DSSP OUTPUT


==== Secondary Structure Definition by the program DSSP, CMBI version 3.0.1                          ==== DATE=2019-06-21      .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637                                                              .
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COMPND                                                                                                                         .
SOURCE                                                                                                                         .
AUTHOR                                                                                                                         .
  116  1  0  0  0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN)                .
  6662.5   ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2)                                                                         .
   71 61.2   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J)  , SAME NUMBER PER 100 RESIDUES                              .
    0  0.0   TOTAL NUMBER OF HYDROGEN BONDS IN     PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES                              .
    2  1.7   TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES                              .
    0  0.0   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES                              .
    1  0.9   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES                              .
    0  0.0   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES                              .
    0  0.0   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES                              .
    0  0.0   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES                              .
    0  0.0   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES                              .
    0  0.0   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES                              .
   12 10.3   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES                              .
    8  6.9   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES                              .
   43 37.1   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES                              .
    3  2.6   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES                              .
  1  2  3  4  5  6  7  8  9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30     *** HISTOGRAMS OF ***           .
  0  0  0  3  0  0  0  2  0  1  0  0  0  0  0  0  1  0  0  0  0  0  0  0  0  0  0  0  0  0    RESIDUES PER ALPHA HELIX         .
  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0    PARALLEL BRIDGES PER LADDER      .
  1  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0    ANTIPARALLEL BRIDGES PER LADDER  .
  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0    LADDERS PER SHEET                .
  #  RESIDUE AA STRUCTURE BP1 BP2  ACC     N-H-->O    O-->H-N    N-H-->O    O-->H-N    TCO  KAPPA ALPHA  PHI   PSI    X-CA   Y-CA   Z-CA            CHAIN AUTHCHAIN
    1    1   M     >        0   0  103      0, 0.0     4,-2.8     0, 0.0     5,-0.2   0.000 360.0 360.0 360.0 159.9    1.3    8.9  -12.5                           
    2    2   D  H  >  +     0   0  150      2,-0.2     4,-3.1     1,-0.2     5,-0.2   0.909 360.0  55.7 -62.5 -36.1    4.0    8.0  -10.1                           
    3    3   A  H  > S+     0   0    7      1,-0.2     4,-2.5     2,-0.2     5,-0.2   0.944 109.1  48.2 -61.8 -42.6    4.4    5.0  -12.5                           
