0.701   3.859  -4.829
  Start of MODEL   14
10578    HB   VAL 107           HB       VAL 107  -1.451   6.779  -4.982
  Start of MODEL   14
10579    H    ASN 108           H        ASN 108  -2.516   2.780  -5.083
  Start of MODEL   14
10580    HA   ASN 108           HA       ASN 108  -4.811   3.900  -6.376
  Start of MODEL   14
10581    HB2  ASN 108           HB2      ASN 108  -5.080   1.944  -7.960
  Start of MODEL   14
10582    HB3  ASN 108           HB3      ASN 108  -3.836   3.102  -8.398
  Start of MODEL   14
10583   HD21  ASN 108          HD21      ASN 108  -3.406   0.649  -5.891
  Start of MODEL   14
10584   HD22  ASN 108          HD22      ASN 108  -2.246  -0.280  -6.773
  Start of MODEL   14
10585    H    LEU 109           H        LEU 109  -6.736   2.553  -6.009
  Start of MODEL   14
10586    HA   LEU 109           HA       LEU 109  -6.850   1.250  -3.570
  Start of MODEL   14
10587    HB2  LEU 109           HB2      LEU 109  -8.581   0.856  -6.012
  Start of MODEL   14
10588    HB3  LEU 109           HB3      LEU 109  -8.962   0.205  -4.429
  Start of MODEL   14
10589    HG   LEU 109           HG       LEU 109  -8.680   3.147  -5.051
  Start of MODEL   14
10590   HD12  LEU 109          HD11      LEU 109 -11.124   3.218  -4.787
  Start of MODEL   14
10591   HD11  LEU 109          HD12      LEU 109 -11.150   1.456  -4.682
  Start of MODEL   14
10592   HD13  LEU 109          HD13      LEU 109 -10.627   2.244  -6.173
  Start of MODEL   14
10593   HD23  LEU 109          HD21      LEU 109  -9.718   1.740  -2.596
  Start of MODEL   14
10594   HD22  LEU 109          HD22      LEU 109  -9.632   3.483  -2.848
  Start of MODEL   14
10595   HD21  LEU 109          HD23      LEU 109  -8.150   2.534  -2.732
  Start of MODEL   14
10596    H    ALA 110           H        ALA 110  -6.366  -0.737  -2.848
  Start of MODEL   14
10597    HA   ALA 110           HA       ALA 110  -4.398  -2.137  -4.248
  Start of MODEL   14
10598    HB2  ALA 110           HB1      ALA 110  -5.973  -3.084  -1.857
  Start of MODEL   14
10599    HB1  ALA 110           HB2      ALA 110  -4.554  -2.034  -1.799
  Start of MODEL   14
10600    HB3  ALA 110           HB3      ALA 110  -4.405  -3.692  -2.391
  Start of MODEL   14
10601    H    TYR 111           H        TYR 111  -7.857  -2.715  -4.067
  Start of MODEL   14
10602    HA   TYR 111           HA       TYR 111  -7.720  -5.431  -4.908
  Start of MODEL   14
10603    HB2  TYR 111           HB2      TYR 111 -10.048  -5.444  -4.864
  Start of MODEL   14
10604    HB3  TYR 111           HB3      TYR 111  -9.651  -4.196  -3.690
  Start of MODEL   14
10605    HD1  TYR 111           HD1      TYR 111  -9.431  -1.771  -4.817
  Start of MODEL   14
10606    HD2  TYR 111           HD2      TYR 111 -11.782  -4.979  -6.318
  Start of MODEL   14
10607    HE1  TYR 111           HE1      TYR 111 -10.845  -0.161  -6.014
  Start of MODEL   14
10608    HE2  TYR 111           HE2      TYR 111 -13.205  -3.378  -7.525
  Start of MODEL   14
10609    HH   TYR 111           HH       TYR 111 -12.348  -0.124  -7.956
  Start of MODEL   14
10610    H    LEU 112           H        LEU 112  -7.411  -2.479  -6.594
  Start of MODEL   14
10611    HA   LEU 112           HA       LEU 112  -8.349  -3.394  -9.138
  Start of MODEL   14
10612    HB2  LEU 112           HB2      LEU 112  -6.663  -1.034  -8.334
  Start of MODEL   14
10613    HB3  LEU 112           HB3      LEU 112  -7.145  -1.351  -9.992
  Start of MODEL   14
10614    HG   LEU 112           HG       LEU 112  -8.998  -0.807  -7.676
  Start of MODEL   14
10615   HD13  LEU 112          HD11      LEU 112  -7.837   1.183  -8.435
  Start of MODEL   14
10616   HD12  LEU 112          HD12      LEU 112  -9.530   1.234  -8.923
  Start of MODEL   14
10617   HD11  LEU 112          HD13      LEU 112  -8.286   0.831 -10.104
  Start of MODEL   14
10618   HD21  LEU 112          HD21      LEU 112  -9.972  -2.406  -9.208
  Start of MODEL   14
10619   HD23  LEU 112          HD22      LEU 112  -9.587  -1.363 -10.577
  Start of MODEL   14
10620   HD22  LEU 112          HD23      LEU 112 -10.769  -0.839  -9.376
  Start of MODEL   14
10621    H    GLY 113           H        GLY 113  -5.593  -4.187  -7.420
  Start of MODEL   14
10622    HA2  GLY 113           HA2      GLY 113  -4.324  -5.202  -9.854
  Start of MODEL   14
10623    HA3  GLY 113           HA3      GLY 113  -3.363  -4.138  -8.832
  Start of MODEL   14
10624    H    ALA 114           H        ALA 114  -5.608  -6.042  -7.139
  Start of MODEL   14
10625    HA   ALA 114           HA       ALA 114  -3.494  -7.424  -5.786
  Start of MODEL   14
10626    HB3  ALA 114           HB1      ALA 114  -5.417  -6.587  -4.545
  Start of MODEL   14
10627    HB2  ALA 114           HB2      ALA 114  -5.275  -8.335  -4.373
  Start of MODEL   14
10628    HB1  ALA 114           HB3      ALA 114  -6.484  -7.656  -5.460
  Start of MODEL   14
10629    H    LYS 115           H        LYS 115  -3.127  -9.613  -5.697
  Start of MODEL   14
10630    HA   LYS 115           HA       LYS 115  -3.445 -11.039  -8.109
  Start of MODEL   14
10631    HB2  LYS 115           HB2      LYS 115  -2.553 -11.962  -5.371
  Start of MODEL   14
10632    HB3  LYS 115           HB3      LYS 115  -2.461 -12.943  -6.827
  Start of MODEL   14
10633    HG2  LYS 115           HG2      LYS 115  -1.067 -10.302  -6.462
  Start of MODEL   14
10634    HG3  LYS 115           HG3      LYS 115  -0.321 -11.883  -6.216
  Start of MODEL   14
10635    HD2  LYS 115           HD2      LYS 115  -0.822 -12.464  -8.549
  Start of MODEL   14
10636    HD3  LYS 115           HD3      LYS 115  -1.520 -10.862  -8.788
  Start of MODEL   14
10637    HE2  LYS 115           HE2      LYS 115   0.607  -9.823  -8.380
  Start of MODEL   14
10638    HE3  LYS 115           HE3      LYS 115   1.325 -11.374  -7.948
  Start of MODEL   14
10639    HZ2  LYS 115           HZ1      LYS 115   1.928 -10.808 -10.194
  Start of MODEL   14
10640    HZ1  LYS 115           HZ2      LYS 115   0.299 -10.588 -10.625
  Start of MODEL   14
10641    HZ3  LYS 115           HZ3      LYS 115   0.871 -12.134 -10.226
  Start of MODEL   14
10642    HA   PRO 116           HA       PRO 116  -7.462 -12.789  -7.214
  Start of MODEL   14
10643    HB2  PRO 116           HB2      PRO 116  -7.795 -14.063  -9.548
  Start of MODEL   14
10644    HB3  PRO 116           HB3      PRO 116  -7.868 -12.300  -9.439
  Start of MODEL   14
10645    HG2  PRO 116           HG2      PRO 116  -5.625 -14.046 -10.375
  Start of MODEL   14
10646    HG3  PRO 116           HG3      PRO 116  -6.214 -12.517 -11.049
  Start of MODEL   14
10647    HD2  PRO 116           HD2      PRO 116  -4.016 -12.744  -9.407
  Start of MODEL   14
10648    HD3  PRO 116           HD3      PRO 116  -4.975 -11.264  -9.601
  Start of MODEL   14
10649    H    ARG 117           H        ARG 117  -4.945 -14.088  -6.339
  Start of MODEL   14
10650    HA   ARG 117           HA       ARG 117  -5.951 -16.765  -6.034
  Start of MODEL   14
10651    HB2  ARG 117           HB2      ARG 117  -4.741 -16.976  -8.158
  Start of MODEL   14
10652    HB3  ARG 117           HB3      ARG 117  -3.295 -16.317  -7.404
  Start of MODEL   14
10653    HG2  ARG 117           HG2      ARG 117  -3.205 -18.752  -7.621
  Start of MODEL   14
10654    HG3  ARG 117           HG3      ARG 117  -3.143 -18.235  -5.935
  Start of MODEL   14
10655    HD2  ARG 117           HD2      ARG 117  -5.621 -18.633  -5.837
  Start of MODEL   14
10656    HD3  ARG 117           HD3      ARG 117  -5.496 -19.377  -7.429
  Start of MODEL   14
10657    HE   ARG 117           HE       ARG 117  -3.681 -20.753  -6.017
  Start of MODEL   14
10658   HH11  ARG 117          HH11      ARG 117  -7.024 -19.941  -5.398
  Start of MODEL   14
10659   HH12  ARG 117          HH12      ARG 117  -7.320 -21.340  -4.422
  Start of MODEL   14
10660   HH21  ARG 117          HH21      ARG 117  -4.059 -22.619  -4.758
  Start of MODEL   14
10661   HH22  ARG 117          HH22      ARG 117  -5.625 -22.861  -4.039
  Start of MODEL   14
10662    H    THR 118           H        THR 118  -5.924 -16.664  -3.884
  Start of MODEL   14
10663    HA   THR 118           HA       THR 118  -3.377 -16.724  -2.554
  Start of MODEL   14
10664    HB   THR 118           HB       THR 118  -3.850 -14.283  -2.659
  Start of MODEL   14
10665    HG1  THR 118           HG1      THR 118  -3.691 -13.983  -0.318
  Start of MODEL   14
10666   HG21  THR 118          HG21      THR 118  -6.277 -14.993  -1.008
  Start of MODEL   14
10667   HG23  THR 118          HG22      THR 118  -6.283 -14.327  -2.640
  Start of MODEL   14
10668   HG22  THR 118          HG23      THR 118  -5.683 -13.359  -1.296
  Start of MODEL   14
10669    H    ASN 119           H        ASN 119  -3.832 -16.996  -0.081
  Start of MODEL   14
10670    HA   ASN 119           HA       ASN 119  -6.331 -18.449   0.405
  Start of MODEL   14
10671    HB2  ASN 119           HB2      ASN 119  -3.595 -19.634   0.959
  Start of MODEL   14
10672    HB3  ASN 119           HB3      ASN 119  -5.131 -20.362   1.400
  Start of MODEL   14
10673   HD21  ASN 119          HD21      ASN 119  -2.891 -19.718  -1.145
  Start of MODEL   14
10674   HD22  ASN 119          HD22      ASN 119  -3.638 -20.709  -2.343
  Start of MODEL   14
10675    H    VAL 120           H        VAL 120  -3.196 -17.662   1.892
  Start of MODEL   14
10676    HA   VAL 120           HA       VAL 120  -2.612 -16.490   3.732
  Start of MODEL   14
10677    HB   VAL 120           HB       VAL 120  -5.449 -15.449   3.846
  Start of MODEL   14
10678    H    GLN 121           H        GLN 121  -3.469 -19.171   3.996
  Start of MODEL   14
10679    HA   GLN 121           HA       GLN 121  -3.533 -19.232   6.836
  Start of MODEL   14
10680    HB2  GLN 121           HB2      GLN 121  -6.008 -18.974   6.193
  Start of MODEL   14
10681    HB3  GLN 121           HB3      GLN 121  -5.886 -20.603   5.539
  Start of MODEL   14
10682    HG2  GLN 121           HG2      GLN 121  -5.118 -21.372   7.781
  Start of MODEL   14
10683    HG3  GLN 121           HG3      GLN 121  -5.460 -19.755   8.393
  Start of MODEL   14
10684   HE21  GLN 121          HE21      GLN 121  -6.612 -22.262   9.200
  Start of MODEL   14
10685   HE22  GLN 121          HE22      GLN 121  -8.316 -22.146   8.934
  Start of MODEL   14
10686    H5'   DG   1           H5'       DG   1  21.439  -4.721  -2.140
  Start of MODEL   14
10687    H4'   DG   1           H4'       DG   1  19.975  -5.973  -3.834
  Start of MODEL   14
10688    H3'   DG   1           H3'       DG   1  19.485  -3.643  -5.062
  Start of MODEL   14
10689    H2'   DG   1           H2'       DG   1  18.428  -2.466  -3.271
  Start of MODEL   14
10690    H1'   DG   1           H1'       DG   1  16.939  -4.996  -2.452
  Start of MODEL   14
10691    H8    DG   1           H8        DG   1  19.158  -2.114  -1.103
  Start of MODEL   14
10692    H1    DG   1           H1        DG   1  14.369  -4.039   2.709
  Start of MODEL   14
10693    H22   DG   1           H21       DG   1  13.769  -6.393   0.227
  Start of MODEL   14
10694    H21   DG   1           H22       DG   1  13.292  -5.731   1.774
  Start of MODEL   14
10695   HO5'   DG   1           H5T       DG   1  20.051  -2.773  -2.460
  Start of MODEL   14
10696   H5''   DG   1          5H''       DG   1  21.766  -4.519  -3.871
  Start of MODEL   14
