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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AUTHOR                                                                                                                         .
  135  1  0  0  0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN)                .
  7400.1   ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2)                                                                         .
   67 49.6   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                              .
    6  4.4   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                              .
    0  0.0   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES                              .
    1  0.7   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES                              .
    1  0.7   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES                              .
    2  1.5   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                              .
    7  5.2   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES                              .
    6  4.4   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES                              .
   42 31.1   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES                              .
    3  2.2   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  1  0  0  1  1  0  1  0  0  2  0  0  0  0  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  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    ANTIPARALLEL 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    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    1      0, 0.0     3,-3.5     0, 0.0     7,-0.5   0.000 360.0 360.0 360.0-174.9   -8.5   -3.5   -1.4                           
    2    2   E  T 3   +     0   0  117      1,-0.3   114,-0.1     2,-0.1   113,-0.0   0.176 360.0  70.0 -75.2  11.0  -11.1   -2.5   -3.9                           
    3    3   A  T 3  S-     0   0    8     13,-0.1    -1,-0.3   112,-0.1    14,-0.2   0.329  97.3-154.2 -87.8  -4.9  -10.1    0.3   -1.6                           
    4    4   V    <   +     0   0    0     -3,-3.5    87,-0.2     1,-0.3     5,-0.2   0.553  64.8 115.1  59.3  -0.5   -6.8    0.2   -3.5                           
    5    5   K  S    S+     0   0   11      2,-0.1    -1,-0.3    36,-0.1    37,-0.1   0.785  77.1  45.3 -68.2 -29.9   -5.4    1.7   -0.4                           
    6    6   S  S    S-     0   0    0     -5,-0.1   110,-0.1    35,-0.1    87,-0.1   0.978 133.2 -85.8 -83.3 -71.9   -3.4   -1.4    0.1                           
    7    7   L  S    S+     0   0    1    109,-0.2     3,-0.4    -6,-0.1     4,-0.2   0.256  85.9 129.6-170.2  61.3   -2.3   -1.5   -3.4                           
    8    8   I    >   +     0   0    0     -7,-0.5     2,-6.6     1,-0.2     3,-2.5   0.928  48.9 143.4 -61.7 -35.7   -4.7   -3.3   -6.0                           
    9    9   V  T 3   +     0   0    1      3,-0.4    -1,-0.2     1,-0.3     9,-0.1   0.149  67.7  33.7  59.3 -42.9   -3.4    0.3   -7.1                           
   10   10   C  T 3  S+     0   0   33     -2,-6.6    -1,-0.3    -3,-0.4     4,-0.3   0.726 116.5  48.0-120.9 -43.0   -3.4   -1.1  -10.6                           