    4    4   K  H  > S+     0   0   69      2,-0.2     4,-2.3     1,-0.2    -2,-0.2   0.912 112.5  45.6 -59.5 -46.4    4.8    7.6  -15.3                           
    5    5   K  H  X S+     0   0  142     -4,-2.8     4,-3.4     1,-0.2    -1,-0.2   0.932 113.9  50.8 -63.1 -42.3    7.3    9.7  -13.5                           
    6    6   M  H  X S+     0   0    7     -4,-3.1     4,-2.3    -5,-0.2    -2,-0.2   0.892 111.8  42.4 -61.8 -45.6    9.1    6.7  -12.6                           
    7    7   F  H  X S+     0   0    3     -4,-2.5     4,-3.5     2,-0.2     5,-0.3   0.863 117.3  51.9 -67.0 -36.4    9.4    5.1  -16.1                           
    8    8   L  H  X S+     0   0   56     -4,-2.3     4,-3.1    -5,-0.2     5,-0.3   0.936 106.5  51.9 -62.5 -46.8   10.2    8.5  -17.4                           
    9    9   A  H  X S+     0   0   22     -4,-3.4     4,-2.2     1,-0.2    -2,-0.2   0.937 120.7  33.1 -62.8 -42.3   12.9    9.0  -14.9                           
   10   10   L  H  X S+     0   0   16     -4,-2.3     4,-3.6     2,-0.2     5,-0.3   0.904 113.8  56.2 -82.5 -30.3   14.6    5.7  -15.7                           
   11   11   V  H  X S+     0   0    4     -4,-3.5     4,-3.7     1,-0.2     5,-0.2   0.968 113.4  46.4 -62.8 -40.2   13.8    5.6  -19.4                           
   12   12   L  H  X S+     0   0   57     -4,-3.1     4,-2.7    -5,-0.3    -2,-0.2   0.931 115.2  42.6 -64.8 -45.0   15.6    9.0  -19.5                           
   13   13   I  H  X S+     0   0   45     -4,-2.2     4,-3.2    -5,-0.3    -1,-0.2   0.927 117.3  48.2 -64.1 -40.5   18.5    8.1  -17.5                           
   14   14   A  H  X S+     0   0    2     -4,-3.6     4,-2.4     2,-0.2    -2,-0.2   0.907 111.4  48.4 -64.9 -42.6   18.8    4.8  -19.3                           
   15   15   T  H  X S+     0   0    2     -4,-3.7     4,-2.0    -5,-0.3    -1,-0.2   0.889 113.2  49.6 -64.6 -36.8   18.5    6.5  -22.6                           
   16   16   F  H  <>S+     0   0  106     -4,-2.7     5,-0.8     2,-0.2    -2,-0.2   0.919 107.6  53.8 -62.8 -42.9   21.2    9.0  -21.3                           
   17   17   A  H  <5S+     0   0   10     -4,-3.2     4,-0.3     1,-0.2    -1,-0.2   0.878 110.0  48.1 -62.2 -36.0   23.2    6.0  -20.3                           
   18   18   V  H  X5S+     0   0    0     -4,-2.4     4,-0.9    -5,-0.2     6,-0.3   0.949 120.5  35.5 -59.7 -48.9   22.8    5.0  -23.8                           
   19   19   I  T  <5S+     0   0   57     -4,-2.0    -2,-0.2     2,-0.3    -3,-0.2   0.618 116.1  48.3 -92.4 -22.2   23.8    8.5  -25.3                           
   20   20   P  T  45S+     0   0  120      0, 0.0    -1,-0.2     0, 0.0    -3,-0.2   0.645 111.4  53.7 -73.0 -15.1   26.4    9.6  -22.9                           
   21   21   S  T  4<  -     0   0  108     -4,-0.9     3,-1.3    -6,-0.2    -1,-0.3  -0.671  46.9  -9.8 129.1-144.9   27.0    7.8  -27.1                           
   23   23   A  T >  S+     0   0   82      1,-0.4     3,-1.5    -2,-0.2     4,-0.2   0.423 104.5  87.9 -84.2  11.0   25.2    7.6  -30.6                           
   24   24   T  T 3>  +     0   0   67     -6,-0.3     4,-2.8     1,-0.3    -1,-0.4   0.209  63.4 100.5 -65.1  -0.1   24.2    4.0  -30.0                           
   25   25   F  H <>  +     0   0   57     -3,-1.3     4,-2.2     2,-0.2    -1,-0.3   0.849  68.4  61.6 -41.1 -50.7   21.5    6.1  -28.5                           