10697   H2''   DG   1          2H''       DG   1  17.023  -3.199  -4.028
  Start of MODEL   14
10698    H5'   DG   2           H5'       DG   2  15.040  -5.150  -5.839
  Start of MODEL   14
10699    H4'   DG   2           H4'       DG   2  13.424  -4.838  -7.817
  Start of MODEL   14
10700    H3'   DG   2           H3'       DG   2  15.453  -3.861  -9.289
  Start of MODEL   14
10701    H2'   DG   2           H2'       DG   2  15.993  -2.018  -7.792
  Start of MODEL   14
10702    H1'   DG   2           H1'       DG   2  12.959  -1.565  -7.634
  Start of MODEL   14
10703    H8    DG   2           H8        DG   2  16.324  -0.511  -6.329
  Start of MODEL   14
10704    H1    DG   2           H1        DG   2  11.405   1.129  -2.549
  Start of MODEL   14
10705    H22   DG   2           H21       DG   2   9.556  -0.953  -4.621
  Start of MODEL   14
10706    H21   DG   2           H22       DG   2   9.560   0.130  -3.248
  Start of MODEL   14
10707   H5''   DG   2          5H''       DG   2  15.413  -5.896  -7.408
  Start of MODEL   14
10708   H2''   DG   2          2H''       DG   2  14.969  -1.244  -8.997
  Start of MODEL   14
10709    H5'   DT   3           H5'       DT   3  11.235  -4.712  -8.164
  Start of MODEL   14
10710    H4'   DT   3           H4'       DT   3   8.959  -5.905  -8.445
  Start of MODEL   14
10711    H3'   DT   3           H3'       DT   3   9.325  -5.950 -11.100
  Start of MODEL   14
10712    H2'   DT   3           H2'       DT   3   9.583  -3.541 -11.350
  Start of MODEL   14
10713    H1'   DT   3           H1'       DT   3   7.142  -3.329  -9.498
  Start of MODEL   14
10714    H3    DT   3           H3        DT   3   7.758   1.002 -11.232
  Start of MODEL   14
10715    H71   DT   3           H71       DT   3  10.724   1.722  -7.843
  Start of MODEL   14
10716    H73   DT   3           H72       DT   3  11.451   0.117  -7.589
  Start of MODEL   14
10717    H72   DT   3           H73       DT   3  10.035   0.616  -6.633
  Start of MODEL   14
10718    H6    DT   3           H6        DT   3   9.765  -1.879  -8.002
  Start of MODEL   14
10719   H5''   DT   3          5H''       DT   3  11.163  -6.251  -9.045
  Start of MODEL   14
10720   H2''   DT   3          2H''       DT   3   7.896  -3.805 -11.785
  Start of MODEL   14
10721    H5'   DG   4           H5'       DG   4   5.457  -7.779  -9.523
  Start of MODEL   14
10722    H4'   DG   4           H4'       DG   4   5.676  -6.405  -7.820
  Start of MODEL   14
10723    H3'   DG   4           H3'       DG   4   2.824  -6.122  -8.237
  Start of MODEL   14
10724    H2'   DG   4           H2'       DG   4   2.777  -3.798  -8.263
  Start of MODEL   14
10725    H1'   DG   4           H1'       DG   4   5.652  -3.705  -7.241
  Start of MODEL   14
10726    H8    DG   4           H8        DG   4   6.312  -1.277  -7.425
  Start of MODEL   14
10727    H1    DG   4           H1        DG   4   2.755  -0.400 -12.693
  Start of MODEL   14
10728    H22   DG   4           H21       DG   4   1.842  -3.721 -12.254
  Start of MODEL   14
10729    H21   DG   4           H22       DG   4   1.686  -2.265 -13.208
  Start of MODEL   14
10730   H5''   DG   4          5H''       DG   4   3.756  -7.299  -9.657
  Start of MODEL   14
10731   H2''   DG   4          2H''       DG   4   3.375  -3.860  -6.606
  Start of MODEL   14
10732    H5'   DT   5           H5'       DT   5   3.870  -7.338  -3.387
  Start of MODEL   14
10733    H4'   DT   5           H4'       DT   5   2.567  -7.559  -1.487
  Start of MODEL   14
10734    H3'   DT   5           H3'       DT   5   1.267  -9.689  -2.491
  Start of MODEL   14
10735    H2'   DT   5           H2'       DT   5  -0.122  -8.489  -4.065
  Start of MODEL   14
10736    H1'   DT   5           H1'       DT   5  -0.586  -6.410  -1.869
  Start of MODEL   14
10737    H3    DT   5           H3        DT   5  -3.264  -4.064  -4.562
  Start of MODEL   14
10738    H71   DT   5           H71       DT   5  -0.454  -4.577  -8.174
  Start of MODEL   14
10739    H72   DT   5           H72       DT   5   0.939  -3.912  -7.290
  Start of MODEL   14
10740    H73   DT   5           H73       DT   5   0.833  -5.663  -7.597
  Start of MODEL   14
10741    H6    DT   5           H6        DT   5   0.941  -6.204  -5.205
  Start of MODEL   14
10742   H5''   DT   5          5H''       DT   5   3.236  -8.995  -3.487
  Start of MODEL   14
10743   H2''   DT   5          2H''       DT   5  -1.188  -8.604  -2.665
  Start of MODEL   14
10744    H5'   DG   6           H5'       DG   6   2.686  -7.475   1.881
  Start of MODEL   14
10745    H4'   DG   6           H4'       DG   6   3.182  -8.268   4.258
  Start of MODEL   14
10746    H3'   DG   6           H3'       DG   6   1.490 -10.351   3.831
  Start of MODEL   14
10747    H2'   DG   6           H2'       DG   6  -0.562  -9.157   3.728
  Start of MODEL   14
10748    H1'   DG   6           H1'       DG   6   0.441  -7.188   5.836
  Start of MODEL   14
10749    H8    DG   6           H8        DG   6  -1.226  -7.537   2.367
  Start of MODEL   14
10750    H1    DG   6           H1        DG   6  -3.464  -2.778   6.057
  Start of MODEL   14
10751    H22   DG   6           H21       DG   6  -1.006  -3.789   8.289
  Start of MODEL   14
10752    H21   DG   6           H22       DG   6  -2.317  -2.682   7.942
  Start of MODEL   14
10753   H5''   DG   6          5H''       DG   6   3.270  -9.129   2.141
  Start of MODEL   14
10754   H2''   DG   6          2H''       DG   6  -0.460  -9.376   5.467
  Start of MODEL   14
10755    H5'   DC   7           H5'       DC   7  -0.248 -12.510   4.205
  Start of MODEL   14
10756    H4'   DC   7           H4'       DC   7  -1.430 -14.018   5.962
  Start of MODEL   14
10757    H3'   DC   7           H3'       DC   7   0.539 -13.352   7.689
  Start of MODEL   14
10758   HO3'   DC   7           H3T       DC   7  -0.678 -14.641   8.754
  Start of MODEL   14
10759    H2'   DC   7           H2'       DC   7   2.389 -14.285   6.504
  Start of MODEL   14
10760    H1'   DC   7           H1'       DC   7   0.657 -16.667   5.693
  Start of MODEL   14
10761    H42   DC   7           H41       DC   7   5.407 -16.029   1.109
  Start of MODEL   14
10762    H41   DC   7           H42       DC   7   5.375 -17.711   1.598
  Start of MODEL   14
10763    H5    DC   7           H5        DC   7   3.980 -14.337   2.124
  Start of MODEL   14
10764    H6    DC   7           H6        DC   7   2.267 -13.928   3.813
  Start of MODEL   14
10765   H5''   DC   7          5H''       DC   7  -0.806 -11.840   5.752
  Start of MODEL   14
10766   H2''   DC   7          2H''       DC   7   1.923 -15.673   7.478
  Start of MODEL   15
10767    H1   GLY  25           HT1      GLY  25 -13.491  -9.835  -2.668
  Start of MODEL   15
10768    H2   GLY  25           HT2      GLY  25 -13.425  -9.517  -4.333
  Start of MODEL   15
10769    H3   GLY  25           HT3      GLY  25 -12.950  -8.330  -3.222
  Start of MODEL   15
10770    HA3  GLY  25           HA2      GLY  25 -11.082  -9.643  -2.514
  Start of MODEL   15
10771    HA2  GLY  25           HA3      GLY  25 -11.023  -9.373  -4.249
  Start of MODEL   15
10772    H    ALA  26           H        ALA  26 -11.926 -11.105  -5.630
  Start of MODEL   15
10773    HA   ALA  26           HA       ALA  26 -11.862 -13.229  -6.399
  Start of MODEL   15
10774    HB1  ALA  26           HB1      ALA  26 -10.277 -13.849  -3.909
  Start of MODEL   15
10775    HB3  ALA  26           HB2      ALA  26  -9.612 -13.356  -5.467
  Start of MODEL   15
10776    HB2  ALA  26           HB3      ALA  26 -10.452 -14.900  -5.315
  Start of MODEL   15
10777    H    MET  27           H        MET  27 -11.871 -14.296  -3.032
  Start of MODEL   15
10778    HA   MET  27           HA       MET  27 -14.498 -15.502  -3.565
  Start of MODEL   15
10779    HB2  MET  27           HB2      MET  27 -12.556 -16.233  -1.362
  Start of MODEL   15
10780    HB3  MET  27           HB3      MET  27 -14.003 -17.113  -1.834
  Start of MODEL   15
10781    HG2  MET  27           HG2      MET  27 -11.484 -16.783  -3.440
  Start of MODEL   15
10782    HG3  MET  27           HG3      MET  27 -12.045 -18.248  -2.641
  Start of MODEL   15
10783    HE2  MET  27           HE1      MET  27 -15.261 -19.092  -4.765
  Start of MODEL   15
10784    HE1  MET  27           HE2      MET  27 -15.163 -18.163  -3.265
  Start of MODEL   15
10785    HE3  MET  27           HE3      MET  27 -14.214 -19.638  -3.454
  Start of MODEL   15
10786    H    GLY  28           H        GLY  28 -15.496 -13.431  -3.159
  Start of MODEL   15
10787    HA2  GLY  28           HA2      GLY  28 -16.808 -12.124  -1.762
  Start of MODEL   15
10788    HA3  GLY  28           HA3      GLY  28 -16.235 -13.077  -0.398
  Start of MODEL   15
10789    H    SER  29           H        SER  29 -15.720 -11.432   0.973
  Start of MODEL   15
10790    HA   SER  29           HA       SER  29 -14.455  -9.831   1.951
  Start of MODEL   15
10791    HB2  SER  29           HB2      SER  29 -12.637 -11.440   1.258
  Start of MODEL   15
10792    HB3  SER  29           HB3      SER  29 -12.373 -10.422  -0.157
  Start of MODEL   15
10793    HG   SER  29           HG       SER  29 -11.314 -10.124   2.199
  Start of MODEL   15
10794    H    ARG  30           H        ARG  30 -15.798  -8.112   1.445
  Start of MODEL   15
10795    HA   ARG  30           HA       ARG  30 -14.906  -6.428  -0.797
  Start of MODEL   15
10796    HB2  ARG  30           HB2      ARG  30 -17.122  -5.464  -0.901
  Start of MODEL   15
10797    HB3  ARG  30           HB3      ARG  30 -17.249  -7.213  -1.018
  Start of MODEL   15
10798    HG2  ARG  30           HG2      ARG  30 -17.636  -5.733   1.570
  Start of MODEL   15
10799    HG3  ARG  30           HG3      ARG  30 -18.950  -6.041   0.436
  Start of MODEL   15
10800    HD2  ARG  30           HD2      ARG  30 -18.839  -8.347   0.748
  Start of MODEL   15
10801    HD3  ARG  30           HD3      ARG  30 -17.211  -8.270   1.415
  Start of MODEL   15
10802    HE   ARG  30           HE       ARG  30 -18.811  -6.867   3.176
  Start of MODEL   15
10803   HH11  ARG  30          HH11      ARG  30 -18.849 -10.095   1.835
  Start of MODEL   15
10804   HH12  ARG  30          HH12      ARG  30 -19.351 -10.855   3.319
  Start of MODEL   15
10805   HH21  ARG  30          HH21      ARG  30 -19.491  -7.852   5.141
  Start of MODEL   15
10806   HH22  ARG  30          HH22      ARG  30 -19.735  -9.576   5.189
  Start of MODEL   15
10807    H    ASP  31           H        ASP  31 -14.898  -6.750   2.487
  Start of MODEL   15
10808    HA   ASP  31           HA       ASP  31 -15.504  -4.145   3.376
  Start of MODEL   15
10809    HB2  ASP  31           HB2      ASP  31 -15.510  -6.177   4.803
  Start of MODEL   15
10810    HB3  ASP  31           HB3      ASP  31 -13.759  -6.247   4.672
  Start of MODEL   15
10811    H    THR  32           H        THR  32 -12.658  -5.591   2.060
  Start of MODEL   15
10812    HA   THR  32           HA       THR  32 -11.062  -3.195   2.683
  Start of MODEL   15
10813    HB   THR  32           HB       THR  32  -9.144  -4.687   1.811
  Start of MODEL   15
10814    HG1  THR  32           HG1      THR  32 -10.504  -6.922   2.626
  Start of MODEL   15
10815   HG21  THR  32          HG21      THR  32  -9.519  -4.083   4.182
  Start of MODEL   15
10816   HG23  THR  32          HG22      THR  32  -8.837  -5.696   3.978
  Start of MODEL   15
