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                                                              .
                                                                                                                               .
COMPND                                                                                                                         .
SOURCE                                                                                                                         .
AUTHOR                                                                                                                         .
  172  1  0  0  0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN)                .
 13675.1   ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2)                                                                         .
   84 48.8   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                              .
    0  0.0   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                              .
    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                              .
   13  7.6   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES                              .
   18 10.5   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES                              .
   52 30.2   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES                              .
    1  0.6   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  0  0  0  1  2  2  0  0  1  1  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      .
  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    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   E              0   0  195      0, 0.0     0, 0.0     0, 0.0     0, 0.0   0.000 360.0 360.0 360.0-139.5   25.7   12.6   20.9                           
    2    2   R        +     0   0  205      1,-0.0     2,-0.4     2,-0.0     0, 0.0   0.968 360.0  64.4 -63.0 -51.1   23.6    9.5   20.6                           
    3    3   C        +     0   0   71     37,-0.1     2,-0.3    38,-0.0    -1,-0.0  -0.574  65.1 176.2 -84.5 131.2   24.9    7.8   23.7                           
    4    4   C        -     0   0  120     -2,-0.4     2,-0.5     2,-0.0    -2,-0.0  -0.859  30.3-114.1-127.1 163.5   24.2    9.5   27.0                           
    5    5   N        -     0   0   98     -2,-0.3     2,-0.5     8,-0.0    -2,-0.0  -0.860  26.7-170.3-103.3 124.7   24.9    8.4   30.6                           
    6    6   E        +     0   0  179     -2,-0.5     2,-0.3     0, 0.0    -2,-0.0  -0.963  14.2 163.3-117.2 119.7   22.0    7.7   32.8                           
    7    7   L        -     0   0   38     -2,-0.5     3,-0.1     1,-0.2    25,-0.1  -0.878  35.0-115.9-128.0 162.7   22.7    7.2   36.5                           
    8    8   N  S    S-     0   0   94     -2,-0.3     2,-2.1     1,-0.2    -1,-0.2   0.053  75.6 -34.2 -80.3-158.2   20.5    7.2   39.5                           
    9    9   E  S    S+     0   0  184      3,-0.0     2,-0.5     2,-0.0    -1,-0.2  -0.372  83.7 138.0 -68.9  85.9   20.9    9.8   42.2                           
   10   10   F        -     0   0   40     -2,-2.1    -3,-0.1     1,-0.1    -1,-0.0  -0.973  33.6-169.4-122.9 113.8   24.6   10.3   42.2                           
   11   11   E  S    S+     0   0  199     -2,-0.5    -1,-0.1     1,-0.2    -2,-0.0   0.894  89.5  57.6 -66.4 -34.6   25.4   13.9   42.5                           
   12   12   N  S    S-     0   0  123     -3,-0.1    -1,-0.2     2,-0.0     3,-0.1   0.931  80.4-171.1 -62.1 -47.6   28.9   12.9   41.7                           