   11   11   V  S <  S+     0   0   77     -3,-2.5    -2,-0.2    -4,-0.2     3,-0.1   0.798 135.9  22.6 -62.4 -42.9   -6.2   -3.6  -10.8                           
   12   12   L  S    S+     0   0   29      1,-0.1     7,-0.5   -11,-0.1     6,-0.4   0.095  85.7 104.6-127.4  42.6   -8.0   -0.6   -9.2                           
   13   13   V  S    S+     0   0    7     -5,-0.3     2,-0.4   121,-0.3     9,-0.2   0.819  95.7  49.6 -61.1 -35.3   -6.0    2.6  -10.1                           
   14   14   L  S    S+     0   0  106     -4,-0.3     2,-0.2     4,-0.1    -1,-0.1  -0.919 117.4  22.0-112.5 142.6   -8.9    2.7  -12.3                           
   15   15   G  S    S+     0   0   55     -2,-0.4    -1,-0.1     1,-0.4    -3,-0.1  -0.518 128.9  50.4  91.5 -57.8  -12.3    2.2  -10.9                           
   16   16   L  S >  S-     0   0   49     -4,-0.4     3,-2.1    -2,-0.2    -1,-0.4  -0.177 108.8 -49.8 -98.9-164.3  -10.8    3.2   -7.6                           
   17   17   V  T 3> S+     0   0   22      1,-0.4     4,-3.5     2,-0.3     5,-0.3   0.513 122.8  54.7 -61.4 -39.3   -8.6    5.9   -5.9                           
   18   18   L  H 3> S+     0   0    1     -6,-0.4     4,-2.3     2,-0.3    -1,-0.4   0.719 102.3  66.7 -62.1 -20.6   -5.6    6.4   -8.0                           
   19   19   Q  H <4 S+     0   0   69     -3,-2.1     4,-0.4    -7,-0.5    -2,-0.3   0.943 107.7  37.6 -62.0 -41.0   -8.4    6.9  -10.5                           
   20   20   H  H  > S+     0   0   85      2,-0.2     4,-0.7     3,-0.2     6,-0.3   0.887 118.1  47.6 -61.3 -46.0   -9.0   10.0   -8.3                           
   21   21   E  H  X S+     0   0   24     -4,-3.5     4,-3.5     1,-0.2    -3,-0.2   0.828 118.0  46.4 -72.7 -25.6   -5.3   10.7   -7.8                           
   22   22   H  H  < S+     0   0   91     -4,-2.3    -2,-0.2     2,-0.3    -1,-0.2   0.497  96.0  62.2-102.1   4.8   -5.2   10.3  -11.4                           
   23   23   I  H  4 S-     0   0  136     -4,-0.4    -1,-0.2    -6,-0.2    -2,-0.2   0.482 148.7 -64.4 -74.0 -13.9   -8.1   12.4  -12.2                           
   24   24   Q  H  <  -     0   0  131     -4,-0.7    -2,-0.3    -6,-0.2    -3,-0.2   0.719  55.6 -93.6 136.8  95.4   -5.2   14.1  -10.6                           
   25   25   V     <  +     0   0   43     -4,-3.5    -4,-0.2    -7,-0.1     3,-0.1   0.235  58.2 155.0  53.2  39.6   -3.6   13.8   -7.3                           
   26   26   E        +     0   0   99     -6,-0.3    -1,-0.1     1,-0.1    -2,-0.1  -0.165  40.1  51.9 -83.0-171.2   -5.2   16.3   -5.0                           
   27   27   A  S    S-     0   0   25     36,-0.2     2,-0.4     1,-0.2    36,-0.2   0.854  75.0-137.0  58.6  71.5   -5.6   16.4   -1.2                           
   28   28   K  E     -A   62   0A  41     34,-2.2    34,-2.7    36,-0.3     2,-0.4  -0.496  24.7-178.9 -94.4 119.6   -2.2   15.8    0.3                           
   29   29   S  E     -A   61   0A  12     -2,-0.4     2,-0.3    32,-0.2    32,-0.2  -0.904   1.7-176.4-121.1 129.8   -1.9   13.5    3.1                           
   30   30   C  E     -A   60   0A   3     30,-2.5    30,-2.2    -2,-0.4    42,-0.1  -0.997   3.8-168.6-148.3 157.2    1.3   12.6    5.1                           
   31   31   C        -     0   0    2     -2,-0.3    28,-0.2    28,-0.3    27,-0.1  -0.792  32.3-122.5-141.3 146.2    2.4   10.3    7.8                           