   26   26   E  H <4 S+     0   0  161     -3,-1.5    -1,-0.2     1,-0.2    -2,-0.2   0.916 113.7  33.7 -57.0 -44.0   19.6    5.4  -31.6                           
   27   27   K  H  4 S+     0   0  161      1,-0.2     3,-0.3    -4,-0.2    -1,-0.2   0.816 126.0  36.9 -76.8 -41.9   19.6    1.7  -30.9                           
   28   28   D  H  < S+     0   0   21     -4,-2.8    -2,-0.2     1,-0.2    -3,-0.2   0.335  82.8  97.4-104.4   8.7   19.5    1.5  -27.2                           
   29   29   F  S >< S-     0   0   23     -4,-2.2     3,-0.6     1,-0.3     2,-0.4   0.648 102.5-128.2 -64.1 -18.5   17.1    4.6  -26.9                           
   30   30   I  T 3   -     0   0   17      1,-0.4    -1,-0.3    -3,-0.3     3,-0.1  -0.934  55.7 -26.1 158.9-107.1   15.3    1.3  -26.7                           
   31   31   T  T 3  S-     0   0   36     -2,-0.4     2,-2.5    -3,-0.1    -1,-0.4   0.619  85.0-165.2 -62.6 -37.3   12.4    0.4  -28.8                           
   32   32   R  S <> S+     0   0  102     -3,-0.6     4,-2.2     1,-0.2     5,-0.2  -0.559  79.6  53.6  68.8 -73.0   12.4    4.3  -28.6                           
   33   33   E  H  > S+     0   0  124     -2,-2.5     4,-1.3     1,-0.2    -1,-0.2   0.946 115.1  33.9 -63.3 -44.6    8.9    4.1  -29.9                           
   34   34   A  H  > S+     0   0   24      1,-0.2     4,-1.4     2,-0.2    -1,-0.2   0.915 120.2  45.3 -75.9 -37.4    7.5    1.7  -27.4                           
   35   35   I  H  > S+     0   0    4      1,-0.2     4,-3.3     2,-0.2    -1,-0.2   0.710 108.7  64.6 -76.2 -19.8    9.4    2.7  -24.2                           
   36   36   Q  H  X S+     0   0   48     -4,-2.2     4,-4.2     2,-0.2     5,-0.3   0.943  98.3  53.1 -62.1 -36.1    8.5    6.3  -25.5                           
   37   37   A  H  X S+     0   0   22     -4,-1.3     4,-2.0     1,-0.2    -2,-0.2   0.950 114.0  40.5 -56.1 -50.0    5.0    5.4  -24.9                           
   38   38   I  H  < S+     0   0    3     -4,-1.4   -30,-0.2     2,-0.2    -1,-0.2   0.908 121.1  43.1 -64.4 -43.7    5.8    4.4  -21.5                           
   39   39   L  H  < S+     0   0   24     -4,-3.3    -2,-0.2     1,-0.2    -1,-0.2   0.891 114.2  50.6 -67.6 -43.9    8.1    7.3  -20.9                           
   40   40   K  H  < S+     0   0  147     -4,-4.2     2,-0.3    -5,-0.2    -2,-0.2   0.815 112.3  15.9 -59.2 -44.7    5.9    9.8  -22.5                           
   41   41   K     <  -     0   0   87     -4,-2.0    -1,-0.1    -5,-0.3   -33,-0.0  -0.917  46.4-134.5-155.1 161.5    2.6    9.2  -20.7                           
   42   42   S        +     0   0   48     -2,-0.3    -1,-0.1     1,-0.1   -39,-0.0   0.782  67.0 114.4 -62.9 -36.2    0.1    7.9  -18.1                           
   43   43   A  S    S-     0   0   74      1,-0.2    -1,-0.1     2,-0.1    -5,-0.0   0.363  83.0 -15.2 -49.8 -51.7   -2.5    6.6  -20.3                           
   44   44   P        -     0   0   38      0, 0.0    -1,-0.2     0, 0.0     2,-0.1   0.845  38.9-173.3-111.7 -54.2   -3.1    2.8  -20.3                           
   45   45   L  S    S+     0   0   24      3,-0.1    -2,-0.1     1,-0.1    -7,-0.0  -0.099  94.5  74.1  58.4 -31.4   -0.3    0.7  -18.7                           
   46   46   S  S    S+     0   0   83      3,-0.2     3,-0.5    -2,-0.1    -1,-0.1   0.826 104.5  24.1 -66.8 -43.3   -2.9   -1.5  -20.3                           