   13   13   N        -     0   0   85      1,-0.1    -2,-0.0    -5,-0.1    -4,-0.0   0.967  34.3-114.5  46.6  82.9   28.1   11.3   38.3                           
   14   14   Q        -     0   0   28      1,-0.1    -1,-0.1     4,-0.1    -4,-0.0  -0.180  20.9-153.8 -54.6 130.0   31.5    9.8   37.7                           
   15   15   R  S    S+     0   0  237     -3,-0.1     2,-0.2     2,-0.1    -1,-0.1   0.889  75.2  37.5 -71.2 -42.4   33.3   11.2   34.7                           
   16   16   C  S    S-     0   0   59      1,-0.0     2,-1.9     0, 0.0    -2,-0.0  -0.625  97.6 -93.7-113.9 166.8   35.4    8.2   34.0                           
   17   17   M        -     0   0   88     -2,-0.2     2,-0.3    28,-0.0    -2,-0.1  -0.634  67.1-178.1 -73.5  94.4   34.9    4.6   34.1                           
   18   18   C        -     0   0   43     -2,-1.9     4,-0.4     1,-0.1     3,-0.1  -0.727  34.1-139.6-110.5 154.0   36.4    4.6   37.5                           
   19   19   E  S >> S+     0   0  138     -2,-0.3     4,-0.8     1,-0.2     3,-0.7   0.894  88.2  62.6 -69.8 -47.8   37.1    1.8   40.0                           
   20   20   A  H 3> S+     0   0   61      1,-0.2     4,-1.5     2,-0.2     3,-0.3   0.803  92.2  63.1 -60.4 -38.9   36.1    3.1   43.4                           
   21   21   L  H 3> S+     0   0   37      1,-0.2     4,-2.7     2,-0.2     5,-0.3   0.868  97.0  56.2 -59.3 -42.7   32.4    3.6   42.8                           
   22   22   Q  H <> S+     0   0   33     -3,-0.7     4,-2.4    -4,-0.4    -1,-0.2   0.918 105.9  49.0 -60.2 -45.5   31.5    0.0   42.1                           
   23   23   Q  H  X S+     0   0  149     -4,-0.8     4,-0.6    -3,-0.3    -1,-0.2   0.941 116.6  40.4 -64.6 -46.9   32.8   -1.3   45.4                           
   24   24   I  H >X S+     0   0  131     -4,-1.5     3,-0.8     1,-0.2     4,-0.5   0.923 120.6  44.2 -66.4 -43.1   31.1    1.2   47.6                           
   25   25   M  H 3X S+     0   0    4     -4,-2.7     4,-3.6     1,-0.2     3,-0.4   0.795  94.9  84.7 -67.6 -27.7   27.9    1.1   45.6                           
   26   26   E  H 3< S+     0   0   70     -4,-2.4    -1,-0.2    -5,-0.3    -2,-0.2   0.801  84.2  55.0 -51.3 -38.7   28.2   -2.7   45.5                           
   27   27   N  H << S+     0   0  162     -3,-0.8    -1,-0.3    -4,-0.6    -2,-0.2   0.984 119.4  31.1 -61.7 -52.6   26.6   -3.0   48.8                           
   28   28   Q  H  < S-     0   0  143     -4,-0.5     2,-0.3    -3,-0.4    -2,-0.2   0.933 135.6 -40.9 -71.9 -44.9   23.5   -1.1   47.8                           
   29   29   S  S  < S-     0   0   50     -4,-3.6    -1,-0.2    -7,-0.2     2,-0.1  -0.975  70.2 -72.8-171.5 168.9   23.5   -2.0   44.1                           
   30   30   D        -     0   0   59     -2,-0.3     3,-0.1     1,-0.1    -7,-0.1  -0.449  42.1-122.6 -78.0 155.8   25.8   -2.5   41.1                           
   31   31   R  S    S-     0   0   27      1,-0.2     2,-0.3    -2,-0.1    -1,-0.1   0.951  77.0  -6.6 -62.3 -55.8   27.3    0.6   39.5                           
   32   32   L        -     0   0   38    -25,-0.1     2,-0.3     2,-0.0    -1,-0.2  -0.946  46.9-161.4-146.8 159.7   26.1    0.3   35.9                           
   33   33   Q        +     0   0  143     -2,-0.3     2,-0.3    32,-0.1    32,-0.0  -0.965  20.1 161.5-136.8 148.8   24.3   -1.9   33.4                           
   34   34   G        -     0   0   40     -2,-0.3     2,-0.8    32,-0.0    32,-0.1  -0.969  46.9 -87.0-161.5 163.3   24.4   -1.5   29.7                           
   35   35   R        +     0   0  151     -2,-0.3     3,-0.3     1,-0.2     6,-0.2  -0.694  34.7 179.9 -89.2 114.3   23.7   -3.7   26.7                           