   32   32   P  S    S+     0   0   66      0, 0.0     2,-0.3     0, 0.0    27,-0.1   0.713  91.7   1.5 -65.6 -19.6    5.2    9.5   10.1                           
   33   33   S  S  > S-     0   0   28     25,-0.2     4,-1.6     1,-0.1    -2,-0.1  -0.895  76.7 -96.9-158.5 168.3    5.6    6.0    9.0                           
   34   34   T  H  > S+     0   0   27     -2,-0.3     4,-2.8     2,-0.2     5,-0.2   0.830 124.2  56.7 -60.4 -41.1    4.4    3.4    6.7                           
   35   35   T  H  > S+     0   0   85      1,-0.2     4,-2.3     2,-0.2     5,-0.2   0.904 108.4  48.7 -62.1 -39.9    2.2    2.1    9.5                           
   36   36   A  H  > S+     0   0    3      2,-0.2     4,-2.9     1,-0.2    -1,-0.2   0.910 109.6  49.2 -63.4 -42.6    0.7    5.6    9.6                           
   37   37   R  H  X S+     0   0   36     -4,-1.6     4,-3.0     2,-0.2    -2,-0.2   0.915 112.2  50.3 -65.4 -41.1    0.1    5.8    5.9                           
   38   38   N  H  X S+     0   0    5     -4,-2.8     4,-3.0     2,-0.2    -2,-0.2   0.930 112.8  45.2 -63.8 -42.9   -1.5    2.4    6.0                           
   39   39   I  H  X S+     0   0   38     -4,-2.3     4,-3.2     2,-0.2    -2,-0.2   0.920 113.5  49.9 -64.5 -42.9   -3.8    3.4    8.9                           
   40   40   Y  H  X S+     0   0    0     -4,-2.9     4,-2.2     2,-0.2    -2,-0.2   0.933 115.3  44.5 -58.4 -47.8   -4.6    6.6    7.2                           
   41   41   N  H  X S+     0   0    1     -4,-3.0     4,-2.1     2,-0.2    -2,-0.2   0.905 113.9  47.6 -62.1 -44.8   -5.4    4.8    4.1                           
   42   42   S  H  X S+     0   0   16     -4,-3.0     4,-2.3     2,-0.2    -2,-0.2   0.878 111.6  53.0 -66.0 -39.6   -7.4    2.1    5.9                           
   43   43   C  H  X>S+     0   0   11     -4,-3.2     5,-1.9     2,-0.3     4,-1.7   0.879 104.5  53.5 -61.2 -40.4   -9.2    4.8    7.8                           
   44   44   R  H  <5S+     0   0   42     -4,-2.2    -1,-0.2     2,-0.2    -2,-0.2   0.876 108.5  53.0 -59.2 -41.6  -10.1    6.5    4.5                           
   45   45   F  H  <5S+     0   0   66     -4,-2.1    -2,-0.3     1,-0.2    -1,-0.2   0.925 102.0  55.6 -56.1 -46.5  -11.4    3.1    3.6                           
   46   46   T  H  <5S-     0   0  112     -4,-2.3    -2,-0.2     1,-0.1    -1,-0.2   0.837 119.9-117.0 -57.0 -34.3  -13.5    3.1    6.7                           
   47   47   G  T  <5 +     0   0   61     -4,-1.7    -3,-0.2     1,-0.4    -2,-0.1   0.455  62.4 150.8 113.0  12.6  -14.9    6.4    5.3                           
   48   48   A      < -     0   0   17     -5,-1.9    -1,-0.4     1,-0.1     2,-0.0  -0.367  54.6 -99.6 -70.1 147.8  -13.6    8.5    8.1                           
   49   49   S     >  -     0   0   72      1,-0.1     4,-2.1    -2,-0.1     5,-0.1  -0.315  33.1-110.0 -70.0 156.6  -12.9   12.1    7.1                           
   50   50   R  H  > S+     0   0   78      1,-0.2     4,-3.3     2,-0.2     5,-0.2   0.839 116.6  56.3 -63.1 -39.3   -9.3   12.9    6.4                           
   51   51   D  H  > S+     0   0   88      2,-0.2     4,-3.3     1,-0.2    -1,-0.2   0.931 111.4  46.0 -60.8 -44.6   -8.8   15.1    9.5                           
   52   52   K  H  > S+     0   0  119      2,-0.2     4,-2.4     1,-0.2    -2,-0.2   0.915 113.3  48.1 -59.4 -43.7  -10.0   12.1   11.7                           