   47   47   N  S    S+     0   0  122      1,-0.3     2,-0.6     4,-0.0     4,-0.1   0.752 132.5  41.3 -96.4 -35.9   -2.0   -0.9  -23.9                           
   48   48   I  S    S+     0   0   14    -11,-0.1     2,-3.3     2,-0.1    -1,-0.3  -0.690  77.8 173.2 -86.6  65.9    1.5    0.1  -23.0                           
   49   49   M  S    S-     0   0   78     -2,-0.6    -3,-0.2    -3,-0.5     3,-0.1  -0.151  77.8 -89.3 -70.5  49.6    1.2   -2.9  -20.6                           
   50   50   L  S    S-     0   0    0     -2,-3.3    -1,-0.2     1,-0.2    45,-0.1   0.829  82.5-131.7  54.1  46.5    4.8   -1.7  -20.5                           
   51   51   E    >>  -     0   0   71      3,-0.2     3,-2.4    -4,-0.1     4,-0.9   0.143   9.1 -97.6-114.8 162.0    4.4   -4.3  -23.2                           
   52   52   E  H 3> S+     0   0  133      1,-0.3     4,-2.7     2,-0.2     5,-0.3   0.597 117.4  50.5 -62.2 -37.2    6.0   -7.2  -24.4                           
   53   53   D  H 3> S+     0   0  121      1,-0.2     4,-2.8     2,-0.2    -1,-0.3   0.944 116.9  46.8 -60.0 -40.6    8.1   -5.9  -27.3                           
   54   54   V  H <> S+     0   0    0     -3,-2.4     4,-2.2     2,-0.2    -2,-0.2   0.921 111.9  46.6 -59.7 -45.4    9.4   -3.3  -24.7                           
   55   55   M  H  X S+     0   0   37     -4,-0.9     4,-3.3     1,-0.2     5,-0.2   0.972 120.1  44.0 -59.9 -46.4   10.1   -5.9  -21.9                           
   56   56   N  H  X S+     0   0   38     -4,-2.7     4,-2.6     2,-0.2     6,-0.2   0.850 109.1  51.5 -66.2 -42.4   11.8   -7.9  -24.4                           
   57   57   A  H  X S+     0   0   30     -4,-2.8     4,-2.8    -5,-0.3     5,-0.3   0.927 116.3  44.0 -60.0 -42.8   13.7   -5.4  -26.2                           
   58   58   L  H  X S+     0   0    0     -4,-2.2     4,-1.1     2,-0.2     7,-0.5   0.881 111.3  49.9 -65.9 -44.5   15.1   -4.2  -22.9                           
   59   59   I  H  < S+     0   0   66     -4,-3.3    -1,-0.2    -5,-0.2    -2,-0.2   0.932 119.4  43.4 -62.4 -39.6   15.8   -7.7  -21.5                           
   60   60   K  H  < S+     0   0  163     -4,-2.6     3,-0.4     1,-0.2    -2,-0.2   0.807 104.2  55.5 -71.9 -36.9   17.6   -8.3  -24.9                           
   61   61   S  H >< S+     0   0   22     -4,-2.8     3,-1.7     1,-0.3     2,-1.3   0.634  86.6 150.4 -73.5 -16.5   19.5   -5.0  -25.2                           
   62   62   K  T 3X  +     0   0  123     -4,-1.1     4,-2.0     1,-0.3     5,-0.3   0.102  45.3  72.2  65.1 -74.9   20.3   -6.7  -22.0                           
   63   63   S  H 3> S+     0   0   71     -2,-1.3     4,-0.7    -3,-0.4    -1,-0.3   0.749 108.6  30.9 -67.5 -44.8   23.6   -5.2  -21.8                           
   64   64   V  H <4 S+     0   0   18     -3,-1.7     6,-0.4     2,-0.2     7,-0.3   0.782 113.0  56.8 -74.7 -45.9   22.3   -1.8  -21.0                           
   65   65   I  H  4 S+     0   0   16     -7,-0.5    -2,-0.2     1,-0.2    -3,-0.1   0.719 125.6  19.6 -72.8 -12.4   19.1   -2.4  -19.1                           
   66   66   S  H  < S+     0   0   41     -4,-2.0    -1,-0.2     1,-0.2    -2,-0.2   0.641 109.2  69.8-109.8 -17.2   21.1   -4.5  -16.5                           
   67   67   N  S  < S-     0   0   91     -4,-0.7     3,-0.5    -5,-0.3    -1,-0.2  -0.932  95.8 -42.9-138.0 117.7   24.5   -3.9  -16.5                           
   68   68   P  S >> S+     0   0   66      0, 0.0     3,-2.2     0, 0.0     4,-0.9  -0.188 115.5  31.2  37.5-138.2   26.3   -0.6  -15.4                           