   36   36   Q        +     0   0   24     -2,-0.8    -1,-0.2     1,-0.2     6,-0.1   0.693  69.1  79.3 -74.8 -28.2   26.7   -5.8   25.8                           
   37   37   Q  S    S+     0   0  121      2,-0.0     2,-0.4     4,-0.0    -1,-0.2   0.829  89.3  57.1 -59.6 -34.0   25.0   -7.5   22.9                           
   38   38   E    >>  -     0   0   63     -3,-0.3     4,-0.9     1,-0.1     3,-0.6  -0.824  69.2-147.1-106.8 143.4   25.5   -4.6   20.5                           
   39   39   Q  H 3> S+     0   0   90     -2,-0.4     4,-2.5     1,-0.2    -1,-0.1   0.817  93.5  73.9 -67.6 -31.4   28.8   -3.0   19.6                           
   40   40   Q  H 3> S+     0   0  107      1,-0.2     4,-0.5     2,-0.2    -1,-0.2   0.849  98.9  44.6 -56.4 -37.8   27.2    0.4   19.3                           
   41   41   F  H <4 S+     0   0   79     -3,-0.6     3,-0.5    -6,-0.2     4,-0.3   0.924 118.2  42.5 -68.2 -46.4   26.9    0.7   23.1                           
   42   42   K  H >X S+     0   0   26     -4,-0.9     4,-1.3     1,-0.2     3,-0.8   0.669  97.2  79.5 -70.6 -28.9   30.4   -0.6   23.8                           
   43   43   R  H 3X S+     0   0   95     -4,-2.5     4,-3.2     1,-0.2    -1,-0.2   0.807  79.0  64.8 -59.2 -38.8   32.0    1.4   21.0                           
   44   44   E  H 3X S+     0   0  100     -4,-0.5     4,-0.7    -3,-0.5    -1,-0.2   0.885 107.9  42.1 -58.3 -40.2   32.2    4.8   22.7                           
   45   45   L  H X4 S+     0   0   28     -3,-0.8     3,-0.7    -4,-0.3     5,-0.3   0.880 115.7  50.0 -67.7 -40.3   34.6    3.4   25.2                           
   46   46   R  H 3< S+     0   0   88     -4,-1.3     7,-0.3     1,-0.3    -2,-0.2   0.851 100.6  66.3 -65.4 -37.0   36.5    1.5   22.5                           
   47   47   N  H 3< S+     0   0  105     -4,-3.2    -1,-0.3    -5,-0.1    -2,-0.2   0.780  96.5  60.7 -60.0 -34.1   36.6    4.7   20.5                           
   48   48   L  S << S-     0   0  115     -4,-0.7    -2,-0.1    -3,-0.7    -3,-0.1   0.774 125.6 -12.9 -70.6-114.4   38.9    6.3   23.1                           
   49   49   P  S    S-     0   0   82      0, 0.0     2,-0.3     0, 0.0    -3,-0.1   0.940  88.9-134.9 -55.4 -58.4   42.2    4.5   23.7                           
   50   50   Q  S >> S+     0   0  133     -5,-0.3     4,-1.5     1,-0.0     3,-0.8  -0.922  78.3  15.5 148.9-118.3   41.6    1.2   21.8                           
   51   51   M  H 3> S+     0   0  111     -2,-0.3     4,-3.0     1,-0.3     5,-0.2   0.806 123.5  64.3 -61.5 -32.4   42.5   -2.2   23.1                           
   52   52   A  H 3> S+     0   0   44      2,-0.2     4,-2.5     1,-0.2    -1,-0.3   0.895  98.8  53.7 -60.3 -38.4   42.8   -0.5   26.3                           
   53   53   K  H <> S+     0   0    5     -3,-0.8     4,-2.4    -7,-0.3    -2,-0.2   0.985 110.3  44.4 -58.6 -55.3   39.1    0.2   26.1                           
   54   54   L  H  X S+     0   0   28     -4,-1.5     4,-2.7     1,-0.2     5,-0.2   0.896 111.9  53.0 -59.3 -42.5   38.1   -3.3   25.5                           
   55   55   T  H  X S+     0   0   69     -4,-3.0     4,-2.9     1,-0.3    -1,-0.2   0.937 109.1  47.8 -62.2 -43.4   40.4   -4.6   28.3                           
   56   56   I  H  X S+     0   0   70     -4,-2.5     4,-2.1     1,-0.2    -1,-0.3   0.910 110.7  53.7 -62.4 -37.1   39.0   -2.3   30.8                           
   57   57   L  H  X S+     0   0   21     -4,-2.4     4,-1.6    -5,-0.2    -1,-0.2   0.927 110.5  45.7 -62.0 -43.9   35.6   -3.3   29.7                           
   58   58   V  H  X S+     0   0   45     -4,-2.7     4,-2.0     1,-0.2    -1,-0.2   0.931 108.9  55.4 -64.1 -42.2   36.5   -7.0   30.2                           