10817   HG22  THR  32          HG23      THR  32 -10.552  -5.505   4.348
  Start of MODEL   15
10818    H    MET  33           H        MET  33 -12.913  -4.375   0.178
  Start of MODEL   15
10819    HA   MET  33           HA       MET  33 -11.302  -4.268  -2.033
  Start of MODEL   15
10820    HB2  MET  33           HB2      MET  33 -14.218  -3.828  -1.639
  Start of MODEL   15
10821    HB3  MET  33           HB3      MET  33 -13.513  -3.484  -3.214
  Start of MODEL   15
10822    HG2  MET  33           HG2      MET  33 -12.656  -5.749  -3.346
  Start of MODEL   15
10823    HG3  MET  33           HG3      MET  33 -13.317  -6.107  -1.751
  Start of MODEL   15
10824    HE1  MET  33           HE1      MET  33 -14.123  -5.246  -5.487
  Start of MODEL   15
10825    HE3  MET  33           HE2      MET  33 -14.993  -3.969  -4.636
  Start of MODEL   15
10826    HE2  MET  33           HE3      MET  33 -15.888  -5.224  -5.491
  Start of MODEL   15
10827    H    PHE  34           H        PHE  34 -13.142  -1.448  -0.718
  Start of MODEL   15
10828    HA   PHE  34           HA       PHE  34 -11.616   0.166  -2.635
  Start of MODEL   15
10829    HB2  PHE  34           HB2      PHE  34 -14.240   0.678  -1.235
  Start of MODEL   15
10830    HB3  PHE  34           HB3      PHE  34 -13.359   1.927  -2.105
  Start of MODEL   15
10831    HD1  PHE  34           HD1      PHE  34 -15.186  -1.237  -2.430
  Start of MODEL   15
10832    HD2  PHE  34           HD2      PHE  34 -13.376   2.018  -4.490
  Start of MODEL   15
10833    HE1  PHE  34           HE1      PHE  34 -16.278  -1.960  -4.508
  Start of MODEL   15
10834    HE2  PHE  34           HE2      PHE  34 -14.471   1.307  -6.575
  Start of MODEL   15
10835    HZ   PHE  34           HZ       PHE  34 -15.902  -0.635  -6.618
  Start of MODEL   15
10836    H    THR  35           H        THR  35 -11.396  -0.793   0.458
  Start of MODEL   15
10837    HA   THR  35           HA       THR  35 -10.659   1.850   1.492
  Start of MODEL   15
10838    HB   THR  35           HB       THR  35 -10.732   0.677   3.735
  Start of MODEL   15
10839    HG1  THR  35           HG1      THR  35 -12.148  -1.315   3.509
  Start of MODEL   15
10840   HG23  THR  35          HG21      THR  35 -13.147   0.789   3.901
  Start of MODEL   15
10841   HG22  THR  35          HG22      THR  35 -13.310   0.622   2.154
  Start of MODEL   15
10842   HG21  THR  35          HG23      THR  35 -12.592   2.082   2.834
  Start of MODEL   15
10843    H    LYS  36           H        LYS  36  -9.384  -1.368   0.815
  Start of MODEL   15
10844    HA   LYS  36           HA       LYS  36  -6.925  -0.866   2.229
  Start of MODEL   15
10845    HB2  LYS  36           HB2      LYS  36  -7.848  -3.117   2.149
  Start of MODEL   15
10846    HB3  LYS  36           HB3      LYS  36  -7.864  -3.087   0.396
  Start of MODEL   15
10847    HG2  LYS  36           HG2      LYS  36  -5.427  -3.076   0.365
  Start of MODEL   15
10848    HG3  LYS  36           HG3      LYS  36  -5.404  -3.076   2.134
  Start of MODEL   15
10849    HD2  LYS  36           HD2      LYS  36  -6.514  -5.221   2.198
  Start of MODEL   15
10850    HD3  LYS  36           HD3      LYS  36  -6.721  -5.206   0.447
  Start of MODEL   15
10851    HE2  LYS  36           HE2      LYS  36  -4.337  -5.357   0.124
  Start of MODEL   15
10852    HE3  LYS  36           HE3      LYS  36  -4.053  -5.225   1.856
  Start of MODEL   15
10853    HZ3  LYS  36           HZ1      LYS  36  -5.231  -7.333   2.154
  Start of MODEL   15
10854    HZ2  LYS  36           HZ2      LYS  36  -3.888  -7.513   1.147
  Start of MODEL   15
10855    HZ1  LYS  36           HZ3      LYS  36  -5.441  -7.467   0.482
  Start of MODEL   15
10856    H    ILE  37           H        ILE  37  -5.509   0.471   1.409
  Start of MODEL   15
10857    HA   ILE  37           HA       ILE  37  -5.339   0.837  -1.499
  Start of MODEL   15
10858    HB   ILE  37           HB       ILE  37  -4.316   2.539   0.780
  Start of MODEL   15
10859   HD13  ILE  37          HD11      ILE  37  -5.598   4.773   1.006
  Start of MODEL   15
10860   HD12  ILE  37          HD12      ILE  37  -6.997   5.047  -0.031
  Start of MODEL   15
10861   HD11  ILE  37          HD13      ILE  37  -5.372   5.110  -0.708
  Start of MODEL   15
10862    H    PHE  38           H        PHE  38  -3.596   0.222  -2.599
  Start of MODEL   15
10863    HA   PHE  38           HA       PHE  38  -1.320  -0.862  -1.117
  Start of MODEL   15
10864    HB2  PHE  38           HB2      PHE  38  -2.267  -2.318  -2.850
  Start of MODEL   15
10865    HB3  PHE  38           HB3      PHE  38  -2.030  -1.054  -4.053
  Start of MODEL   15
10866    HD1  PHE  38           HD1      PHE  38  -0.165  -1.174  -5.385
  Start of MODEL   15
10867    HD2  PHE  38           HD2      PHE  38  -0.056  -2.973  -1.527
  Start of MODEL   15
10868    HE1  PHE  38           HE1      PHE  38   2.085  -2.040  -5.856
  Start of MODEL   15
10869    HE2  PHE  38           HE2      PHE  38   2.202  -3.837  -1.993
  Start of MODEL   15
10870    HZ   PHE  38           HZ       PHE  38   3.282  -3.367  -4.134
  Start of MODEL   15
10871    H    VAL  39           H        VAL  39   0.464   0.333  -0.898
  Start of MODEL   15
10872    HA   VAL  39           HA       VAL  39   0.756   2.677  -2.641
  Start of MODEL   15
10873    HB   VAL  39           HB       VAL  39   2.315   2.212  -0.117
  Start of MODEL   15
10874    H    GLY  40           H        GLY  40   2.361   2.733  -4.062
  Start of MODEL   15
10875    HA2  GLY  40           HA2      GLY  40   4.393   0.590  -3.920
  Start of MODEL   15
10876    HA3  GLY  40           HA3      GLY  40   3.534   0.945  -5.414
  Start of MODEL   15
10877    H    GLY  41           H        GLY  41   6.356   0.986  -5.030
  Start of MODEL   15
10878    HA2  GLY  41           HA2      GLY  41   8.021   2.265  -5.999
  Start of MODEL   15
10879    HA3  GLY  41           HA3      GLY  41   6.857   3.564  -6.212
  Start of MODEL   15
10880    H    LEU  42           H        LEU  42   6.853   2.416  -3.070
  Start of MODEL   15
10881    HA   LEU  42           HA       LEU  42   7.845   4.826  -1.973
  Start of MODEL   15
10882    HB2  LEU  42           HB2      LEU  42   7.244   2.140  -0.743
  Start of MODEL   15
10883    HB3  LEU  42           HB3      LEU  42   7.761   3.524   0.198
  Start of MODEL   15
10884    HG   LEU  42           HG       LEU  42   5.238   3.355  -1.447
  Start of MODEL   15
10885   HD13  LEU  42          HD11      LEU  42   5.162   1.949   0.536
  Start of MODEL   15
10886   HD12  LEU  42          HD12      LEU  42   4.111   3.354   0.725
  Start of MODEL   15
10887   HD11  LEU  42          HD13      LEU  42   5.678   3.307   1.535
  Start of MODEL   15
10888   HD23  LEU  42          HD21      LEU  42   6.202   5.522   0.418
  Start of MODEL   15
10889   HD22  LEU  42          HD22      LEU  42   4.662   5.493  -0.446
  Start of MODEL   15
10890   HD21  LEU  42          HD23      LEU  42   6.177   5.627  -1.340
  Start of MODEL   15
10891    HA   PRO  43           HA       PRO  43  12.189   3.793  -1.891
  Start of MODEL   15
10892    HB2  PRO  43           HB2      PRO  43  12.967   5.742  -0.158
  Start of MODEL   15
10893    HB3  PRO  43           HB3      PRO  43  12.631   6.057  -1.864
  Start of MODEL   15
10894    HG2  PRO  43           HG2      PRO  43  10.896   6.519   0.528
  Start of MODEL   15
10895    HG3  PRO  43           HG3      PRO  43  11.145   7.550  -0.895
  Start of MODEL   15
10896    HD2  PRO  43           HD2      PRO  43   8.967   5.958  -0.586
  Start of MODEL   15
10897    HD3  PRO  43           HD3      PRO  43   9.653   6.351  -2.174
  Start of MODEL   15
10898    H    TYR  44           H        TYR  44  13.622   2.822  -0.382
  Start of MODEL   15
10899    HA   TYR  44           HA       TYR  44  12.300   1.240   1.525
  Start of MODEL   15
10900    HB2  TYR  44           HB2      TYR  44  15.255   1.698   1.101
  Start of MODEL   15
10901    HB3  TYR  44           HB3      TYR  44  14.579   0.449   2.142
  Start of MODEL   15
10902    HD1  TYR  44           HD1      TYR  44  12.397  -0.663   0.609
  Start of MODEL   15
10903    HD2  TYR  44           HD2      TYR  44  16.207   0.663  -0.747
  Start of MODEL   15
10904    HE1  TYR  44           HE1      TYR  44  12.238  -2.180  -1.320
  Start of MODEL   15
10905    HE2  TYR  44           HE2      TYR  44  16.059  -0.852  -2.683
  Start of MODEL   15
10906    HH   TYR  44           HH       TYR  44  13.165  -2.381  -3.580
  Start of MODEL   15
10907    H    HIS  45           H        HIS  45  13.592   4.383   1.805
  Start of MODEL   15
10908    HA   HIS  45           HA       HIS  45  14.070   4.353   4.617
  Start of MODEL   15
10909    HB2  HIS  45           HB2      HIS  45  13.293   6.860   3.162
  Start of MODEL   15
10910    HB3  HIS  45           HB3      HIS  45  14.372   6.677   4.530
  Start of MODEL   15
10911    HD1  HIS  45           HD1      HIS  45  16.831   6.019   4.020
  Start of MODEL   15
10912    HD2  HIS  45           HD2      HIS  45  14.421   6.574   0.678
  Start of MODEL   15
10913    HE1  HIS  45           HE1      HIS  45  18.409   6.206   2.073
  Start of MODEL   15
10914    HE2  HIS  45           HE2      HIS  45  16.940   6.816   0.118
  Start of MODEL   15
10915    H    THR  46           H        THR  46  11.159   4.732   2.712
  Start of MODEL   15
10916    HA   THR  46           HA       THR  46   9.603   6.216   4.422
  Start of MODEL   15
10917    HB   THR  46           HB       THR  46   8.684   3.919   2.685
  Start of MODEL   15
10918    HG1  THR  46           HG1      THR  46   9.693   6.423   2.125
  Start of MODEL   15
10919   HG22  THR  46          HG21      THR  46   6.574   5.161   2.557
  Start of MODEL   15
10920   HG21  THR  46          HG22      THR  46   7.212   6.368   3.671
  Start of MODEL   15
10921   HG23  THR  46          HG23      THR  46   6.946   4.714   4.220
  Start of MODEL   15
10922    H    SER  47           H        SER  47   8.474   5.851   6.260
  Start of MODEL   15
10923    HA   SER  47           HA       SER  47   8.538   3.124   7.356
  Start of MODEL   15
10924    HB2  SER  47           HB2      SER  47   8.538   4.161   9.601
  Start of MODEL   15
10925    HB3  SER  47           HB3      SER  47   9.955   4.639   8.665
  Start of MODEL   15
10926    HG   SER  47           HG       SER  47   8.509   6.536   8.076
  Start of MODEL   15
10927    H    ASP  48           H        ASP  48   6.756   2.704   8.923
  Start of MODEL   15
10928    HA   ASP  48           HA       ASP  48   4.258   2.900   7.826
  Start of MODEL   15
10929    HB2  ASP  48           HB2      ASP  48   4.680   2.830  10.815
  Start of MODEL   15
10930    HB3  ASP  48           HB3      ASP  48   3.363   2.115   9.895
  Start of MODEL   15
10931    H    LYS  49           H        LYS  49   5.756   5.125  10.118
  Start of MODEL   15
10932    HA   LYS  49           HA       LYS  49   3.378   6.620  10.564
  Start of MODEL   15
10933    HB2  LYS  49           HB2      LYS  49   5.301   6.626  12.153
  Start of MODEL   15
10934    HB3  LYS  49           HB3      LYS  49   6.220   7.565  10.977
  Start of MODEL   15
10935    HG2  LYS  49           HG2      LYS  49   4.701   9.400  11.138
  Start of MODEL   15
10936    HG3  LYS  49           HG3      LYS  49   3.569   8.450  12.094
  Start of MODEL   15
