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                                                                                                                         .
  175  1  3  3  0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN)                .
 11127.9   ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2)                                                                         .
   99 56.6   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J)  , SAME NUMBER PER 100 RESIDUES                              .
    3  1.7   TOTAL NUMBER OF HYDROGEN BONDS IN     PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES                              .
   15  8.6   TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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  0.6   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-3), SAME NUMBER PER 100 RESIDUES                              .
    1  0.6   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES                              .
    1  0.6   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                              .
   19 10.9   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES                              .
   10  5.7   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES                              .
   40 22.9   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  1  1  0  0  1  0  0  0  0  0  1  0  1  0  0  0  0  0  0  0  0  0  0  0  0  0  0    RESIDUES PER ALPHA HELIX         .
  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  0    PARALLEL BRIDGES PER LADDER      .
  1  2  0  0  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    ANTIPARALLEL BRIDGES PER LADDER  .
  2  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    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   A              0   0   29      0, 0.0    87,-1.3     0, 0.0    86,-0.1   0.000 360.0 360.0 360.0 -35.1  -12.8    7.2   -1.3                           
    2    2   A        +     0   0   29     85,-0.2     5,-0.2    84,-0.2   155,-0.1   0.745 360.0 106.9 -76.8 -35.3   -9.2    7.0   -0.1                           
    3    3   Y  S >> S-     0   0  168      1,-0.1     4,-1.5     3,-0.1     3,-0.5   0.020  84.3-112.6 -53.7 155.7  -10.0    5.1    3.1                           
    4    4   A  H 3> S+     0   0   39      1,-0.3     4,-2.8     2,-0.2     5,-0.2   0.901 119.9  55.5 -57.5 -40.7   -9.1    1.5    3.4                           
    5    5   Q  H 3> S+     0   0  120      1,-0.2     4,-3.6     2,-0.2    -1,-0.3   0.856 102.0  58.7 -60.6 -36.1  -12.8    0.7    3.4                           
    6    6   N  H <> S+     0   0   27     -3,-0.5     4,-1.4     2,-0.2    -1,-0.2   0.933 111.1  38.7 -61.8 -47.1  -13.1    2.5    0.2                           
    7    7   Y  H  X S+     0   0   18     -4,-1.5     4,-2.0    -5,-0.2     3,-0.2   0.973 119.3  49.7 -63.6 -49.8  -10.6    0.2   -1.6                           
    8    8   A  H  X S+     0   0    3     -4,-2.8     4,-3.3     1,-0.2     5,-0.2   0.883 104.0  57.5 -58.8 -45.5  -11.9   -2.8    0.2                           
    9    9   N  H  X S+     0   0   65     -4,-3.6     4,-2.5     1,-0.2    -1,-0.2   0.916 108.8  44.3 -58.6 -47.4  -15.6   -2.2   -0.5                           
   10   10   Q  H  X S+     0   0    3     -4,-1.4     4,-2.3    -3,-0.2    -1,-0.2   0.904 115.3  47.4 -67.6 -39.3  -15.2   -2.2   -4.3                           
   11   11   R  H  X S+     0   0    3     -4,-2.0     4,-2.8     1,-0.2     5,-0.2   0.942 111.5  52.8 -64.9 -41.9  -12.9   -5.2   -4.3                           
   12   12   A  H  X S+     0   0   30     -4,-3.3     4,-2.8     1,-0.2    -2,-0.2   0.895 110.2  46.1 -62.0 -43.0  -15.3   -7.0   -2.1                           
   13   13   D  H  X S+     0   0   25     -4,-2.5     4,-2.7    -5,-0.2     5,-0.3   0.945 111.3  52.2 -68.3 -38.8  -18.3   -6.4   -4.2                           