   59   59   A  H  X S+     0   0   40     -4,-2.9     4,-1.7     1,-0.3    -1,-0.2   0.890 104.2  54.5 -59.3 -36.8   38.0   -6.2   33.6                           
   60   60   L  H  < S+     0   0   32     -4,-2.1     3,-0.4     1,-0.3    -1,-0.3   0.944 107.3  51.1 -59.5 -43.4   34.7   -4.7   34.6                           
   61   61   A  H  X S+     0   0   21     -4,-1.6     4,-1.0     1,-0.3     3,-0.3   0.828 100.0  64.0 -62.1 -35.1   33.1   -7.9   33.6                           
   62   62   L  H  < S+     0   0  137     -4,-2.0     2,-0.8     1,-0.3    -1,-0.3   0.937 108.0  44.1 -57.1 -44.8   35.6   -9.8   35.7                           
   63   63   F  T  < S-     0   0   98     -4,-1.7    -1,-0.3    -3,-0.4     3,-0.1  -0.830 136.3 -46.1-112.5 103.5   34.1   -8.1   38.7                           
   64   64   L  T  4 S+     0   0   92     -2,-0.8     2,-0.3    -3,-0.3    -3,-0.2   0.833  97.1 114.2  53.9  48.3   30.3   -8.0   38.7                           
   65   65   L  S  < S-     0   0   40     -4,-1.0    -1,-0.1    -7,-0.1   -32,-0.1  -0.986  71.0-106.3-142.1 140.6   29.4   -6.9   35.3                           
   66   66   A        -     0   0   60     -2,-0.3     2,-0.5     1,-0.1     3,-0.2  -0.292  47.6-107.6 -62.1 148.9   27.5   -8.9   32.7                           
   67   67   A        +     0   0   55      1,-0.2    -1,-0.1    -6,-0.1   -31,-0.1  -0.679  48.0 161.0 -99.6 124.4   29.8  -10.1   30.0                           
   68   68   H  S    S+     0   0   61     -2,-0.5    -1,-0.2   -11,-0.1   -10,-0.1   0.691  85.7  67.2 -80.7 -33.8   30.0   -8.9   26.5                           
   69   69   A  S >  S-     0   0   14     -3,-0.2     3,-0.6     1,-0.1    -2,-0.1   0.831  79.6-160.5 -60.4 -44.0   33.4  -10.5   26.6                           
   70   70   S  T 3   -     0   0   77      1,-0.2    -1,-0.1   -12,-0.1     3,-0.1   0.674  53.8 -91.8  65.1  16.2   32.3  -14.1   26.9                           
   71   71   A  T 3  S+     0   0   97      1,-0.2     2,-0.3   -13,-0.0    -1,-0.2   0.910  91.4 115.4  45.8  60.3   35.8  -14.8   28.2                           
   72   72   R  S <  S-     0   0  208     -3,-0.6    -1,-0.2     1,-0.0     2,-0.0  -0.890  77.0 -79.0-143.0 174.4   37.4  -15.7   24.9                           
   73   73   Q        -     0   0  159     -2,-0.3     2,-0.3    -3,-0.1     3,-0.1  -0.390  62.1-179.4 -67.2 159.4   40.1  -14.2   22.8                           
   74   74   Q        +     0   0  105      1,-0.1    -5,-0.0     2,-0.0    -1,-0.0  -0.978  43.1  38.5-157.0 172.2   38.7  -11.3   20.9                           
   75   75   W        +     0   0  100     -2,-0.3    -1,-0.1     2,-0.2     3,-0.1   0.752  64.2 136.2  56.0  26.7   39.3   -8.6   18.4                           
   76   76   E  S    S+     0   0  134      1,-0.2     2,-0.4    -3,-0.1    -1,-0.1   0.945  74.0  40.5 -65.0 -39.2   41.4  -11.0   16.5                           
   77   77   L  S    S-     0   0  109      1,-0.1    -2,-0.2     3,-0.0    -1,-0.2  -0.871  73.4-147.5-110.6 140.6   39.5   -9.6   13.6                           
   78   78   Q        -     0   0  154     -2,-0.4    -1,-0.1     1,-0.1    -2,-0.1   0.869  56.6-115.4 -66.0 -37.5   38.6   -5.9   13.1                           
   79   79   G        -     0   0   39     -3,-0.1     2,-0.1     2,-0.0     3,-0.1   0.182  22.6-134.2 108.3 133.8   35.5   -7.2   11.4                           
   80   80   D        -     0   0  103      1,-0.2     2,-0.1    -2,-0.0    -3,-0.0  -0.235  54.5 -53.7-100.2-166.1   34.4   -6.8    7.9                           
   81   81   R        -     0   0  102     -2,-0.1    -1,-0.2     1,-0.1     2,-0.1  -0.461  67.2-108.8 -71.3 147.4   30.9   -5.9    6.7                           