10937    HD2  LYS  49           HD2      LYS  49   4.721   9.941  13.561
  Start of MODEL   15
10938    HD3  LYS  49           HD3      LYS  49   5.295   8.305  13.878
  Start of MODEL   15
10939    HE2  LYS  49           HE2      LYS  49   7.323   8.705  12.688
  Start of MODEL   15
10940    HE3  LYS  49           HE3      LYS  49   6.720  10.245  12.070
  Start of MODEL   15
10941    HZ2  LYS  49           HZ1      LYS  49   8.283  10.489  13.943
  Start of MODEL   15
10942    HZ1  LYS  49           HZ2      LYS  49   7.194   9.666  14.946
  Start of MODEL   15
10943    HZ3  LYS  49           HZ3      LYS  49   6.758  11.159  14.268
  Start of MODEL   15
10944    H    THR  50           H        THR  50   5.976   6.781   8.234
  Start of MODEL   15
10945    HA   THR  50           HA       THR  50   5.477   9.362   7.227
  Start of MODEL   15
10946    HB   THR  50           HB       THR  50   6.459   7.033   5.570
  Start of MODEL   15
10947    HG1  THR  50           HG1      THR  50   8.307   8.649   6.909
  Start of MODEL   15
10948   HG22  THR  50          HG21      THR  50   7.780   8.757   4.439
  Start of MODEL   15
10949   HG21  THR  50          HG22      THR  50   7.100   9.984   5.511
  Start of MODEL   15
10950   HG23  THR  50          HG23      THR  50   6.056   9.128   4.375
  Start of MODEL   15
10951    H    LEU  51           H        LEU  51   4.130   6.188   6.438
  Start of MODEL   15
10952    HA   LEU  51           HA       LEU  51   2.471   7.172   4.302
  Start of MODEL   15
10953    HB2  LEU  51           HB2      LEU  51   2.418   4.606   5.873
  Start of MODEL   15
10954    HB3  LEU  51           HB3      LEU  51   1.262   4.967   4.608
  Start of MODEL   15
10955    HG   LEU  51           HG       LEU  51   4.233   4.558   4.322
  Start of MODEL   15
10956   HD11  LEU  51          HD11      LEU  51   1.855   3.124   3.143
  Start of MODEL   15
10957   HD13  LEU  51          HD12      LEU  51   2.873   2.539   4.460
  Start of MODEL   15
10958   HD12  LEU  51          HD13      LEU  51   3.553   2.742   2.844
  Start of MODEL   15
10959   HD23  LEU  51          HD21      LEU  51   2.270   5.461   2.214
  Start of MODEL   15
10960   HD22  LEU  51          HD22      LEU  51   3.967   5.054   1.955
  Start of MODEL   15
10961   HD21  LEU  51          HD23      LEU  51   3.537   6.454   2.938
  Start of MODEL   15
10962    H    HIS  52           H        HIS  52   2.010   6.393   7.703
  Start of MODEL   15
10963    HA   HIS  52           HA       HIS  52  -0.682   6.913   7.983
  Start of MODEL   15
10964    HB2  HIS  52           HB2      HIS  52   0.722   6.024   9.784
  Start of MODEL   15
10965    HB3  HIS  52           HB3      HIS  52   1.550   7.567   9.922
  Start of MODEL   15
10966    HD1  HIS  52           HD1      HIS  52   0.363   9.445  11.235
  Start of MODEL   15
10967    HD2  HIS  52           HD2      HIS  52  -1.850   5.930  10.893
  Start of MODEL   15
10968    HE1  HIS  52           HE1      HIS  52  -1.554   9.680  12.845
  Start of MODEL   15
10969    HE2  HIS  52           HE2      HIS  52  -2.697   7.440  12.803
  Start of MODEL   15
10970    H    GLU  53           H        GLU  53   1.950   9.277   8.524
  Start of MODEL   15
10971    HA   GLU  53           HA       GLU  53   0.350  11.474   8.961
  Start of MODEL   15
10972    HB2  GLU  53           HB2      GLU  53   3.086  11.445   7.685
  Start of MODEL   15
10973    HB3  GLU  53           HB3      GLU  53   2.326  12.831   8.447
  Start of MODEL   15
10974    HG2  GLU  53           HG2      GLU  53   3.200  10.285   9.783
  Start of MODEL   15
10975    HG3  GLU  53           HG3      GLU  53   3.955  11.870   9.930
  Start of MODEL   15
10976    H    TYR  54           H        TYR  54   1.635  10.319   5.849
  Start of MODEL   15
10977    HA   TYR  54           HA       TYR  54   0.770  12.658   4.462
  Start of MODEL   15
10978    HB2  TYR  54           HB2      TYR  54   2.583  11.211   3.593
  Start of MODEL   15
10979    HB3  TYR  54           HB3      TYR  54   1.392   9.955   3.253
  Start of MODEL   15
10980    HD1  TYR  54           HD1      TYR  54   0.147   9.990   1.259
  Start of MODEL   15
10981    HD2  TYR  54           HD2      TYR  54   2.343  13.439   2.420
  Start of MODEL   15
10982    HE1  TYR  54           HE1      TYR  54  -0.339  11.020  -0.920
  Start of MODEL   15
10983    HE2  TYR  54           HE2      TYR  54   1.869  14.486   0.246
  Start of MODEL   15
10984    HH   TYR  54           HH       TYR  54  -0.472  13.244  -1.922
  Start of MODEL   15
10985    H    PHE  55           H        PHE  55  -0.578   9.344   4.502
  Start of MODEL   15
10986    HA   PHE  55           HA       PHE  55  -2.768  10.067   2.868
  Start of MODEL   15
10987    HB2  PHE  55           HB2      PHE  55  -2.228   7.634   4.539
  Start of MODEL   15
10988    HB3  PHE  55           HB3      PHE  55  -3.715   7.828   3.617
  Start of MODEL   15
10989    HD1  PHE  55           HD1      PHE  55  -0.088   7.358   3.404
  Start of MODEL   15
10990    HD2  PHE  55           HD2      PHE  55  -3.724   7.697   1.225
  Start of MODEL   15
10991    HE1  PHE  55           HE1      PHE  55   1.050   6.526   1.392
  Start of MODEL   15
10992    HE2  PHE  55           HE2      PHE  55  -2.594   6.859  -0.796
  Start of MODEL   15
10993    HZ   PHE  55           HZ       PHE  55  -0.207   6.276  -0.712
  Start of MODEL   15
10994    H    GLU  56           H        GLU  56  -2.355  10.211   6.339
  Start of MODEL   15
10995    HA   GLU  56           HA       GLU  56  -5.103   9.991   6.972
  Start of MODEL   15
10996    HB2  GLU  56           HB2      GLU  56  -4.548  10.739   9.189
  Start of MODEL   15
10997    HB3  GLU  56           HB3      GLU  56  -3.279   9.663   8.624
  Start of MODEL   15
10998    HG2  GLU  56           HG2      GLU  56  -1.887  11.230   9.379
  Start of MODEL   15
10999    HG3  GLU  56           HG3      GLU  56  -2.295  12.095   7.901
  Start of MODEL   15
11000    H    GLN  57           H        GLN  57  -3.244  12.525   5.655
  Start of MODEL   15
11001    HA   GLN  57           HA       GLN  57  -4.796  14.756   6.412
  Start of MODEL   15
11002    HB2  GLN  57           HB2      GLN  57  -3.313  14.435   3.799
  Start of MODEL   15
11003    HB3  GLN  57           HB3      GLN  57  -3.696  15.930   4.635
  Start of MODEL   15
11004    HG2  GLN  57           HG2      GLN  57  -1.828  13.821   5.685
  Start of MODEL   15
11005    HG3  GLN  57           HG3      GLN  57  -1.320  15.255   4.800
  Start of MODEL   15
11006   HE21  GLN  57          HE21      GLN  57  -0.709  14.352   7.510
  Start of MODEL   15
11007   HE22  GLN  57          HE22      GLN  57  -1.175  15.648   8.558
  Start of MODEL   15
11008    H    PHE  58           H        PHE  58  -5.565  12.125   4.379
  Start of MODEL   15
11009    HA   PHE  58           HA       PHE  58  -7.498  13.652   2.813
  Start of MODEL   15
11010    HB2  PHE  58           HB2      PHE  58  -6.849  10.692   2.773
  Start of MODEL   15
11011    HB3  PHE  58           HB3      PHE  58  -8.025  11.475   1.735
  Start of MODEL   15
11012    HD1  PHE  58           HD1      PHE  58  -4.421  11.546   2.628
  Start of MODEL   15
11013    HD2  PHE  58           HD2      PHE  58  -7.408  12.324  -0.299
  Start of MODEL   15
11014    HE1  PHE  58           HE1      PHE  58  -2.664  12.039   0.980
  Start of MODEL   15
11015    HE2  PHE  58           HE2      PHE  58  -5.655  12.832  -1.952
  Start of MODEL   15
11016    HZ   PHE  58           HZ       PHE  58  -3.279  12.684  -1.318
  Start of MODEL   15
11017    H    GLY  59           H        GLY  59  -7.405  11.581   5.621
  Start of MODEL   15
11018    HA2  GLY  59           HA2      GLY  59  -9.831  12.075   6.659
  Start of MODEL   15
11019    HA3  GLY  59           HA3      GLY  59 -10.199  10.862   5.441
  Start of MODEL   15
11020    H    ASP  60           H        ASP  60 -10.945   9.743   7.429
  Start of MODEL   15
11021    HA   ASP  60           HA       ASP  60  -9.202   8.926   9.457
  Start of MODEL   15
11022    HB2  ASP  60           HB2      ASP  60 -11.818   7.792   8.489
  Start of MODEL   15
11023    HB3  ASP  60           HB3      ASP  60 -10.936   7.080   9.833
  Start of MODEL   15
11024    H    ILE  61           H        ILE  61  -7.454   7.738   9.233
  Start of MODEL   15
11025    HA   ILE  61           HA       ILE  61  -7.508   5.408   7.505
  Start of MODEL   15
11026    HB   ILE  61           HB       ILE  61  -5.370   6.856   9.006
  Start of MODEL   15
11027   HD11  ILE  61          HD11      ILE  61  -3.242   6.295   6.830
  Start of MODEL   15
11028   HD13  ILE  61          HD12      ILE  61  -3.691   7.868   7.486
  Start of MODEL   15
11029   HD12  ILE  61          HD13      ILE  61  -3.791   7.578   5.751
  Start of MODEL   15
11030    H    GLU  62           H        GLU  62  -7.767   3.426   8.187
  Start of MODEL   15
11031    HA   GLU  62           HA       GLU  62  -8.304   2.834  10.957
  Start of MODEL   15
11032    HB2  GLU  62           HB2      GLU  62  -8.585   1.524   8.346
  Start of MODEL   15
11033    HB3  GLU  62           HB3      GLU  62  -8.107   0.428   9.626
  Start of MODEL   15
11034    HG2  GLU  62           HG2      GLU  62 -10.509   2.236   9.727
  Start of MODEL   15
11035    HG3  GLU  62           HG3      GLU  62 -10.542   0.537   9.258
  Start of MODEL   15
11036    H    GLU  63           H        GLU  63  -5.799   2.224   8.564
  Start of MODEL   15
11037    HA   GLU  63           HA       GLU  63  -3.838   1.542  10.576
  Start of MODEL   15
11038    HB2  GLU  63           HB2      GLU  63  -5.053  -0.552  10.295
  Start of MODEL   15
11039    HB3  GLU  63           HB3      GLU  63  -4.889  -0.443   8.555
  Start of MODEL   15
11040    HG2  GLU  63           HG2      GLU  63  -2.436  -0.685   8.828
  Start of MODEL   15
11041    HG3  GLU  63           HG3      GLU  63  -2.712  -0.960  10.554
  Start of MODEL   15
11042    H    ALA  64           H        ALA  64  -1.793   2.115   9.803
  Start of MODEL   15
11043    HA   ALA  64           HA       ALA  64  -1.433   2.275   6.899
  Start of MODEL   15
11044    HB2  ALA  64           HB1      ALA  64  -0.306   4.436   7.086
  Start of MODEL   15
11045    HB1  ALA  64           HB2      ALA  64  -0.668   4.481   8.813
  Start of MODEL   15
11046    HB3  ALA  64           HB3      ALA  64  -1.980   4.542   7.634
  Start of MODEL   15
11047    H    VAL  65           H        VAL  65   0.198   0.956   6.452
  Start of MODEL   15
11048    HA   VAL  65           HA       VAL  65   2.570   0.983   8.171
  Start of MODEL   15
11049    HB   VAL  65           HB       VAL  65   2.726  -1.523   7.983
  Start of MODEL   15
11050    H    VAL  66           H        VAL  66   4.511   0.427   7.183
  Start of MODEL   15
11051    HA   VAL  66           HA       VAL  66   4.465   0.153   4.252
  Start of MODEL   15
11052    HB   VAL  66           HB       VAL  66   6.755   0.679   6.163
  Start of MODEL   15
11053    H    ILE  67           H        ILE  67   5.219  -1.750   3.274
  Start of MODEL   15
11054    HA   ILE  67           HA       ILE  67   4.833  -3.984   5.070
  Start of MODEL   15
11055    HB   ILE  67           HB       ILE  67   4.967  -3.865   2.063
  Start of MODEL   15
11056   HD13  ILE  67          HD11      ILE  67   2.559  -5.401   4.594