   14   14   D  H  X S+     0   0    3     -4,-2.3     4,-2.0     1,-0.2     5,-0.2   0.950 115.1  42.0 -59.1 -47.8  -16.4   -7.4   -7.3                           
   15   15   C  H  X>S+     0   0    6     -4,-2.8     6,-2.5     1,-0.2     4,-1.5   0.910 111.4  55.5 -66.8 -39.6  -15.3  -10.6   -5.8                           
   16   16   G  H  X5S+     0   0   40     -4,-2.8     4,-0.8     4,-0.3    -1,-0.2   0.944 110.5  44.8 -61.0 -45.4  -18.7  -11.3   -4.2                           
   17   17   M  H  <5S+     0   0  129     -4,-2.7    -1,-0.2    -5,-0.2    -2,-0.2   0.955 115.2  43.2 -65.2 -49.4  -20.5  -11.1   -7.5                           
   18   18   I  H  <5S-     0   0   23     -4,-2.0    -2,-0.2    -5,-0.3    -3,-0.1   0.977 136.1  -6.5 -72.9 -53.9  -18.3  -13.1   -9.7                           
   19   19   H  H  <5S-     0   0   91     -4,-1.5    -1,-0.2    -5,-0.2    -3,-0.2   0.378  90.0-104.6-125.3  16.9  -17.2  -16.1   -7.9                           
   20   20   S     << -     0   0   99     -5,-0.9    -4,-0.3    -4,-0.8    -3,-0.1   0.897  62.5-164.9  58.3  36.0  -18.5  -15.6   -4.5                           
   21   21   D        -     0   0   15     -6,-2.5    -1,-0.2    -7,-0.2   126,-0.1  -0.250  18.9-102.3 -61.1 143.5  -14.9  -14.9   -4.3                           
   22   22   G        -     0   0   29      1,-0.1    -1,-0.1    -3,-0.1    -3,-0.1  -0.118  43.4 -96.3 -65.0 167.7  -13.6  -14.9   -0.8                           
   23   23   P        -     0   0  108      0, 0.0     2,-0.3     0, 0.0    -1,-0.1   0.127  26.1-134.8 -73.8-176.5  -12.9  -11.7    0.9                           
   24   24   Y        -     0   0   57    -16,-0.1     2,-0.3   129,-0.0   128,-0.2  -0.880  12.9-145.2-136.6 162.6   -9.8   -9.7    1.5                           
   25   25   G  E     -a  152   0A  34    126,-1.9   128,-0.6    -2,-0.3     2,-0.6  -0.883  20.6-112.3-131.0 164.0   -8.5   -8.0    4.6                           
   26   26   E  E     -a  153   0A  66     -2,-0.3   128,-0.2     1,-0.2     3,-0.1  -0.883  20.7-172.4-101.0 119.3   -6.5   -4.9    5.1                           
   27   27   N        -     0   0   79    126,-2.2     2,-1.3    -2,-0.6    -1,-0.2   0.825  17.2-157.3 -72.6 -34.8   -3.0   -5.5    6.4                           
   28   28   L  S  > S+     0   0   91    125,-0.5     4,-1.7     1,-0.2    -1,-0.1  -0.232  88.0  68.4  79.4 -41.6   -2.5   -1.8    6.9                           
   29   29   A  T >4 S+     0   0   50     -2,-1.3     3,-0.7     1,-0.2     5,-0.3   0.972  96.0  51.4 -67.3 -45.4    1.1   -2.5    6.6                           
   30   30   A  T 3> S+     0   0    7      1,-0.3     4,-2.5     2,-0.2   124,-0.3   0.847 105.5  57.9 -59.5 -33.8    0.7   -3.3    3.0                           
   31   31   A  H 3> S+     0   0   27    122,-0.3     4,-2.8     2,-0.2    -1,-0.3   0.919 102.9  53.2 -62.1 -42.2   -1.1   -0.0    2.8                           
   32   32   F  H  S+     0   0   72      0, 0.0     4,-3.4     0, 0.0     5,-0.3   0.856 112.1  55.0 -59.9 -30.2    4.3    0.2    1.5                           
   34   34   Q  H  X S+     0   0    6     -4,-2.5     4,-2.6    -5,-0.3   122,-0.3   0.951 114.4  41.8 -63.7 -41.8    1.8    0.6   -1.2                           
   35   35   L  H  X S+     0   0   66     -4,-2.8     4,-3.0   120,-0.3    -1,-0.2   0.895 115.8  49.8 -64.8 -43.4    1.7    4.3   -0.3                           
   36   36   N  H  X S+     0   0   94     -4,-3.3     4,-3.3     2,-0.2     5,-0.3   0.935 112.5  45.5 -65.6 -45.5    5.4    4.5    0.1                           
   37   37   A  H  X S+     0   0   28     -4,-3.4     4,-3.8     1,-0.2     5,-0.2   0.957 115.4  48.6 -61.7 -44.0    6.1    2.8   -3.2                           
   38   38   A  H  X S+     0   0    0     -4,-2.6     4,-1.2    -5,-0.3    -1,-0.2   0.890 111.9  50.3 -61.8 -39.7    3.6    5.1   -4.7                           