   69   69   V  H 3> S+     0   0   93      1,-0.3     4,-3.5     2,-0.2     5,-0.3   0.408 127.0  39.8 -53.0 -36.8   25.3    2.8  -16.1                           
   70   70   I  H 3> S+     0   0    3     -3,-0.5     4,-2.4    -6,-0.4    -1,-0.3   0.948 118.2  42.1 -64.4 -50.2   21.6    2.0  -16.1                           
   71   71   E  H <> S+     0   0   85     -3,-2.2     4,-2.0    -7,-0.3    -1,-0.2   0.967 123.1  46.1 -59.8 -43.0   21.2   -0.5  -13.3                           
   72   72   E  H  X S+     0   0   96     -4,-0.9     4,-2.2     1,-0.3    -2,-0.2   0.909 109.4  50.9 -68.5 -37.2   23.6    2.0  -11.4                           
   73   73   A  H  X S+     0   0   10     -4,-3.5     4,-2.7     1,-0.2    -1,-0.3   0.845 107.8  56.4 -63.0 -37.2   21.8    5.1  -12.4                           
   74   74   L  H  < S+     0   0    6     -4,-2.4     9,-0.7    -5,-0.3    -1,-0.2   0.922 104.4  50.1 -58.4 -42.4   18.8    3.3  -11.1                           
   75   75   L  H >< S+     0   0   81     -4,-2.0     3,-1.1     1,-0.2    -2,-0.2   0.885 114.0  46.6 -62.9 -39.0   20.4    2.8   -7.8                           
   76   76   K  H 3< S+     0   0  167     -4,-2.2     3,-0.3     1,-0.3    -2,-0.2   0.892 108.7  52.6 -62.7 -40.4   21.2    6.5   -7.8                           
   77   77   N  T 3X S+     0   0   36     -4,-2.7     4,-0.8     1,-0.2    -1,-0.3  -0.010  76.7 145.6 -87.1  25.6   17.8    7.5   -8.9                           
   78   78   N  T <4  +     0   0   57     -3,-1.1     2,-0.3     2,-0.1    -1,-0.2   0.445  51.4  70.5 -66.2  -9.1   16.8    5.4   -5.9                           
   79   79   N  T  4 S+     0   0  117     -3,-0.3     3,-0.0     1,-0.1     4,-0.0  -0.960  88.8  40.4-113.1 156.6   14.0    7.7   -5.3                           
   80   80   G  T  4 S+     0   0   62     -2,-0.3     2,-0.3     2,-0.0   -74,-0.2  -0.585 147.4   3.5  96.4 -52.1   11.0    7.9   -7.4                           
   81   81   L  S  < S-     0   0    1     -4,-0.8     2,-0.7    -7,-0.2     0, 0.0  -0.872  73.9-143.9-161.6 135.2   11.8    4.3   -7.2                           
   82   82   N  S    S-     0   0   70     -2,-0.3     2,-1.9    -3,-0.0     5,-0.5  -0.887  89.8 -38.5-106.0 106.1   14.5    2.6   -5.2                           
   83   83   G  S    S-     0   0    1     -2,-0.7     6,-0.2    -9,-0.7     9,-0.2  -0.613 134.2 -38.7  73.5 -87.4   15.7   -0.2   -7.3                           
   84   84   I  B >>  -A   88   0A   0     -2,-1.9     2,-5.0     4,-0.8     3,-2.9  -0.676  68.5-118.6-140.0 132.0   12.1   -0.2   -8.0                           
   85   85   P  T 34 S+     0   0   55      0, 0.0    30,-0.1     0, 0.0    -2,-0.1  -0.194  97.6 106.7 -70.9  58.5   10.1    0.6   -4.7                           
   86   86   C  T 34 S-     0   0    0     -2,-5.0    28,-1.0     2,-0.5    30,-0.6   0.501 113.7-109.2 -51.3 -40.0    8.8   -2.7   -5.5                           
   87   87   G  T <4 S+     0   0   26     -3,-2.9     2,-0.2    -5,-0.5    22,-0.1  -0.047  89.3  50.4 131.7 -13.9   11.2   -2.4   -2.6                           
   88   88   E  B  < S-A   84   0A  82     -4,-1.5    -4,-0.8    20,-0.1     2,-0.6  -0.769  99.9 -61.6-162.9 174.0   14.0   -4.1   -4.3                           
   89   89   S        +     0   0   35     -2,-0.2     2,-0.3    -6,-0.2    -6,-0.1  -0.586  64.1 154.4-103.9 121.2   16.0   -4.1   -7.4                           