  Start of MODEL   15
11057   HD12  ILE  67          HD12      ILE  67   1.458  -4.030   4.461
  Start of MODEL   15
11058   HD11  ILE  67          HD13      ILE  67   3.039  -3.821   5.209
  Start of MODEL   15
11059    H    THR  68           H        THR  68   6.293  -5.289   5.732
  Start of MODEL   15
11060    HA   THR  68           HA       THR  68   8.963  -5.267   4.529
  Start of MODEL   15
11061    HB   THR  68           HB       THR  68   9.874  -5.515   6.863
  Start of MODEL   15
11062    HG1  THR  68           HG1      THR  68   7.636  -4.290   7.952
  Start of MODEL   15
11063   HG21  THR  68          HG21      THR  68   8.408  -2.943   6.261
  Start of MODEL   15
11064   HG23  THR  68          HG22      THR  68  10.032  -3.372   5.723
  Start of MODEL   15
11065   HG22  THR  68          HG23      THR  68   9.708  -3.122   7.437
  Start of MODEL   15
11066    H    ASP  69           H        ASP  69  10.004  -7.328   4.632
  Start of MODEL   15
11067    HA   ASP  69           HA       ASP  69   8.192  -9.498   4.570
  Start of MODEL   15
11068    HB2  ASP  69           HB2      ASP  69  10.242  -9.589   3.256
  Start of MODEL   15
11069    HB3  ASP  69           HB3      ASP  69  11.209  -9.551   4.734
  Start of MODEL   15
11070    H    ARG  70           H        ARG  70   7.613 -10.948   6.079
  Start of MODEL   15
11071    HA   ARG  70           HA       ARG  70   7.707 -10.072   8.725
  Start of MODEL   15
11072    HB2  ARG  70           HB2      ARG  70   6.484 -12.030   9.350
  Start of MODEL   15
11073    HB3  ARG  70           HB3      ARG  70   5.849 -11.382   7.846
  Start of MODEL   15
11074    HG2  ARG  70           HG2      ARG  70   7.751 -13.695   8.039
  Start of MODEL   15
11075    HG3  ARG  70           HG3      ARG  70   5.999 -13.845   7.903
  Start of MODEL   15
11076    HD2  ARG  70           HD2      ARG  70   6.532 -12.184   5.843
  Start of MODEL   15
11077    HD3  ARG  70           HD3      ARG  70   8.009 -13.148   5.876
  Start of MODEL   15
11078    HE   ARG  70           HE       ARG  70   5.526 -14.650   5.972
  Start of MODEL   15
11079   HH11  ARG  70          HH11      ARG  70   8.117 -13.379   3.939
  Start of MODEL   15
11080   HH12  ARG  70          HH12      ARG  70   7.734 -14.440   2.618
  Start of MODEL   15
11081   HH21  ARG  70          HH21      ARG  70   5.045 -16.004   4.257
  Start of MODEL   15
11082   HH22  ARG  70          HH22      ARG  70   5.976 -15.942   2.789
  Start of MODEL   15
11083    H    ASN  71           H        ASN  71  10.049 -11.946   7.077
  Start of MODEL   15
11084    HA   ASN  71           HA       ASN  71  10.944 -13.299   9.476
  Start of MODEL   15
11085    HB2  ASN  71           HB2      ASN  71  12.289 -13.157   6.769
  Start of MODEL   15
11086    HB3  ASN  71           HB3      ASN  71  12.679 -14.271   8.078
  Start of MODEL   15
11087   HD21  ASN  71          HD21      ASN  71  10.567 -13.557   5.460
  Start of MODEL   15
11088   HD22  ASN  71          HD22      ASN  71   9.675 -15.047   5.506
  Start of MODEL   15
11089    H    THR  72           H        THR  72  12.378 -10.961   7.194
  Start of MODEL   15
11090    HA   THR  72           HA       THR  72  14.467 -10.385   9.155
  Start of MODEL   15
11091    HB   THR  72           HB       THR  72  15.538  -9.161   7.252
  Start of MODEL   15
11092    HG1  THR  72           HG1      THR  72  14.278 -10.163   5.199
  Start of MODEL   15
11093   HG23  THR  72          HG21      THR  72  16.104 -11.492   7.726
  Start of MODEL   15
11094   HG22  THR  72          HG22      THR  72  16.139 -11.170   5.991
  Start of MODEL   15
11095   HG21  THR  72          HG23      THR  72  14.770 -12.025   6.704
  Start of MODEL   15
11096    H    GLN  73           H        GLN  73  11.661  -9.011   7.809
  Start of MODEL   15
11097    HA   GLN  73           HA       GLN  73  10.499  -7.108   8.247
  Start of MODEL   15
11098    HB2  GLN  73           HB2      GLN  73  12.614  -6.626  10.348
  Start of MODEL   15
11099    HB3  GLN  73           HB3      GLN  73  11.106  -5.733  10.197
  Start of MODEL   15
11100    HG2  GLN  73           HG2      GLN  73   9.862  -7.823  10.585
  Start of MODEL   15
11101    HG3  GLN  73           HG3      GLN  73  11.397  -8.670  10.800
  Start of MODEL   15
11102   HE21  GLN  73          HE21      GLN  73  12.647  -6.455  12.193
  Start of MODEL   15
11103   HE22  GLN  73          HE22      GLN  73  11.953  -6.412  13.779
  Start of MODEL   15
11104    H    LYS  74           H        LYS  74  12.911  -7.275   6.439
  Start of MODEL   15
11105    HA   LYS  74           HA       LYS  74  13.846  -4.567   6.269
  Start of MODEL   15
11106    HB2  LYS  74           HB2      LYS  74  14.022  -6.841   4.282
  Start of MODEL   15
11107    HB3  LYS  74           HB3      LYS  74  14.819  -5.285   4.101
  Start of MODEL   15
11108    HG2  LYS  74           HG2      LYS  74  15.339  -7.333   6.247
  Start of MODEL   15
11109    HG3  LYS  74           HG3      LYS  74  16.394  -6.921   4.894
  Start of MODEL   15
11110    HD2  LYS  74           HD2      LYS  74  16.639  -4.646   5.779
  Start of MODEL   15
11111    HD3  LYS  74           HD3      LYS  74  15.585  -5.059   7.133
  Start of MODEL   15
11112    HE2  LYS  74           HE2      LYS  74  17.188  -6.817   7.798
  Start of MODEL   15
11113    HE3  LYS  74           HE3      LYS  74  18.259  -6.298   6.496
  Start of MODEL   15
11114    HZ1  LYS  74           HZ1      LYS  74  17.413  -4.689   8.844
  Start of MODEL   15
11115    HZ3  LYS  74           HZ2      LYS  74  18.351  -4.091   7.565
  Start of MODEL   15
11116    HZ2  LYS  74           HZ3      LYS  74  18.957  -5.325   8.556
  Start of MODEL   15
11117    H    SER  75           H        SER  75  13.378  -3.141   4.418
  Start of MODEL   15
11118    HA   SER  75           HA       SER  75  10.502  -2.932   4.260
  Start of MODEL   15
11119    HB2  SER  75           HB2      SER  75  12.616  -1.145   3.031
  Start of MODEL   15
11120    HB3  SER  75           HB3      SER  75  10.924  -0.740   3.317
  Start of MODEL   15
11121    HG   SER  75           HG       SER  75  12.156   0.133   4.967
  Start of MODEL   15
11122    H    ARG  76           H        ARG  76   9.301  -3.723   2.614
  Start of MODEL   15
11123    HA   ARG  76           HA       ARG  76  10.633  -4.812   0.297
  Start of MODEL   15
11124    HB2  ARG  76           HB2      ARG  76   7.733  -4.722   1.125
  Start of MODEL   15
11125    HB3  ARG  76           HB3      ARG  76   8.291  -5.469  -0.365
  Start of MODEL   15
11126    HG2  ARG  76           HG2      ARG  76   9.720  -6.980   1.002
  Start of MODEL   15
11127    HG3  ARG  76           HG3      ARG  76   8.978  -6.294   2.447
  Start of MODEL   15
11128    HD2  ARG  76           HD2      ARG  76   6.839  -7.104   1.846
  Start of MODEL   15
11129    HD3  ARG  76           HD3      ARG  76   7.374  -7.513   0.219
  Start of MODEL   15
11130    HE   ARG  76           HE       ARG  76   8.552  -8.920   2.508
  Start of MODEL   15
11131   HH11  ARG  76          HH11      ARG  76   6.551  -8.930  -0.358
  Start of MODEL   15
11132   HH12  ARG  76          HH12      ARG  76   6.505 -10.669  -0.486
  Start of MODEL   15
11133   HH21  ARG  76          HH21      ARG  76   8.485 -11.235   2.363
  Start of MODEL   15
11134   HH22  ARG  76          HH22      ARG  76   7.590 -11.962   1.062
  Start of MODEL   15
11135    H    GLY  77           H        GLY  77  10.068  -1.793   0.949
  Start of MODEL   15
11136    HA2  GLY  77           HA2      GLY  77   9.948   0.108  -0.342
  Start of MODEL   15
11137    HA3  GLY  77           HA3      GLY  77  10.044  -0.940  -1.743
  Start of MODEL   15
11138    H    TYR  78           H        TYR  78   7.409  -1.717   0.234
  Start of MODEL   15
11139    HA   TYR  78           HA       TYR  78   5.633   0.225  -0.945
  Start of MODEL   15
11140    HB2  TYR  78           HB2      TYR  78   4.098  -1.467  -1.890
  Start of MODEL   15
11141    HB3  TYR  78           HB3      TYR  78   5.649  -1.432  -2.712
  Start of MODEL   15
11142    HD1  TYR  78           HD1      TYR  78   3.548  -3.349  -0.359
  Start of MODEL   15
11143    HD2  TYR  78           HD2      TYR  78   7.051  -3.373  -2.770
  Start of MODEL   15
11144    HE1  TYR  78           HE1      TYR  78   3.766  -5.770   0.000
  Start of MODEL   15
11145    HE2  TYR  78           HE2      TYR  78   7.282  -5.795  -2.425
  Start of MODEL   15
11146    HH   TYR  78           HH       TYR  78   6.564  -7.481  -0.676
  Start of MODEL   15
11147    H    GLY  79           H        GLY  79   3.332  -0.146  -0.075
  Start of MODEL   15
11148    HA2  GLY  79           HA2      GLY  79   3.310  -1.563   2.456
  Start of MODEL   15
11149    HA3  GLY  79           HA3      GLY  79   3.290   0.187   2.584
  Start of MODEL   15
11150    H    PHE  80           H        PHE  80   1.242  -0.609   3.736
  Start of MODEL   15
11151    HA   PHE  80           HA       PHE  80  -0.946  -0.437   1.795
  Start of MODEL   15
11152    HB2  PHE  80           HB2      PHE  80  -0.681  -2.434   4.033
  Start of MODEL   15
11153    HB3  PHE  80           HB3      PHE  80  -2.254  -1.976   3.394
  Start of MODEL   15
11154    HD1  PHE  80           HD1      PHE  80   0.792  -3.851   2.815
  Start of MODEL   15
11155    HD2  PHE  80           HD2      PHE  80  -2.853  -2.522   1.082
  Start of MODEL   15
11156    HE1  PHE  80           HE1      PHE  80   1.054  -5.505   1.018
  Start of MODEL   15
11157    HE2  PHE  80           HE2      PHE  80  -2.607  -4.168  -0.720
  Start of MODEL   15
11158    HZ   PHE  80           HZ       PHE  80  -0.652  -5.696  -0.735
  Start of MODEL   15
11159    H    VAL  81           H        VAL  81  -2.493   0.885   2.283
  Start of MODEL   15
11160    HA   VAL  81           HA       VAL  81  -2.761   1.815   5.074
  Start of MODEL   15
11161    HB   VAL  81           HB       VAL  81  -3.148   3.476   2.573
  Start of MODEL   15
11162    H    THR  82           H        THR  82  -4.625   1.303   5.962
  Start of MODEL   15
11163    HA   THR  82           HA       THR  82  -6.824   0.489   4.203
  Start of MODEL   15
11164    HB   THR  82           HB       THR  82  -6.636  -0.004   7.176
  Start of MODEL   15
11165    HG1  THR  82           HG1      THR  82  -5.411  -1.737   6.799
  Start of MODEL   15
11166   HG22  THR  82          HG21      THR  82  -8.167  -1.872   6.621
  Start of MODEL   15
11167   HG21  THR  82          HG22      THR  82  -8.186  -1.339   4.942
  Start of MODEL   15
11168   HG23  THR  82          HG23      THR  82  -8.851  -0.302   6.205
  Start of MODEL   15
11169    H    MET  83           H        MET  83  -8.100   2.188   3.818
  Start of MODEL   15
11170    HA   MET  83           HA       MET  83  -8.327   4.327   5.728
  Start of MODEL   15
11171    HB2  MET  83           HB2      MET  83  -9.705   3.942   3.071
  Start of MODEL   15
11172    HB3  MET  83           HB3      MET  83  -9.709   5.418   4.032
  Start of MODEL   15
11173    HG2  MET  83           HG2      MET  83  -7.268   4.119   2.857
  Start of MODEL   15
11174    HG3  MET  83           HG3      MET  83  -8.117   5.501   2.168
  Start of MODEL   15
11175    HE1  MET  83           HE1      MET  83  -8.897   7.223   4.648
  Start of MODEL   15
11176    HE3  MET  83           HE2      MET  83  -8.096   7.950   3.250