   39   39   G  H  X S+     0   0   19     -4,-3.0     4,-1.8     2,-0.2     3,-0.3   0.949 116.8  38.1 -65.7 -48.5    5.1    8.1   -3.0                           
   40   40   A  H  X S+     0   0   55     -4,-3.3     4,-3.6     1,-0.3     3,-0.4   0.967 118.9  49.6 -65.7 -44.5    8.6    7.3   -4.1                           
   41   41   V  H  X S+     0   0    0     -4,-3.8     4,-1.0    -5,-0.3    -1,-0.3   0.648 107.9  55.8 -66.2 -23.5    7.4    6.2   -7.5                           
   42   42   K  H  < S+     0   0   65     -4,-1.2   119,-1.5    -3,-0.3     4,-0.4   0.824 112.9  39.4 -74.6 -40.6    5.3    9.4   -7.7                           
   43   43   M  H >< S+     0   0  125     -4,-1.8     3,-1.0    -3,-0.4     4,-0.4   0.917 123.5  42.6 -69.1 -44.1    8.4   11.6   -7.2                           
   44   44   W  H 3< S+     0   0   81     -4,-3.6     3,-0.3     1,-0.3    -2,-0.2   0.820 106.0  63.0 -67.6 -32.6   10.3    9.2   -9.4                           
   45   45   D  T 3< S+     0   0    0     -4,-1.0    14,-0.4    -5,-0.3    -1,-0.3   0.699  83.6  84.2 -70.1 -14.8    7.4    9.0  -11.7                           
   46   46   D  S <  S-     0   0   54     -3,-1.0     2,-0.3    -4,-0.4    -1,-0.2   0.943 110.8 -68.8 -49.0 -66.7    7.9   12.6  -12.3                           
   47   47   E        -     0   0  122     -4,-0.4     2,-0.3    -3,-0.3    -1,-0.2  -0.910  46.8-151.6-180.0 159.7   10.6   12.1  -14.9                           
   48   48   K        -     0   0   86     -2,-0.3     2,-1.9     9,-0.2     9,-0.1  -0.947  36.4 -94.9-142.2 165.0   14.1   10.8  -15.0                           
   49   49   Q        +     0   0  188     -2,-0.3     2,-0.4     2,-0.1    -2,-0.0  -0.615  69.3 141.7 -82.1  89.3   17.1   11.4  -17.2                           
   50   50   W        -     0   0  142     -2,-1.9     2,-0.7     0, 0.0     6,-0.2  -0.990  55.7-121.7-127.3 135.9   16.5    8.5  -19.5                           
   51   51   M        +     0   0  160     -2,-0.4     2,-0.2     5,-0.0     3,-0.1  -0.688  66.6 107.3 -81.1 121.7   17.2    8.8  -23.1                           
   52   52   K        -     0   0  134     -2,-0.7    -1,-0.0     1,-0.4     4,-0.0  -0.764  69.9 -37.1-161.1-154.8   13.9    8.1  -24.8                           
   53   53   S  S >  S-     0   0   95     -2,-0.2     3,-0.5     2,-0.1    -1,-0.4   0.108  83.0 -71.3 -70.3-168.6   11.1    9.7  -26.7                           
   54   54   S  T 3  S+     0   0  120      1,-0.3     2,-0.6     2,-0.1     3,-0.1   0.985 127.5   3.2 -53.3 -69.0    9.9   13.2  -25.8                           
   55   55   I  T 3  S-     0   0  110      1,-0.2    -1,-0.3    -8,-0.0     3,-0.1  -0.905  71.0-179.2-119.4 104.6    8.3   12.0  -22.6                           
   56   56   F    <   -     0   0   50     -2,-0.6     2,-0.3    -3,-0.5    -1,-0.2   0.975  66.4 -19.6 -67.0 -49.0    9.0    8.4  -22.1                           
   57   57   V        +     0   0   38     -3,-0.1     2,-0.3    -9,-0.1    -1,-0.2  -0.973  54.8 168.6-155.1 166.7    7.1    8.1  -18.9                           
   58   58   A        -     0   0    5      3,-0.8   -12,-0.2     2,-0.7   -11,-0.1  -0.895  62.7 -73.0-163.5 175.3    5.6   10.0  -16.0                           
   59   59   a  S >  S+     0   0    0    -14,-0.4     3,-1.5    -2,-0.3     2,-0.8   0.880 118.0  82.9 -48.7 -45.8    3.2    9.1  -13.2                           
   60   60   F  T 3  S-     0   0   53      1,-0.3    -2,-0.7   -14,-0.1   106,-0.1  -0.517 124.4  -8.8 -62.5 110.1    0.5    9.2  -15.9                           
   61   61   I  T 3  S+     0   0   90     -2,-0.8    -3,-0.8     1,-0.1    -1,-0.3   0.991  95.6 126.8  45.0  74.7    1.4    5.7  -16.8                           
   62   62   T    <   +     0   0    2     -3,-1.5     2,-2.1    -5,-0.2    -1,-0.1  -0.582  23.3 158.1-130.1  64.5    4.5    5.1  -14.8                           