   90   90   C        -     0   0    4     -2,-0.6     2,-0.6     9,-0.1    19,-0.1  -0.845  59.9-136.9-127.6 152.9   14.1   -4.8  -10.5                           
   91   91   V        +     0   0   32     -2,-0.3    16,-0.1    -7,-0.0    -7,-0.1  -0.979  46.2 173.5 -86.9  92.4   13.7   -4.5  -14.2                           
   92   92   W        +     0   0    1     -2,-0.6     4,-0.3    -9,-0.2    11,-0.1   0.173  20.8 139.3 -82.2   5.6   10.2   -3.9  -13.1                           
   93   93   I        -     0   0    7      1,-0.1    -1,-0.2   -38,-0.1     6,-0.1   0.589  62.3 -26.3 -58.4 -40.6    9.2   -3.0  -16.7                           
   94   94   P  S   >S+     0   0    5      0, 0.0     5,-0.8     0, 0.0     2,-0.5   0.739  82.2 102.9-116.8 -69.8    5.8   -4.5  -17.5                           
   95   95   C  T   5S-     0   0   65      3,-0.3     2,-0.1     1,-0.2    -2,-0.1   0.176  83.6-125.9 -62.0 -23.9    3.7   -7.4  -16.4                           
   96   96   I  T  >5S+     0   0   63     -2,-0.5     4,-1.5    -4,-0.3    -1,-0.2  -0.739 100.7  37.1 155.6 -48.7    1.7   -4.7  -14.5                           
   97   97   S  H  >5S+     0   0   62      2,-0.2     4,-1.4     1,-0.2    -2,-0.1   0.833 116.1  61.7 -61.6 -38.0    1.6   -5.5  -10.8                           
   98   98   S  H  45S+     0   0    1      4,-0.3     6,-0.5     5,-0.3    -3,-0.3   0.861 100.9  51.9 -61.1 -40.3    5.0   -6.7  -11.8                           
   99   99   A  H  4 -     0   0    4     -6,-0.5     5,-0.7    -7,-0.1     2,-0.3  -0.671  49.8-152.8 -63.6 141.0    9.1  -10.0  -11.7                           
  105  105   K  T   5S+     0   0  132     -2,-0.3     2,-1.0     3,-0.2    -2,-0.1  -0.919  70.3  28.7-133.4 159.0   10.9  -12.9  -10.2                           
  106  106   N  T   5S+     0   0  178     -2,-0.3    -1,-0.1     1,-0.0    -2,-0.0  -0.426 115.0  67.8  76.1 -50.0   14.6  -13.8  -10.4                           
  107  107   K  T   5S-     0   0   62     -2,-1.0    -2,-0.1   -16,-0.1   -18,-0.1   0.785 119.6-110.0 -55.4 -30.6   15.1  -10.1  -10.8                           
  108  108   V  T   5 +     0   0   49     -4,-0.2     2,-0.3     1,-0.2    -3,-0.2   0.892  59.3 154.7  73.8  95.9   14.0   -9.7   -7.1                           
  109  109   C      < -     0   0    8     -5,-0.7     2,-0.6    -7,-0.1    -1,-0.2  -0.897  38.7-140.4-152.6  85.1   10.6   -8.0   -7.2                           
  110  110   Y        -     0   0  110     -2,-0.3     4,-0.3     1,-0.2     6,-0.1  -0.552  12.1-162.4 -76.6 117.1    8.9   -9.0   -4.0                           
  111  111   R  S    S+     0   0  150     -2,-0.6     2,-0.5     2,-0.1    -1,-0.2   0.811  75.3  76.1 -75.1 -40.1    5.4   -9.5   -5.1                           
  112  112   K  S    S-     0   0  187      4,-0.1     2,-0.4     1,-0.1     4,-0.1  -0.718 105.6-114.5 -63.5 134.4    3.9   -9.3   -1.7                           
  113  113   S        -     0   0   68     -2,-0.5    -2,-0.1     1,-0.1   -26,-0.1  -0.696  30.2-162.6-118.3 129.4    4.2   -5.8   -1.8                           
  114  114   L  S    S-     0   0   83    -28,-1.0   -27,-0.1    -2,-0.4    -1,-0.1   0.720  93.4 -26.3-102.3 -37.7    6.5   -4.2    0.7                           
  115  115   D              0   0  161    -29,-0.3    -1,-0.1     1,-0.2   -28,-0.1   0.093 360.0 360.0-112.2 -17.6    5.4   -0.7    0.7                           
  116  116   I              0   0   95    -30,-0.6    -2,-0.3    -6,-0.1    -1,-0.2  -0.695 360.0 360.0 139.3 360.0    4.3   -1.7   -2.9