  Start of MODEL   15
11177    HE2  MET  83           HE3      MET  83  -7.485   8.262   4.877
  Start of MODEL   15
11178    H    LYS  84           H        LYS  84 -10.165   5.026   6.684
  Start of MODEL   15
11179    HA   LYS  84           HA       LYS  84 -11.875   2.925   7.608
  Start of MODEL   15
11180    HB2  LYS  84           HB2      LYS  84 -10.933   4.960   8.897
  Start of MODEL   15
11181    HB3  LYS  84           HB3      LYS  84 -12.276   5.841   8.184
  Start of MODEL   15
11182    HG2  LYS  84           HG2      LYS  84 -13.856   4.716   9.418
  Start of MODEL   15
11183    HG3  LYS  84           HG3      LYS  84 -12.826   3.297   9.642
  Start of MODEL   15
11184    HD2  LYS  84           HD2      LYS  84 -12.443   5.996  10.949
  Start of MODEL   15
11185    HD3  LYS  84           HD3      LYS  84 -13.059   4.537  11.733
  Start of MODEL   15
11186    HE2  LYS  84           HE2      LYS  84 -10.925   3.409  11.222
  Start of MODEL   15
11187    HE3  LYS  84           HE3      LYS  84 -10.317   4.914  10.538
  Start of MODEL   15
11188    HZ3  LYS  84           HZ1      LYS  84 -10.472   5.958  12.683
  Start of MODEL   15
11189    HZ2  LYS  84           HZ2      LYS  84  -9.593   4.520  12.837
  Start of MODEL   15
11190    HZ1  LYS  84           HZ3      LYS  84 -11.198   4.581  13.360
  Start of MODEL   15
11191    H    ASP  85           H        ASP  85 -12.016   5.149   5.029
  Start of MODEL   15
11192    HA   ASP  85           HA       ASP  85 -14.726   4.315   4.436
  Start of MODEL   15
11193    HB2  ASP  85           HB2      ASP  85 -15.651   6.485   4.170
  Start of MODEL   15
11194    HB3  ASP  85           HB3      ASP  85 -14.897   6.462   5.759
  Start of MODEL   15
11195    H    ARG  86           H        ARG  86 -15.316   4.582   2.261
  Start of MODEL   15
11196    HA   ARG  86           HA       ARG  86 -13.274   4.015   0.441
  Start of MODEL   15
11197    HB2  ARG  86           HB2      ARG  86 -15.644   3.335   0.173
  Start of MODEL   15
11198    HB3  ARG  86           HB3      ARG  86 -16.064   5.006  -0.179
  Start of MODEL   15
11199    HG2  ARG  86           HG2      ARG  86 -14.108   4.604  -1.995
  Start of MODEL   15
11200    HG3  ARG  86           HG3      ARG  86 -14.772   2.979  -1.876
  Start of MODEL   15
11201    HD2  ARG  86           HD2      ARG  86 -16.257   5.505  -2.565
  Start of MODEL   15
11202    HD3  ARG  86           HD3      ARG  86 -15.887   4.164  -3.643
  Start of MODEL   15
11203    HE   ARG  86           HE       ARG  86 -17.508   3.509  -1.318
  Start of MODEL   15
11204   HH11  ARG  86          HH11      ARG  86 -17.385   4.254  -4.743
  Start of MODEL   15
11205   HH12  ARG  86          HH12      ARG  86 -19.019   3.733  -5.041
  Start of MODEL   15
11206   HH21  ARG  86          HH21      ARG  86 -19.648   2.826  -1.712
  Start of MODEL   15
11207   HH22  ARG  86          HH22      ARG  86 -20.309   2.930  -3.318
  Start of MODEL   15
11208    H    ALA  87           H        ALA  87 -14.942   7.050   1.138
  Start of MODEL   15
11209    HA   ALA  87           HA       ALA  87 -14.205   8.333  -1.277
  Start of MODEL   15
11210    HB2  ALA  87           HB1      ALA  87 -15.020   9.638   1.315
  Start of MODEL   15
11211    HB1  ALA  87           HB2      ALA  87 -16.143   8.993   0.120
  Start of MODEL   15
11212    HB3  ALA  87           HB3      ALA  87 -15.091  10.347  -0.298
  Start of MODEL   15
11213    H    SER  88           H        SER  88 -12.872   8.446   2.019
  Start of MODEL   15
11214    HA   SER  88           HA       SER  88 -10.875  10.368   1.432
  Start of MODEL   15
11215    HB2  SER  88           HB2      SER  88 -10.874   8.194   3.536
  Start of MODEL   15
11216    HB3  SER  88           HB3      SER  88  -9.805   9.600   3.505
  Start of MODEL   15
11217    HG   SER  88           HG       SER  88 -12.381   9.381   4.367
  Start of MODEL   15
11218    H    ALA  89           H        ALA  89 -10.997   6.832   1.273
  Start of MODEL   15
11219    HA   ALA  89           HA       ALA  89  -8.290   6.386   0.629
  Start of MODEL   15
11220    HB1  ALA  89           HB1      ALA  89 -10.714   4.780  -0.190
  Start of MODEL   15
11221    HB3  ALA  89           HB2      ALA  89  -9.825   4.599   1.323
  Start of MODEL   15
11222    HB2  ALA  89           HB3      ALA  89  -9.043   4.223  -0.212
  Start of MODEL   15
11223    H    GLU  90           H        GLU  90 -11.125   6.982  -1.389
  Start of MODEL   15
11224    HA   GLU  90           HA       GLU  90  -9.744   6.550  -3.826
  Start of MODEL   15
11225    HB2  GLU  90           HB2      GLU  90 -12.264   6.354  -3.396
  Start of MODEL   15
11226    HB3  GLU  90           HB3      GLU  90 -12.306   8.100  -3.627
  Start of MODEL   15
11227    HG2  GLU  90           HG2      GLU  90 -11.407   7.892  -5.833
  Start of MODEL   15
11228    HG3  GLU  90           HG3      GLU  90 -11.144   6.163  -5.607
  Start of MODEL   15
11229    H    ARG  91           H        ARG  91 -10.478   9.482  -1.947
  Start of MODEL   15
11230    HA   ARG  91           HA       ARG  91  -9.626  11.332  -3.878
  Start of MODEL   15
11231    HB2  ARG  91           HB2      ARG  91  -9.158  11.564  -0.898
  Start of MODEL   15
11232    HB3  ARG  91           HB3      ARG  91  -9.180  12.879  -2.061
  Start of MODEL   15
11233    HG2  ARG  91           HG2      ARG  91 -11.494  11.205  -1.140
  Start of MODEL   15
11234    HG3  ARG  91           HG3      ARG  91 -11.218  12.923  -0.861
  Start of MODEL   15
11235    HD2  ARG  91           HD2      ARG  91 -11.652  11.673  -3.575
  Start of MODEL   15
11236    HD3  ARG  91           HD3      ARG  91 -12.901  12.478  -2.626
  Start of MODEL   15
11237    HE   ARG  91           HE       ARG  91 -10.922  14.339  -2.812
  Start of MODEL   15
11238   HH11  ARG  91          HH11      ARG  91 -12.745  12.466  -5.153
  Start of MODEL   15
11239   HH12  ARG  91          HH12      ARG  91 -12.627  13.674  -6.394
  Start of MODEL   15
11240   HH21  ARG  91          HH21      ARG  91 -10.742  15.907  -4.461
  Start of MODEL   15
11241   HH22  ARG  91          HH22      ARG  91 -11.512  15.638  -5.998
  Start of MODEL   15
11242    H    ALA  92           H        ALA  92  -7.856   9.467  -1.474
  Start of MODEL   15
11243    HA   ALA  92           HA       ALA  92  -5.284  10.420  -2.030
  Start of MODEL   15
11244    HB1  ALA  92           HB1      ALA  92  -5.869   9.023  -0.086
  Start of MODEL   15
11245    HB3  ALA  92           HB2      ALA  92  -4.473   8.407  -0.973
  Start of MODEL   15
11246    HB2  ALA  92           HB3      ALA  92  -6.047   7.636  -1.162
  Start of MODEL   15
11247    H    CYS  93           H        CYS  93  -7.231   7.938  -3.638
  Start of MODEL   15
11248    HA   CYS  93           HA       CYS  93  -5.050   7.088  -5.305
  Start of MODEL   15
11249    HB2  CYS  93           HB2      CYS  93  -7.998   6.439  -5.456
  Start of MODEL   15
11250    HB3  CYS  93           HB3      CYS  93  -6.716   5.621  -6.345
  Start of MODEL   15
11251    HG   CYS  93           HG       CYS  93  -7.132   5.603  -2.950
  Start of MODEL   15
11252    H    LYS  94           H        LYS  94  -7.275   9.682  -5.442
  Start of MODEL   15
11253    HA   LYS  94           HA       LYS  94  -7.689   9.844  -8.227
  Start of MODEL   15
11254    HB2  LYS  94           HB2      LYS  94  -8.637  11.200  -6.078
  Start of MODEL   15
11255    HB3  LYS  94           HB3      LYS  94  -7.483  12.372  -6.689
  Start of MODEL   15
11256    HG2  LYS  94           HG2      LYS  94  -9.763  11.166  -8.246
  Start of MODEL   15
11257    HG3  LYS  94           HG3      LYS  94  -9.726  12.780  -7.542
  Start of MODEL   15
11258    HD2  LYS  94           HD2      LYS  94  -7.795  13.322  -8.975
  Start of MODEL   15
11259    HD3  LYS  94           HD3      LYS  94  -7.927  11.727  -9.717
  Start of MODEL   15
11260    HE2  LYS  94           HE2      LYS  94  -9.006  13.322 -11.153
  Start of MODEL   15
11261    HE3  LYS  94           HE3      LYS  94 -10.238  12.301 -10.418
  Start of MODEL   15
11262    HZ1  LYS  94           HZ1      LYS  94  -9.491  14.967  -9.362
  Start of MODEL   15
11263    HZ3  LYS  94           HZ2      LYS  94 -10.830  14.027  -8.925
  Start of MODEL   15
11264    HZ2  LYS  94           HZ3      LYS  94 -10.751  14.726 -10.467
  Start of MODEL   15
11265    H    ASP  95           H        ASP  95  -5.130  10.976  -6.101
  Start of MODEL   15
11266    HA   ASP  95           HA       ASP  95  -3.580  11.736  -8.484
  Start of MODEL   15
11267    HB2  ASP  95           HB2      ASP  95  -3.850  13.430  -6.585
  Start of MODEL   15
11268    HB3  ASP  95           HB3      ASP  95  -2.824  12.366  -5.629
  Start of MODEL   15
11269    HA   PRO  96           HA       PRO  96  -2.122   7.566  -7.332
  Start of MODEL   15
11270    HB2  PRO  96           HB2      PRO  96  -1.240   6.900  -9.807
  Start of MODEL   15
11271    HB3  PRO  96           HB3      PRO  96  -2.936   6.785  -9.325
  Start of MODEL   15
11272    HG2  PRO  96           HG2      PRO  96  -1.548   8.940 -10.874
  Start of MODEL   15
11273    HG3  PRO  96           HG3      PRO  96  -3.122   8.179 -11.177
  Start of MODEL   15
11274    HD2  PRO  96           HD2      PRO  96  -2.895  10.590  -9.986
  Start of MODEL   15
11275    HD3  PRO  96           HD3      PRO  96  -4.187   9.445  -9.568
  Start of MODEL   15
11276    H    ASN  97           H        ASN  97  -0.433  10.344  -8.176
  Start of MODEL   15
11277    HA   ASN  97           HA       ASN  97   2.117   8.958  -7.717
  Start of MODEL   15
11278    HB2  ASN  97           HB2      ASN  97   1.537  11.071  -9.790
  Start of MODEL   15
11279    HB3  ASN  97           HB3      ASN  97   3.170  10.704  -9.244
  Start of MODEL   15
11280   HD21  ASN  97          HD21      ASN  97   2.702   7.881  -8.924
  Start of MODEL   15
11281   HD22  ASN  97          HD22      ASN  97   2.623   7.221 -10.521
  Start of MODEL   15
11282    HA   PRO  98           HA       PRO  98   1.762  12.526  -4.756
  Start of MODEL   15
11283    HB2  PRO  98           HB2      PRO  98   2.099  10.534  -2.664
  Start of MODEL   15
11284    HB3  PRO  98           HB3      PRO  98   0.789  11.696  -2.883
  Start of MODEL   15
11285    HG2  PRO  98           HG2      PRO  98   0.461   9.017  -3.195
  Start of MODEL   15
11286    HG3  PRO  98           HG3      PRO  98  -0.493  10.225  -4.074
  Start of MODEL   15
11287    HD2  PRO  98           HD2      PRO  98   1.870   8.639  -4.998
  Start of MODEL   15
11288    HD3  PRO  98           HD3      PRO  98   0.370   9.036  -5.864
  Start of MODEL   15
11289    H    ILE  99           H        ILE  99   3.607  13.501  -4.062
  Start of MODEL   15
11290    HA   ILE  99           HA       ILE  99   6.102  12.041  -4.192
  Start of MODEL   15
11291    HB   ILE  99           HB       ILE  99   5.650  14.876  -3.232
  Start of MODEL   15
11292   HD11  ILE  99          HD11      ILE  99   6.147  12.685  -6.284
  Start of MODEL   15
11293   HD13  ILE  99          HD12      ILE  99   7.639  13.615  -6.148
  Start of MODEL   15
11294   HD12  ILE  99          HD13      ILE  99   6.427  14.067  -7.347
  Start of MODEL   15
11295    H    ILE 100           H        ILE 100   6.616  10.726  -2.588
  Start of MODEL   15
11296    HA   ILE 100           HA       ILE 100   6.094  11.587   0.185