   82   82   R     >  -     0   0  141      1,-0.1     4,-1.7    -2,-0.1     5,-0.1  -0.456  11.0-130.9 -80.2 153.3   28.3   -8.1    8.3                           
   83   83   C  H  > S+     0   0   46      2,-0.2     4,-2.9     1,-0.2     5,-0.2   0.907 105.9  56.6 -64.7 -43.3   26.3  -10.6    6.3                           
   84   84   Q  H  > S+     0   0  122      1,-0.2     4,-2.3     2,-0.2     5,-0.2   0.912 107.4  47.0 -60.2 -45.1   23.0   -9.4    7.7                           
   85   85   S  H  > S+     0   0   57      1,-0.2     4,-2.4     2,-0.2    -1,-0.2   0.951 114.3  47.0 -62.9 -46.7   23.6   -5.9    6.5                           
   86   86   Q  H  X S+     0   0   22     -4,-1.7     4,-2.2     1,-0.2    -1,-0.2   0.878 111.4  50.5 -63.9 -41.0   24.7   -6.9    3.1                           
   87   87   L  H  < S+     0   0   54     -4,-2.9    -1,-0.2     2,-0.2    -2,-0.2   0.929 112.3  46.1 -65.1 -44.2   21.8   -9.3    2.6                           
   88   88   E  H  < S+     0   0  136     -4,-2.3    -1,-0.2     1,-0.2    -2,-0.2   0.922 114.2  49.0 -64.3 -42.2   19.2   -6.9    3.5                           
   89   89   R  H  < S+     0   0  151     -4,-2.4    -1,-0.2    -5,-0.2    -2,-0.2   0.846  92.8  98.8 -65.2 -35.6   20.8   -4.2    1.4                           
   90   90   A     <  -     0   0   23     -4,-2.2     2,-0.6    -5,-0.2     3,-0.1  -0.189  60.5-154.8 -63.1 142.1   21.0   -6.5   -1.6                           
   91   91   N        +     0   0  102      1,-0.1     4,-0.2    31,-0.1    34,-0.1  -0.888  16.6 177.0-117.1  94.6   18.4   -6.4   -4.3                           
   92   92   L    >>  +     0   0   39     -2,-0.6     4,-1.7     1,-0.2     3,-1.6   0.561  52.5  98.8 -73.0 -17.1   18.5   -9.9   -5.7                           
   93   93   R  H 3> S+     0   0  112      1,-0.3     4,-3.1     2,-0.2     5,-0.4   0.848  76.4  58.4 -50.5 -41.9   15.7   -9.4   -8.2                           
   94   94   P  H 3> S+     0   0   19      0, 0.0     4,-2.1     0, 0.0    -1,-0.3   0.870 108.1  46.8 -57.2 -37.0   18.0   -8.7  -11.1                           
   95   95   C  H <> S+     0   0   14     -3,-1.6     4,-3.1    -4,-0.2    -2,-0.2   0.900 113.1  49.7 -68.4 -39.9   19.6  -12.1  -10.6                           
   96   96   E  H  X S+     0   0   40     -4,-1.7     4,-2.2     2,-0.2     5,-0.3   0.960 114.8  41.6 -65.2 -49.9   16.3  -13.8  -10.3                           
   97   97   Q  H  X S+     0   0   56     -4,-3.1     4,-2.1     1,-0.2     5,-0.4   0.912 114.0  55.6 -64.8 -37.7   14.9  -12.3  -13.4                           
   98   98   H  H  X S+     0   0    0     -4,-2.1     4,-2.5    -5,-0.4    -2,-0.2   0.974 109.2  44.9 -58.1 -53.9   18.2  -12.9  -15.1                           
   99   99   L  H  X S+     0   0   26     -4,-3.1     4,-1.2     1,-0.2    -2,-0.2   0.927 116.6  41.9 -61.1 -50.0   18.2  -16.6  -14.4                           
  100  100   M  H >X S+     0   0   88     -4,-2.2     4,-0.9     1,-0.2     3,-0.8   0.953 118.0  44.0 -65.3 -46.4   14.7  -17.5  -15.3                           
  101  101   Q  H 3X S+     0   0  102     -4,-2.1     4,-1.7    -5,-0.3     3,-0.5   0.899 109.1  60.1 -63.7 -37.3   14.4  -15.4  -18.4                           
  102  102   C  H 3X S+     0   0    1     -4,-2.5     4,-1.7    -5,-0.4    -1,-0.3   0.773  91.9  66.8 -65.4 -28.6   17.8  -16.5  -19.5                           
  103  103   G  H << S+     0   0   20     -4,-1.2    -1,-0.2    -3,-0.8    -2,-0.2   0.952 106.3  39.2 -60.0 -48.0   16.8  -20.1  -19.5                           