   53   53   C  H  X S+     0   0    0     -4,-2.1     4,-2.7     1,-0.2    -2,-0.2   0.913 115.4  46.8 -62.5 -43.7   -7.8    9.7    9.8                           
   54   54   C  H  X>S+     0   0    4     -4,-3.3     4,-2.4     1,-0.2     5,-1.9   0.944 110.0  49.9 -62.6 -48.9   -5.0   12.1   10.2                           
   55   55   K  H  <5S+     0   0  176     -4,-3.3    -1,-0.2     1,-0.2    -2,-0.2   0.906 118.5  39.8 -62.3 -42.2   -5.4   12.8   13.8                           
   56   56   I  H  <5S+     0   0  108     -4,-2.4    -1,-0.2    -5,-0.2    -2,-0.2   0.928 117.8  47.7 -63.9 -48.0   -5.6    9.0   14.6                           
   57   57   S  H  <5S-     0   0   15     -4,-2.7    -2,-0.2    -5,-0.2    -3,-0.2   0.729 109.6-111.5 -64.5 -40.2   -2.8    7.9   12.2                           
   58   58   G  T  <5S+     0   0   33     -4,-2.4     2,-0.2     1,-0.4   -25,-0.2   0.796  81.5 122.5  86.5  47.5   -0.2   10.4   13.0                           
   59   59   C      < -     0   0    6     -5,-1.9    -1,-0.4   -28,-0.2     2,-0.3  -0.762  49.5-145.2-120.9 163.7   -0.7   11.9    9.7                           
   60   60   K  E     -A   30   0A 116    -30,-2.2   -30,-2.5    -2,-0.2     2,-0.5  -0.943  10.1-129.3-133.0 165.6   -1.7   15.5    8.5                           
   61   61   I  E     -A   29   0A  60     -2,-0.3     2,-0.3   -32,-0.2   -32,-0.2  -0.962  22.9-179.9-126.8 130.9   -3.7   16.9    5.7                           
   62   62   V  E     -A   28   0A  28    -34,-2.7   -34,-2.2    -2,-0.5    -2,-0.0  -0.997  29.3-156.9-128.6 126.9   -2.6   19.6    3.3                           
   63   63   D  S    S+     0   0  149     -2,-0.3   -36,-0.2   -36,-0.2    -1,-0.1   0.854  81.8  86.4 -63.9 -37.0   -4.3   21.4    0.4                           
   64   64   G  S    S-     0   0   33      2,-0.1   -36,-0.3     1,-0.1    -2,-0.2  -0.268  87.7-126.7 -62.6 146.5   -0.7   22.2   -0.8                           
   65   65   K  S    S+     0   0  111    -38,-0.1    -1,-0.1    -2,-0.1     2,-0.1   0.831  83.7 103.7 -63.5 -35.0    1.3   19.7   -2.9                           
   66   66   C  S    S-     0   0   82      1,-0.1    -2,-0.1   -38,-0.0   -38,-0.1  -0.290  70.1-136.6 -60.4 130.2    4.0   20.1   -0.3                           
   67   67   K        -     0   0   79      1,-0.1     5,-0.1    -2,-0.1    -1,-0.1  -0.725  35.0-103.1 -82.8 139.8    4.6   17.4    2.3                           
   68   68   P        -     0   0   25      0, 0.0    -1,-0.1     0, 0.0    -8,-0.0  -0.303  27.3-124.6 -61.0 136.4    5.1   18.8    5.8                           
   69   69   P  S    S+     0   0  115      0, 0.0     3,-0.4     0, 0.0    -2,-0.0   0.864 107.4  32.9 -63.0 -40.6    8.7   18.8    6.9                           
   70   70   F  S    S+     0   0  177      1,-0.2     2,-2.2     3,-0.0    -3,-0.0   0.953 116.9  56.3 -64.9 -41.5    8.3   16.9   10.0                           
   71   71   I  S    S+     0   0    9    -41,-0.1     2,-0.7     2,-0.0    -1,-0.2  -0.429  81.5 142.6 -84.9  56.5    5.5   14.8    8.7                           
   72   72   H        +     0   0   95     -2,-2.2     2,-0.2    -3,-0.4     3,-0.1  -0.903  14.9 157.5-118.6 119.8    7.6   13.7    5.9                           