  Start of MODEL   15
11297    HB   ILE 100           HB       ILE 100   5.953   8.754  -0.873
  Start of MODEL   15
11298   HD13  ILE 100          HD11      ILE 100   3.576   7.836  -1.193
  Start of MODEL   15
11299   HD12  ILE 100          HD12      ILE 100   2.214   8.822  -0.658
  Start of MODEL   15
11300   HD11  ILE 100          HD13      ILE 100   3.322   8.128   0.526
  Start of MODEL   15
11301    H    ASP 101           H        ASP 101   7.923  11.895   1.226
  Start of MODEL   15
11302    HA   ASP 101           HA       ASP 101  10.049  11.673   2.014
  Start of MODEL   15
11303    HB2  ASP 101           HB2      ASP 101   9.219   9.327   2.436
  Start of MODEL   15
11304    HB3  ASP 101           HB3      ASP 101   9.953   8.857   0.910
  Start of MODEL   15
11305    H    GLY 102           H        GLY 102   9.574  12.710  -0.581
  Start of MODEL   15
11306    HA2  GLY 102           HA2      GLY 102  10.954  13.671  -2.157
  Start of MODEL   15
11307    HA3  GLY 102           HA3      GLY 102  12.285  12.702  -1.544
  Start of MODEL   15
11308    H    ARG 103           H        ARG 103   9.758  10.664  -2.136
  Start of MODEL   15
11309    HA   ARG 103           HA       ARG 103  10.786  10.036  -4.824
  Start of MODEL   15
11310    HB2  ARG 103           HB2      ARG 103  11.332   8.310  -3.236
  Start of MODEL   15
11311    HB3  ARG 103           HB3      ARG 103   9.679   8.266  -2.644
  Start of MODEL   15
11312    HG2  ARG 103           HG2      ARG 103   9.811   6.385  -3.974
  Start of MODEL   15
11313    HG3  ARG 103           HG3      ARG 103   9.074   7.572  -5.052
  Start of MODEL   15
11314    HD2  ARG 103           HD2      ARG 103  11.285   8.034  -6.021
  Start of MODEL   15
11315    HD3  ARG 103           HD3      ARG 103  11.991   6.806  -4.968
  Start of MODEL   15
11316    HE   ARG 103           HE       ARG 103   9.827   5.813  -6.572
  Start of MODEL   15
11317   HH11  ARG 103          HH11      ARG 103  13.284   6.379  -6.427
  Start of MODEL   15
11318   HH12  ARG 103          HH12      ARG 103  13.650   5.280  -7.726
  Start of MODEL   15
11319   HH21  ARG 103          HH21      ARG 103  10.303   4.376  -8.297
  Start of MODEL   15
11320   HH22  ARG 103          HH22      ARG 103  11.954   4.143  -8.793
  Start of MODEL   15
11321    H    LYS 104           H        LYS 104   9.337   9.922  -6.493
  Start of MODEL   15
11322    HA   LYS 104           HA       LYS 104   6.577  10.520  -6.022
  Start of MODEL   15
11323    HB2  LYS 104           HB2      LYS 104   7.644  11.227  -8.119
  Start of MODEL   15
11324    HB3  LYS 104           HB3      LYS 104   7.963   9.548  -8.539
  Start of MODEL   15
11325    HG2  LYS 104           HG2      LYS 104   5.575   9.107  -8.680
  Start of MODEL   15
11326    HG3  LYS 104           HG3      LYS 104   5.227  10.767  -8.199
  Start of MODEL   15
11327    HD2  LYS 104           HD2      LYS 104   6.752   9.979 -10.679
  Start of MODEL   15
11328    HD3  LYS 104           HD3      LYS 104   5.037  10.390 -10.643
  Start of MODEL   15
11329    HE2  LYS 104           HE2      LYS 104   5.629  12.621  -9.750
  Start of MODEL   15
11330    HE3  LYS 104           HE3      LYS 104   7.336  12.198  -9.893
  Start of MODEL   15
11331    HZ2  LYS 104           HZ1      LYS 104   5.379  12.451 -12.117
  Start of MODEL   15
11332    HZ1  LYS 104           HZ2      LYS 104   6.967  11.875 -12.296
  Start of MODEL   15
11333    HZ3  LYS 104           HZ3      LYS 104   6.694  13.471 -11.791
  Start of MODEL   15
11334    H    ALA 105           H        ALA 105   5.090   9.105  -5.408
  Start of MODEL   15
11335    HA   ALA 105           HA       ALA 105   5.753   6.249  -5.604
  Start of MODEL   15
11336    HB1  ALA 105           HB1      ALA 105   3.862   7.657  -3.720
  Start of MODEL   15
11337    HB3  ALA 105           HB2      ALA 105   5.496   7.113  -3.333
  Start of MODEL   15
11338    HB2  ALA 105           HB3      ALA 105   4.239   5.937  -3.717
  Start of MODEL   15
11339    H    ASN 106           H        ASN 106   3.966   4.765  -5.945
  Start of MODEL   15
11340    HA   ASN 106           HA       ASN 106   1.872   5.945  -7.660
  Start of MODEL   15
11341    HB2  ASN 106           HB2      ASN 106   3.239   3.254  -7.896
  Start of MODEL   15
11342    HB3  ASN 106           HB3      ASN 106   1.799   3.699  -8.804
  Start of MODEL   15
11343   HD21  ASN 106          HD21      ASN 106   2.841   3.469 -10.773
  Start of MODEL   15
11344   HD22  ASN 106          HD22      ASN 106   4.023   4.596 -11.331
  Start of MODEL   15
11345    H    VAL 107           H        VAL 107  -0.038   5.893  -6.698
  Start of MODEL   15
11346    HA   VAL 107           HA       VAL 107  -0.554   3.763  -4.728
  Start of MODEL   15
11347    HB   VAL 107           HB       VAL 107  -1.568   6.611  -4.765
  Start of MODEL   15
11348    H    ASN 108           H        ASN 108  -2.299   2.527  -4.947
  Start of MODEL   15
11349    HA   ASN 108           HA       ASN 108  -4.686   3.503  -6.254
  Start of MODEL   15
11350    HB2  ASN 108           HB2      ASN 108  -4.827   1.568  -7.822
  Start of MODEL   15
11351    HB3  ASN 108           HB3      ASN 108  -3.491   2.650  -8.195
  Start of MODEL   15
11352   HD21  ASN 108          HD21      ASN 108  -4.378  -0.501  -6.984
  Start of MODEL   15
11353   HD22  ASN 108          HD22      ASN 108  -2.802  -1.198  -7.097
  Start of MODEL   15
11354    H    LEU 109           H        LEU 109  -6.549   2.182  -5.772
  Start of MODEL   15
11355    HA   LEU 109           HA       LEU 109  -6.590   0.840  -3.350
  Start of MODEL   15
11356    HB2  LEU 109           HB2      LEU 109  -8.405   0.444  -5.737
  Start of MODEL   15
11357    HB3  LEU 109           HB3      LEU 109  -8.735  -0.160  -4.122
  Start of MODEL   15
11358    HG   LEU 109           HG       LEU 109  -8.509   2.749  -4.906
  Start of MODEL   15
11359   HD12  LEU 109          HD11      LEU 109 -10.892   2.840  -4.395
  Start of MODEL   15
11360   HD11  LEU 109          HD12      LEU 109 -10.895   1.104  -4.084
  Start of MODEL   15
11361   HD13  LEU 109          HD13      LEU 109 -10.562   1.709  -5.705
  Start of MODEL   15
11362   HD22  LEU 109          HD21      LEU 109  -9.246   3.205  -2.614
  Start of MODEL   15
11363   HD21  LEU 109          HD22      LEU 109  -7.687   2.382  -2.648
  Start of MODEL   15
11364   HD23  LEU 109          HD23      LEU 109  -9.148   1.483  -2.246
  Start of MODEL   15
11365    H    ALA 110           H        ALA 110  -6.201  -1.216  -2.681
  Start of MODEL   15
11366    HA   ALA 110           HA       ALA 110  -4.155  -2.496  -4.106
  Start of MODEL   15
11367    HB1  ALA 110           HB1      ALA 110  -4.337  -2.458  -1.653
  Start of MODEL   15
11368    HB3  ALA 110           HB2      ALA 110  -4.100  -4.084  -2.299
  Start of MODEL   15
11369    HB2  ALA 110           HB3      ALA 110  -5.700  -3.574  -1.758
  Start of MODEL   15
11370    H    TYR 111           H        TYR 111  -7.594  -3.223  -3.943
  Start of MODEL   15
11371    HA   TYR 111           HA       TYR 111  -7.344  -5.913  -4.803
  Start of MODEL   15
11372    HB2  TYR 111           HB2      TYR 111  -9.666  -5.997  -4.860
  Start of MODEL   15
11373    HB3  TYR 111           HB3      TYR 111  -9.348  -4.765  -3.650
  Start of MODEL   15
11374    HD1  TYR 111           HD1      TYR 111  -9.138  -2.302  -4.763
  Start of MODEL   15
11375    HD2  TYR 111           HD2      TYR 111 -11.410  -5.544  -6.323
  Start of MODEL   15
11376    HE1  TYR 111           HE1      TYR 111 -10.553  -0.713  -5.987
  Start of MODEL   15
11377    HE2  TYR 111           HE2      TYR 111 -12.833  -3.957  -7.557
  Start of MODEL   15
11378    HH   TYR 111           HH       TYR 111 -13.493  -1.578  -7.401
  Start of MODEL   15
11379    H    LEU 112           H        LEU 112  -7.077  -2.969  -6.462
  Start of MODEL   15
11380    HA   LEU 112           HA       LEU 112  -7.965  -3.789  -9.026
  Start of MODEL   15
11381    HB2  LEU 112           HB2      LEU 112  -6.138  -1.569  -8.147
  Start of MODEL   15
11382    HB3  LEU 112           HB3      LEU 112  -6.663  -1.792  -9.808
  Start of MODEL   15
11383    HG   LEU 112           HG       LEU 112  -8.455  -1.255  -7.442
  Start of MODEL   15
11384   HD12  LEU 112          HD11      LEU 112  -8.888   0.874  -8.572
  Start of MODEL   15
11385   HD11  LEU 112          HD12      LEU 112  -7.679   0.465  -9.788
  Start of MODEL   15
11386   HD13  LEU 112          HD13      LEU 112  -7.193   0.704  -8.112
  Start of MODEL   15
11387   HD22  LEU 112          HD21      LEU 112 -10.255  -1.142  -9.067
  Start of MODEL   15
11388   HD21  LEU 112          HD22      LEU 112  -9.480  -2.728  -9.106
  Start of MODEL   15
11389   HD23  LEU 112          HD23      LEU 112  -9.127  -1.546 -10.363
  Start of MODEL   15
11390    H    GLY 113           H        GLY 113  -5.274  -4.786  -7.287
  Start of MODEL   15
11391    HA2  GLY 113           HA2      GLY 113  -4.089  -5.899  -9.702
  Start of MODEL   15
11392    HA3  GLY 113           HA3      GLY 113  -3.053  -4.851  -8.739
  Start of MODEL   15
11393    H    ALA 114           H        ALA 114  -5.378  -6.549  -6.946
  Start of MODEL   15
11394    HA   ALA 114           HA       ALA 114  -3.327  -7.832  -5.437
  Start of MODEL   15
11395    HB1  ALA 114           HB1      ALA 114  -5.330  -6.856  -4.397
  Start of MODEL   15
11396    HB3  ALA 114           HB2      ALA 114  -5.095  -8.546  -3.961
  Start of MODEL   15
11397    HB2  ALA 114           HB3      ALA 114  -6.318  -8.107  -5.154
  Start of MODEL   15
11398    H    LYS 115           H        LYS 115  -2.923  -9.965  -5.136
  Start of MODEL   15
11399    HA   LYS 115           HA       LYS 115  -3.378 -11.761  -7.284
  Start of MODEL   15
11400    HB2  LYS 115           HB2      LYS 115  -2.325 -12.236  -4.486
  Start of MODEL   15
11401    HB3  LYS 115           HB3      LYS 115  -2.305 -13.431  -5.775
  Start of MODEL   15
11402    HG2  LYS 115           HG2      LYS 115  -0.912 -10.769  -5.939
  Start of MODEL   15
11403    HG3  LYS 115           HG3      LYS 115  -0.140 -12.261  -5.400
  Start of MODEL   15
11404    HD2  LYS 115           HD2      LYS 115  -0.733 -13.292  -7.580
  Start of MODEL   15
11405    HD3  LYS 115           HD3      LYS 115  -1.359 -11.729  -8.107
  Start of MODEL   15
11406    HE2  LYS 115           HE2      LYS 115   1.468 -12.179  -7.174
  Start of MODEL   15
11407    HE3  LYS 115           HE3      LYS 115   0.972 -12.259  -8.865
  Start of MODEL   15
11408    HZ2  LYS 115           HZ1      LYS 115   1.891 -10.094  -8.274
  Start of MODEL   15
11409    HZ1  LYS 115           HZ2      LYS 115   0.673  -9.880  -7.112
  Start of MODEL   15
11410    HZ3  LYS 115           HZ3      LYS 115   0.267  -9.969  -8.752
  Start of MODEL   15
11411    HA   PRO 116           HA       PRO 116  -7.263 -13.605  -6.199
  Start of MODEL   15
11412    HB2  PRO 116           HB2      PRO 116  -6.690 -16.245  -6.798
  Start of MODEL   15
11413    HB3  PRO 116           HB3      PRO 116  -7.186 -15.032  -7.983
  Start of MODEL   15
11414    HG2  PRO 116           HG2      PRO 116  -4.451 -16.020  -7.306
  Start of MODEL   15
11415    HG3  PRO 116           HG3      PRO 116  -5.140 -15.623  -8.892
  Start of MODEL   15