  104  104   L  H  < S+     0   0  146     -4,-0.9    -1,-0.2    -3,-0.5    -2,-0.2   0.929 121.2  42.8 -68.1 -43.3   14.4  -19.7  -22.4                           
  105  105   R  H >< S+     0   0   77     -4,-1.7     3,-3.3     1,-0.3    -1,-0.2   0.741  98.0  87.5 -68.3 -21.5   16.6  -17.3  -24.3                           
  106  106   A  T 3<  +     0   0   13     -4,-1.7    -1,-0.3     1,-0.3    -2,-0.2   0.664  68.1  70.7 -58.2 -30.3   19.4  -19.7  -23.3                           
  107  107   P  T 3  S+     0   0  112      0, 0.0     2,-1.0     0, 0.0    -1,-0.3   0.741  88.8  74.4 -60.1 -15.6   19.0  -21.8  -26.2                           
  108  108   Q  S <  S+     0   0  156     -3,-3.3     2,-0.2    -4,-0.1    -3,-0.0  -0.633  83.0  63.8-103.6  79.4   20.4  -18.8  -28.1                           
  109  109   R        -     0   0  167     -2,-1.0     4,-0.1    -3,-0.2     2,-0.0  -0.812  69.6-119.6 179.0 153.0   24.1  -18.7  -27.3                           
  110  110   C  S    S+     0   0   81     -2,-0.2     3,-0.3     1,-0.1    -2,-0.0  -0.091  81.4  54.7 -86.9-173.8   27.3  -20.9  -27.9                           
  111  111   D  S    S-     0   0  112      1,-0.2     2,-0.3    -2,-0.0    -1,-0.1   0.953  91.6-116.9  45.5  81.8   29.6  -22.4  -25.3                           
  112  112   L  S    S+     0   0  161      1,-0.1     2,-0.3    -5,-0.0    -1,-0.2  -0.303  88.2  46.0 -51.9 108.5   27.1  -24.2  -23.2                           
  113  113   E  S    S+     0   0   69     -2,-0.3    -1,-0.1    -3,-0.3    40,-0.0  -0.937  84.1  53.1 160.3-136.1   27.4  -22.4  -20.0                           
  114  114   V        -     0   0   47     -2,-0.3     2,-0.3     1,-0.1    -1,-0.2   0.080  68.8-153.2 -38.8 128.5   27.6  -18.8  -19.0                           
  115  115   E        -     0   0   13     -3,-0.1     2,-0.4    38,-0.1    -1,-0.1  -0.707   0.8-131.7-114.2 162.3   24.7  -17.0  -20.4                           
  116  116   S        +     0   0   64     -2,-0.3     0, 0.0   -14,-0.1     0, 0.0  -0.884  54.7  71.6-121.2 151.3   24.3  -13.4  -21.4                           
  117  117   G  S    S+     0   0   27     -2,-0.4   -15,-0.1   -12,-0.0   -12,-0.1   0.529  98.7   8.0 115.8 110.2   21.6  -10.8  -20.8                           
  118  118   G  S  > S+     0   0   22    -16,-0.0     4,-1.4   -19,-0.0     3,-0.3   0.222  90.4 115.0  86.5  -6.7   20.8   -8.9  -17.5                           
  119  119   R  H  >  +     0   0   91      1,-0.2     4,-3.8     2,-0.2     5,-0.3   0.863  60.0  67.0 -64.8 -33.6   23.7  -10.3  -15.8                           
  120  120   D  H  > S+     0   0   81      1,-0.3     4,-2.3     2,-0.2    -1,-0.2   0.919 103.3  43.5 -57.6 -47.0   25.6   -7.1  -15.4                           
  121  121   R  H  > S+     0   0  122     -3,-0.3     4,-1.3     1,-0.2    -1,-0.3   0.926 118.0  48.3 -61.8 -41.2   23.1   -5.6  -12.9                           
  122  122   Y  H >X S+     0   0    3     -4,-1.4     4,-2.1   -28,-0.3     3,-0.5   0.928 107.9  52.7 -62.4 -46.1   23.1   -9.0  -11.2                           
  123  123   Q  H 3X S+     0   0    1     -4,-3.8     4,-1.9     1,-0.3    -1,-0.2   0.900 104.9  56.8 -60.3 -41.2   26.8   -9.3  -11.1                           
  124  124   K  H 3< S+     0   0   98     -4,-2.3     4,-0.5    -5,-0.3    -1,-0.3   0.875 107.4  48.5 -60.4 -37.8   27.0   -5.9   -9.5                           
  125  125   I  H X< S+     0   0   35     -4,-1.3     3,-1.4    -3,-0.5     4,-0.3   0.936 110.9  49.8 -65.8 -44.9   24.8   -7.1   -6.7                           
  126  126   Q  H >< S+     0   0    6     -4,-2.1     3,-2.1     1,-0.3     4,-0.3   0.760  91.1  78.5 -65.4 -26.7   26.8  -10.3   -6.2                           