   73   73   H        +     0   0   21     -2,-0.7   -42,-0.2     1,-0.1   -40,-0.1  -0.657  17.8 138.0-137.3  88.1    7.3   10.3    4.7                           
   74   74   T        -     0   0   41     -2,-0.2    14,-0.1   -44,-0.1    -1,-0.1   0.559  55.3-148.0 -98.0 -11.7    8.4    9.4    1.2                           
   75   75   L        -     0   0   39     -3,-0.1    13,-0.1     2,-0.1    -2,-0.0   0.437  39.4 -25.9  77.5 166.0   10.0    6.3    2.5                           
   76   76   H        -     0   0  136      1,-0.2     2,-1.0     8,-0.1     9,-0.4  -0.047  49.2-141.6 -71.6 130.0   12.9    4.5    1.3                           
   77   77   P        -     0   0   71      0, 0.0     3,-0.2     0, 0.0    -1,-0.2  -0.785  17.5-154.6 -70.8 114.3   13.8    5.0   -2.4                           
   78   78   D        +     0   0   53     -2,-1.0     2,-5.4     1,-0.3     4,-0.2   0.777  21.9 177.5 -68.4 -23.0   14.7    1.5   -2.6                           
   79   79   S  S    S+     0   0   88      2,-0.7    -1,-0.3     1,-0.4     2,-0.1  -0.109  70.8  69.9  70.6 -54.6   16.7    2.9   -5.3                           
   80   80   E  S    S+     0   0  187     -2,-5.4    -1,-0.4    -3,-0.2     2,-0.2  -0.510 115.6  24.7 -91.7  53.9   18.1   -0.5   -5.7                           
   81   81   E  S    S-     0   0  129     -2,-0.1     2,-1.9     2,-0.1    -2,-0.7  -0.292  83.4-121.1-164.8 166.9   14.8   -1.2   -6.8                           
   82   82   S  S    S+     0   0   78     -4,-0.2    -2,-0.0    -2,-0.2     0, 0.0  -0.474  83.7 104.3 -85.8  69.6   12.1    0.9   -8.4                           
   83   83   D     >  +     0   0   14     -2,-1.9     4,-3.1    -7,-0.1     5,-0.3   0.531  69.2  26.6-114.3 -99.1    9.8   -0.1   -5.4                           
   84   84   V  H  > S+     0   0   11      1,-0.2     4,-1.5     2,-0.2     5,-0.2   0.796 123.9  39.8 -62.2 -36.7    8.9    2.2   -2.5                           
   85   85   L  H >4 S+     0   0   69     -9,-0.4     3,-0.5     2,-0.2     4,-0.3   0.980 121.0  42.3 -65.8 -50.6    9.3    5.6   -4.0                           
   86   86   D  H 34 S+     0   0   58      1,-0.2    -1,-0.2    -3,-0.2    -2,-0.2   0.818 128.6  35.5 -63.6 -33.2    7.8    4.8   -7.4                           
   87   87   F  H 3< S+     0   0   11     -4,-3.1    -1,-0.2     1,-0.2    -2,-0.2   0.264  98.3  71.4-112.1  11.5    5.1    2.8   -5.4                           
   88   88   C  S << S+     0   0   25     -4,-1.5    -1,-0.2    -3,-0.5    -3,-0.2   0.317  80.6  88.9 -88.4  -1.0    4.7    4.9   -2.3                           
   89   89   K  S    S+     0   0  130     -4,-0.3     2,-0.3    -5,-0.2    -2,-0.2   0.810 110.6   8.6 -61.2 -36.7    3.0    7.0   -5.0                           
   90   90   L  S    S-     0   0    6     -3,-0.2   -85,-0.1     1,-0.1   -86,-0.0  -0.799 133.1 -59.1-117.2 177.2    0.0    5.1   -4.2                           
   91   91   G  S    S-     0   0    2     -2,-0.3    -1,-0.1   -87,-0.2    -3,-0.1  -0.211  72.7-103.7 -76.2 171.8    0.6    3.0   -1.0                           
   92   92   C        -     0   0    4     -4,-0.1     2,-0.3   -58,-0.1    -3,-0.1   0.810  37.4 -41.2 -95.2 -65.8    3.2    0.7   -1.2                           
   93   93   T     >  -     0   0   10      1,-0.1     4,-3.3   -87,-0.1     5,-0.2  -0.841  57.1 -75.7-166.5 170.1    4.4   -2.9   -1.4                           