11416    HD2  PRO 116           HD2      PRO 116  -3.464 -13.947  -7.631
  Start of MODEL   15
11417    HD3  PRO 116           HD3      PRO 116  -4.827 -13.344  -8.595
  Start of MODEL   15
11418    H    ARG 117           H        ARG 117  -7.726 -13.697  -4.097
  Start of MODEL   15
11419    HA   ARG 117           HA       ARG 117  -8.027 -14.549  -2.032
  Start of MODEL   15
11420    HB2  ARG 117           HB2      ARG 117  -6.051 -16.712  -2.736
  Start of MODEL   15
11421    HB3  ARG 117           HB3      ARG 117  -7.060 -16.654  -1.299
  Start of MODEL   15
11422    HG2  ARG 117           HG2      ARG 117  -8.999 -16.536  -3.079
  Start of MODEL   15
11423    HG3  ARG 117           HG3      ARG 117  -7.781 -17.305  -4.103
  Start of MODEL   15
11424    HD2  ARG 117           HD2      ARG 117  -8.976 -18.289  -1.537
  Start of MODEL   15
11425    HD3  ARG 117           HD3      ARG 117  -8.950 -19.085  -3.111
  Start of MODEL   15
11426    HE   ARG 117           HE       ARG 117  -6.528 -18.685  -1.459
  Start of MODEL   15
11427   HH11  ARG 117          HH11      ARG 117  -8.501 -20.697  -3.563
  Start of MODEL   15
11428   HH12  ARG 117          HH12      ARG 117  -7.422 -22.053  -3.459
  Start of MODEL   15
11429   HH21  ARG 117          HH21      ARG 117  -5.145 -20.463  -1.316
  Start of MODEL   15
11430   HH22  ARG 117          HH22      ARG 117  -5.521 -21.941  -2.156
  Start of MODEL   15
11431    H    THR 118           H        THR 118  -7.062 -12.581  -1.414
  Start of MODEL   15
11432    HA   THR 118           HA       THR 118  -4.254 -12.531  -0.779
  Start of MODEL   15
11433    HB   THR 118           HB       THR 118  -5.234 -10.460  -1.517
  Start of MODEL   15
11434    HG1  THR 118           HG1      THR 118  -3.639 -10.430   0.260
  Start of MODEL   15
11435   HG21  THR 118          HG21      THR 118  -7.116 -10.678   0.832
  Start of MODEL   15
11436   HG23  THR 118          HG22      THR 118  -7.547 -10.827  -0.872
  Start of MODEL   15
11437   HG22  THR 118          HG23      THR 118  -6.972  -9.284  -0.240
  Start of MODEL   15
11438    H    ASN 119           H        ASN 119  -3.403 -13.286   1.042
  Start of MODEL   15
11439    HA   ASN 119           HA       ASN 119  -5.191 -14.409   3.021
  Start of MODEL   15
11440    HB2  ASN 119           HB2      ASN 119  -3.310 -15.749   2.182
  Start of MODEL   15
11441    HB3  ASN 119           HB3      ASN 119  -2.176 -14.548   2.787
  Start of MODEL   15
11442   HD21  ASN 119          HD21      ASN 119  -1.641 -14.516   4.910
  Start of MODEL   15
11443   HD22  ASN 119          HD22      ASN 119  -2.152 -15.723   6.051
  Start of MODEL   15
11444    H    VAL 120           H        VAL 120  -5.896 -13.187   4.612
  Start of MODEL   15
11445    HA   VAL 120           HA       VAL 120  -3.922 -11.636   6.149
  Start of MODEL   15
11446    HB   VAL 120           HB       VAL 120  -6.817 -10.849   5.711
  Start of MODEL   15
11447    H    GLN 121           H        GLN 121  -3.696 -12.582   8.080
  Start of MODEL   15
11448    HA   GLN 121           HA       GLN 121  -6.020 -13.972   9.206
  Start of MODEL   15
11449    HB2  GLN 121           HB2      GLN 121  -4.294 -15.535   8.334
  Start of MODEL   15
11450    HB3  GLN 121           HB3      GLN 121  -3.139 -14.843   9.464
  Start of MODEL   15
11451    HG2  GLN 121           HG2      GLN 121  -4.409 -15.640  11.336
  Start of MODEL   15
11452    HG3  GLN 121           HG3      GLN 121  -5.715 -16.166  10.274
  Start of MODEL   15
11453   HE21  GLN 121          HE21      GLN 121  -5.468 -17.995   9.045
  Start of MODEL   15
11454   HE22  GLN 121          HE22      GLN 121  -4.234 -19.168   9.348
  Start of MODEL   15
11455    H5'   DG   1           H5'       DG   1  19.203  -6.846  -5.701
  Start of MODEL   15
11456    H4'   DG   1           H4'       DG   1  16.730  -6.485  -6.293
  Start of MODEL   15
11457    H3'   DG   1           H3'       DG   1  17.453  -4.069  -7.297
  Start of MODEL   15
11458    H2'   DG   1           H2'       DG   1  18.127  -2.986  -5.293
  Start of MODEL   15
11459    H1'   DG   1           H1'       DG   1  15.936  -4.422  -3.728
  Start of MODEL   15
11460    H8    DG   1           H8        DG   1  19.783  -3.909  -3.739
  Start of MODEL   15
11461    H1    DG   1           H1        DG   1  16.833  -2.913   1.876
  Start of MODEL   15
11462    H22   DG   1           H21       DG   1  13.941  -3.749   0.155
  Start of MODEL   15
11463    H21   DG   1           H22       DG   1  14.670  -3.267   1.674
  Start of MODEL   15
11464   HO5'   DG   1           H5T       DG   1  19.578  -4.534  -5.477
  Start of MODEL   15
11465   H5''   DG   1          5H''       DG   1  18.752  -6.480  -7.375
  Start of MODEL   15
11466   H2''   DG   1          2H''       DG   1  16.407  -2.630  -5.226
  Start of MODEL   15
11467    H5'   DG   2           H5'       DG   2  14.788  -3.243 -10.776
  Start of MODEL   15
11468    H4'   DG   2           H4'       DG   2  12.726  -2.918  -9.949
  Start of MODEL   15
11469    H3'   DG   2           H3'       DG   2  13.405  -0.742 -11.386
  Start of MODEL   15
11470    H2'   DG   2           H2'       DG   2  14.159   0.604  -9.514
  Start of MODEL   15
11471    H1'   DG   2           H1'       DG   2  11.704  -0.463  -8.026
  Start of MODEL   15
11472    H8    DG   2           H8        DG   2  15.351   0.792  -7.608
  Start of MODEL   15
11473    H1    DG   2           H1        DG   2  11.611   1.041  -2.399
  Start of MODEL   15
11474    H22   DG   2           H21       DG   2   9.275  -0.549  -4.416
  Start of MODEL   15
11475    H21   DG   2           H22       DG   2   9.642   0.140  -2.854
  Start of MODEL   15
11476   H5''   DG   2          5H''       DG   2  15.354  -1.624 -10.325
  Start of MODEL   15
11477   H2''   DG   2          2H''       DG   2  12.490   1.128  -9.696
  Start of MODEL   15
11478    H5'   DT   3           H5'       DT   3  10.480  -3.116  -9.937
  Start of MODEL   15
11479    H4'   DT   3           H4'       DT   3   8.528  -4.784 -10.235
  Start of MODEL   15
11480    H3'   DT   3           H3'       DT   3   8.968  -4.711 -12.911
  Start of MODEL   15
11481    H2'   DT   3           H2'       DT   3   8.432  -2.395 -13.253
  Start of MODEL   15
11482    H1'   DT   3           H1'       DT   3   6.171  -2.720 -11.206
  Start of MODEL   15
11483    H3    DT   3           H3        DT   3   5.759   1.631 -13.024
  Start of MODEL   15
11484    H71   DT   3           H71       DT   3   8.766   3.000  -9.859
  Start of MODEL   15
11485    H73   DT   3           H72       DT   3   9.745   1.542  -9.573
  Start of MODEL   15
11486    H72   DT   3           H73       DT   3   8.309   1.859  -8.571
  Start of MODEL   15
11487    H6    DT   3           H6        DT   3   8.470  -0.700  -9.869
  Start of MODEL   15
11488   H5''   DT   3          5H''       DT   3  10.733  -4.702 -10.682
  Start of MODEL   15
11489   H2''   DT   3          2H''       DT   3   6.853  -3.132 -13.491
  Start of MODEL   15
11490    H5'   DG   4           H5'       DG   4   4.750  -7.234  -9.917
  Start of MODEL   15
11491    H4'   DG   4           H4'       DG   4   6.199  -6.005  -8.093
  Start of MODEL   15
11492    H3'   DG   4           H3'       DG   4   3.364  -6.153  -8.523
  Start of MODEL   15
11493    H2'   DG   4           H2'       DG   4   2.958  -3.843  -8.582
  Start of MODEL   15
11494    H1'   DG   4           H1'       DG   4   5.668  -3.341  -7.251
  Start of MODEL   15
11495    H8    DG   4           H8        DG   4   6.097  -0.866  -7.341
  Start of MODEL   15
11496    H1    DG   4           H1        DG   4   2.450  -0.124 -12.569
  Start of MODEL   15
11497    H22   DG   4           H21       DG   4   1.990  -3.559 -12.343
  Start of MODEL   15
11498    H21   DG   4           H22       DG   4   1.631  -2.080 -13.202
  Start of MODEL   15
11499   H5''   DG   4          5H''       DG   4   5.136  -5.778 -10.861
  Start of MODEL   15
11500   H2''   DG   4          2H''       DG   4   3.373  -3.880  -6.869
  Start of MODEL   15
11501    H5'   DT   5           H5'       DT   5   3.616  -9.579  -3.822
  Start of MODEL   15
11502    H4'   DT   5           H4'       DT   5   2.973  -8.054  -2.200
  Start of MODEL   15
11503    H3'   DT   5           H3'       DT   5   1.165  -9.983  -2.784
  Start of MODEL   15
11504    H2'   DT   5           H2'       DT   5  -0.220  -8.656  -4.244
  Start of MODEL   15
11505    H1'   DT   5           H1'       DT   5   0.149  -6.362  -2.252
  Start of MODEL   15
11506    H3    DT   5           H3        DT   5  -2.845  -4.082  -4.774
  Start of MODEL   15
11507    H72   DT   5           H71       DT   5   0.896  -3.882  -7.880
  Start of MODEL   15
11508    H73   DT   5           H72       DT   5   1.280  -5.621  -7.900
  Start of MODEL   15
11509    H71   DT   5           H73       DT   5  -0.252  -5.039  -8.595
  Start of MODEL   15
11510    H6    DT   5           H6        DT   5   1.261  -6.335  -5.686
  Start of MODEL   15
11511   H5''   DT   5          5H''       DT   5   2.283  -9.139  -4.908
  Start of MODEL   15
11512   H2''   DT   5          2H''       DT   5  -1.033  -8.439  -2.705
  Start of MODEL   15
11513    H5'   DG   6           H5'       DG   6   3.007  -7.549   1.543
  Start of MODEL   15
11514    H4'   DG   6           H4'       DG   6   3.595  -8.322   3.893
  Start of MODEL   15
11515    H3'   DG   6           H3'       DG   6   2.089 -10.551   3.480
  Start of MODEL   15
11516    H2'   DG   6           H2'       DG   6  -0.065  -9.531   3.384
  Start of MODEL   15
11517    H1'   DG   6           H1'       DG   6   0.782  -7.509   5.510
  Start of MODEL   15
11518    H8    DG   6           H8        DG   6  -0.954  -7.988   2.084
  Start of MODEL   15
11519    H1    DG   6           H1        DG   6  -3.376  -3.415   5.890
  Start of MODEL   15
11520    H22   DG   6           H21       DG   6  -0.678  -4.164   7.930
  Start of MODEL   15
11521    H21   DG   6           H22       DG   6  -2.102  -3.183   7.661
  Start of MODEL   15
11522   H5''   DG   6          5H''       DG   6   3.690  -9.172   1.755
  Start of MODEL   15
11523   H2''   DG   6          2H''       DG   6   0.069  -9.761   5.122
  Start of MODEL   15
11524    H5'   DC   7           H5'       DC   7   3.710 -13.902   4.395
  Start of MODEL   15
11525    H4'   DC   7           H4'       DC   7   1.516 -14.563   3.981
  Start of MODEL   15
11526    H3'   DC   7           H3'       DC   7   0.700 -11.986   3.851
  Start of MODEL   15
11527   HO3'   DC   7           H3T       DC   7  -1.290 -12.875   3.560
  Start of MODEL   15
11528    H2'   DC   7           H2'       DC   7   0.573 -11.478   6.166
  Start of MODEL   15
11529    H1'   DC   7           H1'       DC   7  -0.425 -14.278   6.805
  Start of MODEL   15
11530    H42   DC   7           H41       DC   7   2.729 -11.719  12.056
  Start of MODEL   15
11531    H41   DC   7           H42       DC   7   1.593 -12.914  12.650
  Start of MODEL   15
11532    H5    DC   7           H5        DC   7   2.995 -11.217   9.702
  Start of MODEL   15
11533    H6    DC   7           H6        DC   7   2.255 -11.774   7.447
  Start of MODEL   15
11534   H5''   DC   7          5H''       DC   7   2.938 -12.506   3.618
  Start of MODEL   15
11535   H2''   DC   7          2H''       DC   7  -1.033 -12.158   5.946

  No H/Q in entry =       11535