  127  127   R  G >< S+     0   0  133     -4,-1.9     3,-1.8     1,-0.3    -1,-0.3   0.817  83.0  66.8 -55.0 -29.9   30.0   -8.4   -6.0                           
  128  128   D  G X  S+     0   0   59     -3,-1.4     3,-0.6    -4,-0.5    -1,-0.3   0.809  96.2  54.9 -59.8 -34.8   29.0   -7.5   -2.5                           
  129  129   E  G <  S+     0   0   12     -3,-2.1    -1,-0.3    -4,-0.3    -2,-0.2   0.375  75.8 103.4 -76.9  -4.7   29.4  -11.2   -1.5                           
  130  130   D  G <  S+     0   0   82     -3,-1.8    -1,-0.2    -4,-0.3    -2,-0.1   0.884  75.7  56.1 -53.2 -40.3   33.0  -11.4   -2.8                           
  131  131   S  S <  S+     0   0   59     -3,-0.6     2,-0.3    -4,-0.3    -1,-0.2   0.947 125.9   1.1 -60.4 -51.5   34.4  -11.3    0.7                           
  132  132   Y        -     0   0  152     -4,-0.2     2,-0.6    -3,-0.1    -1,-0.2  -0.984  68.7-140.0-137.9 151.9   32.5  -14.2    2.1                           
  133  133   G        +     0   0   10     -2,-0.3     2,-0.3    32,-0.1    34,-0.1  -0.838  40.1 132.3-123.5 106.6   30.1  -16.6    0.5                           
  134  134   R  S    S-     0   0  141     -2,-0.6    -2,-0.1    32,-0.1    31,-0.0  -0.893  71.7 -32.6-152.8 116.9   27.0  -17.8    2.3                           
  135  135   D  S    S+     0   0   58     -2,-0.3    -2,-0.1     1,-0.1    34,-0.0   0.514  82.5 115.9  59.0  24.1   23.3  -17.9    1.1                           
  136  136   P  S    S+     0   0   26      0, 0.0    -1,-0.1     0, 0.0    -3,-0.0   0.823  88.1  53.3 -74.8 -26.5   22.8  -15.0   -1.3                           
  137  137   Y  S    S+     0   0   13      2,-0.0     3,-0.2    18,-0.0    17,-0.0   0.793  83.1 123.7 -69.1 -35.6   22.2  -17.9   -3.7                           
  138  138   S  S    S-     0   0   58      1,-0.2    33,-0.1     2,-0.1    -4,-0.0   0.134  76.8 -75.8 -42.3 142.8   19.6  -19.6   -1.5                           
  139  139   P        +     0   0   70      0, 0.0    -1,-0.2     0, 0.0     3,-0.1  -0.049  56.1 155.0 -50.4 126.9   16.3  -20.3   -3.1                           
  140  140   S        +     0   0   72     -3,-0.2     2,-0.5     3,-0.1    -2,-0.1  -0.063  54.4  89.3-138.6  26.2   13.9  -17.4   -3.6                           
  141  141   Q        -     0   0   42      1,-0.2    -1,-0.1   -45,-0.0     0, 0.0  -0.865  46.2-178.9-133.3 102.5   12.0  -18.9   -6.5                           
  142  142   D        +     0   0  146     -2,-0.5    -1,-0.2    -3,-0.1     2,-0.1   0.873  66.6  83.3 -64.9 -39.4    9.1  -21.0   -5.6                           
  143  143   P        +     0   0   88      0, 0.0     2,-0.3     0, 0.0    -3,-0.1  -0.435  60.8 163.0 -69.4 143.4    8.4  -21.7   -9.2                           
  144  144   Y        -     0   0  134     -2,-0.1    -2,-0.0     3,-0.0     0, 0.0  -0.905  23.3-169.3-148.4 175.3   10.4  -24.4  -10.7                           
  145  145   S  S    S-     0   0   75     -2,-0.3     3,-0.1     0, 0.0     0, 0.0  -0.580  70.1 -53.1-144.3-157.8   10.6  -26.7  -13.7                           
  146  146   P  S    S-     0   0  125      0, 0.0     2,-0.1     0, 0.0    -2,-0.0   0.700  78.3-171.3 -63.2 -14.8   12.8  -29.7  -14.2                           
  147  147   S        +     0   0   31      1,-0.2     2,-2.9     3,-0.1    -3,-0.0  -0.352  44.0 122.8  65.0-135.8   15.5  -27.2  -13.4                           
  148  148   Q  S  > S+     0   0  163      1,-0.3     4,-3.2    -3,-0.1     5,-0.3  -0.442  85.9  50.0  76.2 -73.9   19.0  -28.6  -14.0                           
  149  149   D  H  > S+     0   0   57     -2,-2.9     4,-1.6     1,-0.2    -1,-0.3   0.834 116.9  42.3 -63.0 -37.9   19.7  -25.8  -16.4                           