   94   94   S  H  > S+     0   0    3     -2,-0.3     4,-2.2     1,-0.3     5,-0.1   0.893 126.8  45.4 -59.9 -41.7    3.9   -6.4   -0.6                           
   95   95   S  H  > S+     0   0   78      2,-0.2     4,-2.3     1,-0.2    -1,-0.3   0.877 113.8  47.3 -62.7 -42.9    5.3   -6.0    2.7                           
   96   96   V  H  > S+     0   0    8      2,-0.2     4,-1.5     1,-0.2    -2,-0.2   0.891 113.0  49.8 -62.7 -40.1    3.3   -2.9    3.5                           
   97   97   C  H  < S+     0   0    0     -4,-3.3     4,-0.5     2,-0.2    -2,-0.2   0.826 109.1  52.1 -69.0 -33.5    0.3   -4.5    2.2                           
   98   98   S  H  X S+     0   0   52     -4,-2.2     4,-2.1    -5,-0.2     3,-0.5   0.851 102.3  61.9 -62.5 -38.4    1.2   -7.6    4.5                           
   99   99   N  H  X S+     0   0   76     -4,-2.3     4,-2.1     1,-0.2    -2,-0.2   0.916 108.8  41.1 -56.1 -40.5    1.4   -5.0    7.3                           
  100  100   M  H  X S+     0   0    1     -4,-1.5     4,-0.5     2,-0.3    -1,-0.2   0.399 102.8  63.8-101.9   8.8   -2.3   -4.3    6.7                           
  101  101   N  H  4 S+     0   0   45     -3,-0.5    -1,-0.2    -4,-0.5    -2,-0.2   0.728 114.5  41.3 -60.1 -42.4   -3.3   -7.9    6.3                           
  102  102   T  H >X S+     0   0   90     -4,-2.1     3,-2.3     1,-0.1     4,-0.5   0.926  97.8  67.8 -65.7 -49.0   -2.1   -7.7    9.7                           
  103  103   F  H 3< S+     0   0  103     -4,-2.1     2,-0.4     1,-0.5    -1,-0.1   0.797 127.1  17.3 -57.1 -43.5   -3.5   -4.5   11.0                           
  104  104   A  T 3< S+     0   0    5     -4,-0.5    -1,-0.5     2,-0.1    12,-0.1  -0.914  75.2 134.9-106.5 105.0   -6.7   -6.2   10.6                           
  105  105   G  T <4 S+     0   0   23     -3,-2.3    -2,-0.2    -2,-0.4    -3,-0.1   0.538  99.0  22.7 -58.8 -34.0   -5.5   -9.6   10.5                           
  106  106   N  S  < S+     0   0  133     -4,-0.5     2,-0.3    -3,-0.1     5,-0.2   0.740  93.4  97.9-103.8 -42.2   -8.4   -9.3   12.8                           
  107  107   E  S   >S+     0   0  130      1,-0.3     5,-0.8     3,-0.1     2,-0.3  -0.680 101.9   5.0-123.3 131.2  -10.9   -6.7   12.6                           
  108  108   E  T   5S-     0   0  144     -2,-0.3    -1,-0.3     3,-0.1    -2,-0.0  -0.764 117.0-116.4  70.8 -60.2  -14.2   -6.9   10.9                           
  109  109   G  T   5S+     0   0   33     -2,-0.3    -2,-0.1    -5,-0.0    -1,-0.1  -0.185  88.7  14.7 144.7 -24.9  -12.5  -10.3   10.8                           
  110  110   N  T  >5S+     0   0  101      3,-0.0     4,-5.2    -3,-0.0    -3,-0.1   0.448 115.1  80.7 -67.2 -35.0  -11.7  -11.3    7.3                           
  111  111   H  H  >5S+     0   0   75      1,-0.4     4,-2.5     2,-0.3     5,-0.4   0.734  94.5  24.9 -94.2 -50.2  -12.3   -8.1    5.9                           
  112  112   A  H  > S+     0   0   18     -6,-0.3     4,-2.7     1,-0.2    -2,-0.3   0.978 119.0  34.2 -59.0 -49.3   -7.4   -8.5    6.3                           
  114  114   D  H  X S+     0   0   61     -4,-5.2     4,-2.6     2,-0.2    -3,-0.2   0.901 116.5  47.4 -70.3 -50.1   -8.8  -10.1    3.2                           