  150  150   P  H  > S+     0   0   48      0, 0.0     4,-3.2     0, 0.0    -1,-0.2   0.898 116.2  45.3 -74.1 -41.7   18.5  -23.4  -13.7                           
  151  151   D  H  4 S+     0   0   53      2,-0.2     5,-0.2     1,-0.2    -2,-0.2   0.894 115.8  48.3 -68.6 -38.7   20.2  -25.1  -10.7                           
  152  152   R  H  X S+     0   0   87     -4,-3.2     4,-1.9     1,-0.2    -1,-0.2   0.965 112.9  50.6 -63.6 -43.2   23.3  -25.4  -12.8                           
  153  153   R  H  X S+     0   0    6     -4,-1.6     4,-2.1    -5,-0.3    -2,-0.2   0.928 107.6  50.1 -60.6 -49.9   22.9  -21.7  -13.7                           
  154  154   D  H  < S+     0   0   23     -4,-3.2     3,-0.4     1,-0.2    -1,-0.2   0.963 114.3  42.8 -63.3 -49.8   22.4  -20.4  -10.2                           
  155  155   P  H  4 S+     0   0   64      0, 0.0     4,-0.3     0, 0.0    -1,-0.2   0.807 114.0  51.3 -62.0 -27.8   25.4  -22.1   -8.8                           
  156  156   Y  H >< S+     0   0   84     -4,-1.9     3,-2.3    -3,-0.2    -2,-0.2   0.845  87.9  91.4 -71.0 -32.7   27.6  -21.3  -11.7                           
  157  157   S  T 3X S+     0   0    0     -4,-2.1     4,-1.3    -3,-0.4    -1,-0.2   0.613  75.7  57.4 -44.8 -43.9   26.6  -17.6  -11.6                           
  158  158   P  T >4>S+     0   0    4      0, 0.0     5,-3.2     0, 0.0     3,-0.7   0.912 104.4  56.0 -56.2 -39.3   29.4  -16.3   -9.3                           
  159  159   S  G X45S+     0   0   68     -3,-2.3     3,-2.5     1,-0.3    -2,-0.2   0.884 100.1  59.0 -62.1 -41.4   31.9  -17.6  -11.8                           
  160  160   P  G 345S+     0   0   24      0, 0.0    -1,-0.3     0, 0.0    -3,-0.1   0.836 108.9  42.4 -60.3 -30.7   30.3  -15.6  -14.6                           
  161  161   Y  G <<5S-     0   0   78     -4,-1.3    -2,-0.2    -3,-0.7     3,-0.1   0.169 119.0-115.5-101.8  31.7   30.9  -12.4  -12.8                           
  162  162   D  T < 5S+     0   0  151     -3,-2.5     2,-0.3     1,-0.2    -3,-0.2   0.861  70.8 138.0  48.0  45.0   34.3  -13.8  -11.9                           
  163  163   R      < -     0   0   16     -5,-3.2    -1,-0.2    -6,-0.2    -2,-0.1  -0.752  58.9 -97.9-114.5 164.2   33.5  -13.9   -8.3                           
  164  164   R        -     0   0  148     -2,-0.3     2,-0.3   -34,-0.1    -1,-0.1  -0.405  39.0-154.2 -77.4 158.2   34.3  -16.5   -5.7                           
  165  165   G        -     0   0   43     -2,-0.1   -32,-0.1    -7,-0.0     2,-0.1  -0.902  21.4 -96.2-132.9 160.8   31.7  -19.1   -4.8                           
  166  166   A        -     0   0   38     -2,-0.3   -32,-0.1     1,-0.1   -34,-0.0  -0.421  21.5-139.9 -73.3 149.3   30.9  -21.2   -1.8                           
  167  167   G  S    S+     0   0   90    -34,-0.1    -1,-0.1    -2,-0.1     0, 0.0   0.862  93.2  27.3 -70.4 -39.2   32.2  -24.8   -1.9                           
  168  168   S        +     0   0   87      2,-0.1    -2,-0.1    -3,-0.0   -34,-0.0   0.564  60.2 131.3 -91.2-123.8   28.9  -25.9   -0.4                           
  169  169   S        -     0   0   40      1,-0.1     2,-0.2   -34,-0.0    -3,-0.0   0.973  42.5-159.1  59.5  64.9   25.5  -24.3   -0.7                           
  170  170   Q        -     0   0  169      1,-0.1     2,-0.5   -32,-0.0    -1,-0.1  -0.495   6.9-162.8 -68.6 136.9   23.4  -27.2   -1.6                           
  171  171   H              0   0   39     -2,-0.2    -1,-0.1     1,-0.2   -20,-0.0  -0.908 360.0 360.0-121.2  99.3   20.1  -26.2   -3.3                           
  172  172   Q              0   0  234     -2,-0.5    -1,-0.2   -21,-0.0   -21,-0.0   0.958 360.0 360.0 -82.0 360.0   17.9  -29.2   -3.1