  115  115   R  H  X S+     0   0   57     -4,-2.5     4,-1.8     2,-0.2    -1,-0.2   0.937 119.6  45.8 -62.5 -44.6   -9.8   -7.2    0.9                           
  116  116   C  H  X S+     0   0    1     -4,-2.0     4,-2.0    -5,-0.4    -2,-0.2   0.910 110.6  52.6 -63.7 -41.1   -6.2   -5.8    1.8                           
  117  117   N  H  X S+     0   0   70     -4,-2.7     4,-3.2    -5,-0.3    -1,-0.2   0.879 104.3  57.0 -63.3 -37.2   -4.6   -9.2    1.2                           
  118  118   E  H  X S+     0   0   61     -4,-2.6     4,-3.6     1,-0.2     5,-0.3   0.917 108.0  49.8 -59.1 -40.4   -6.3   -9.3   -2.2                           
  119  119   A  H  X S+     0   0    0     -4,-1.8     4,-2.6     2,-0.2     5,-0.2   0.895 110.4  45.0 -60.5 -45.9   -4.6   -6.2   -3.0                           
  120  120   C  H  X S+     0   0    5     -4,-2.0     4,-4.8   -23,-0.2    -2,-0.2   0.977 119.7  44.9 -56.6 -52.5   -1.2   -7.2   -1.9                           
  121  121   Y  H  < S+     0   0  159     -4,-3.2    -2,-0.2     1,-0.3    -1,-0.2   0.843 114.7  44.6 -68.7 -40.3   -1.7  -10.4   -3.8                           
  122  122   R  H  < S+     0   0  106     -4,-3.6    -1,-0.3    -5,-0.2    -3,-0.2   0.893 122.3  40.3 -66.9 -41.7   -3.2   -9.1   -7.0                           
  123  123   F  H  < S+     0   0   13     -4,-2.6     2,-0.4    -5,-0.3    -2,-0.2   0.985 126.9  12.8 -67.5 -47.8   -0.7   -6.3   -7.1                           
  124  124   C     <  -     0   0    0     -4,-4.8     2,-0.4    -5,-0.2    -1,-0.2  -0.940  44.8-159.0-136.9 132.9    2.3   -8.3   -6.0                           
  125  125   T  B >   -B  128   0B  63      3,-1.7     3,-2.0    -2,-0.4   -31,-0.1  -0.971  51.2-108.0-104.7 149.4    3.7  -11.7   -5.5                           
  126  126   N  T 3  S+     0   0   97     -2,-0.4   -32,-0.1     1,-0.3     3,-0.1   0.681 108.2  13.6 -64.8 -38.5    6.5  -11.2   -3.2                           
  127  127   E  T 3  S+     0   0  189      1,-0.2     2,-0.7    -3,-0.0    -1,-0.3   0.549 125.3  65.3 -84.2  -9.8    9.4  -11.8   -5.4                           
  128  128   A  B <  S+B  125   0B  56     -3,-2.0    -3,-1.7     0, 0.0     2,-0.3  -0.787  91.8 117.1-133.1  68.4    7.3  -11.6   -8.4                           
  129  129   E        +     0   0   91     -2,-0.7    -5,-0.1    -5,-0.2    -3,-0.1  -0.785  16.2  62.1-160.9 158.5    6.3   -8.1   -8.1                           
  130  130   I        -     0   0   47     -2,-0.3     2,-0.4    -7,-0.1   -47,-0.1   0.724  49.3-123.2  76.4 129.8    5.9   -4.4   -9.0                           
  131  131   V        -     0   0   37      2,-0.2    -1,-0.1     1,-0.1    -7,-0.0  -0.757  11.3-131.5-108.4 142.5    4.2   -2.9  -11.9                           
  132  132   T  S    S+     0   0  152     -2,-0.4     2,-0.3     2,-0.1     3,-0.1   0.769  96.9  40.7 -66.6 -15.7    5.4   -0.4  -14.6                           
  133  133   V        -     0   0   65      1,-0.2    -2,-0.2     0, 0.0    -3,-0.0  -0.923  43.1-178.9-117.1 147.9    2.4    1.5  -13.9                           
  134  134   A              0   0   26      1,-0.7  -121,-0.3    -2,-0.3    -1,-0.2   0.695 360.0 360.0 -91.3 -52.7    0.4    2.6  -11.0                           
  135  135   S              0   0   60     -3,-0.1    -1,-0.7  -122,-0.1  -125,-0.0  -0.627 360.0 360.0-119.1 360.0   -1.9    4.2  -13.5