   63   63   F        +     0   0   45     -5,-0.1     2,-0.3    15,-0.1     6,-0.2  -0.262  44.3  99.9 -83.6  58.2    3.0    2.1  -13.4                           
   64   64   I        +     0   0   70     -2,-2.1     2,-0.3   -23,-0.1    -2,-0.0  -0.981  22.6 102.8-146.4 152.4    6.5    1.0  -12.6                           
   65   65   I  S >  S-     0   0   50     -2,-0.3     3,-0.7   -21,-0.0     2,-0.4  -0.833 110.0 -40.1 174.9-146.1    9.0    0.8   -9.8                           
   66   66   F  T 3  S+     0   0  171     -2,-0.3    -2,-0.1     1,-0.2   -29,-0.0  -0.214 104.3 125.0 -85.6  51.6    9.5   -2.5   -8.2                           
   67   67   H  T 3   -     0   0    2     -2,-0.4    -1,-0.2     1,-0.1     8,-0.2   0.915  45.9-177.7 -66.5 -42.1    5.7   -2.5   -8.8                           
   68   68   S    <   +     0   0   31     -3,-0.7     5,-0.2     1,-0.1     2,-0.1   0.689  38.8 116.5  57.5  26.6    6.7   -5.7  -10.6                           
   69   69   S        +     0   0   10     -6,-0.2     9,-0.2     5,-0.2    -1,-0.1  -0.374  43.5 102.5-123.8  64.9    3.2   -6.4  -11.7                           
   70   70   Q  S    S-     0   0   91     -2,-0.1     2,-1.0     1,-0.1     6,-0.1  -0.235  96.6 -28.5-116.9-160.7    3.6   -6.2  -15.5                           
   71   71   A  S    S+     0   0   97     -2,-0.1     2,-0.3     2,-0.1    -1,-0.1  -0.502 125.0  63.6 -61.6 107.3    3.9   -9.1  -17.9                           
   72   72   Q  S    S-     0   0  134     -2,-1.0    -3,-0.1    -3,-0.1    -4,-0.0  -0.835 117.6 -37.4 171.4-145.9    5.4  -11.4  -15.3                           
   73   73   T  S    S-     0   0  100     -2,-0.3    -3,-0.1    -5,-0.2    -2,-0.1  -0.918  72.4-161.4-104.5 104.4    3.9  -12.6  -12.1                           
   74   74   P        +     0   0   36      0, 0.0   101,-1.0     0, 0.0    -5,-0.2  -0.258  27.7 170.3 -79.2 169.1    1.9   -9.6  -11.0                           
   75   75   R        +     0   0   97     99,-0.3    96,-2.5    -8,-0.2     2,-0.3   0.014  58.9  59.3-168.1  34.7    0.6   -9.0   -7.5                           
   76   76   E  B     -B  170   0B  10     94,-0.2     2,-0.4    99,-0.2    94,-0.2  -0.974  62.0-135.9-158.5 166.7   -0.6   -5.4   -7.7                           
   77   77   N        -     0   0    5     92,-1.6    92,-0.4    -2,-0.3     2,-0.3  -0.960  24.7-167.0-132.0 120.8   -2.9   -3.0   -9.4                           
   78   78   F        +     0   0   33     -2,-0.4     2,-0.3    90,-0.2    90,-0.2  -0.715   7.1 178.7-106.9 150.6   -1.6    0.4  -10.4                           
   79   79   L  E     -C  167   0B  34     88,-2.5    88,-2.9    -2,-0.3     2,-0.3  -0.991  12.3-173.9-150.8 146.9   -3.6    3.4  -11.5                           
   80   80   N  E     +C  166   0B  29     -2,-0.3    86,-0.2    86,-0.2     2,-0.1  -0.978  17.8 163.2-133.5 147.8   -2.9    6.9  -12.5                           
   81   81   A        -     0   0   24     84,-1.6    83,-0.1    -2,-0.3    86,-0.0  -0.325  38.9 -98.8-139.9-142.2   -5.5    9.5  -13.2                           
   82   82   H  S    S-     0   0  119     82,-0.2    -1,-0.1    -2,-0.1   -22,-0.0   0.738  75.0 -43.5-121.4 -59.0   -6.0   13.2  -13.5                           
   83   83   N  S    S+     0   0  125     81,-0.1    -2,-0.1    82,-0.1    80,-0.0   0.407 124.6  38.5-140.2 -76.4   -7.3   15.2  -10.5                           
   84   84   A  S    S+     0   0   41      2,-0.0     5,-0.1     5,-0.0    80,-0.0   0.690  78.3 145.6 -60.1 -24.6  -10.2   13.9   -8.4                           
   85   85   A        +     0   0    2      4,-0.1     2,-0.2     1,-0.1    -4,-0.1   0.168  23.3 178.3 -33.1 112.6   -8.8   10.4   -8.7                           
   86   86   R     >  -     0   0   89      1,-0.1     4,-2.4    71,-0.0   -84,-0.2  -0.613  42.2-110.3-111.8 165.3   -9.5    8.5   -5.5                           
   87   87   R  H  > S+     0   0    0      2,-0.2     4,-3.0    -2,-0.2     5,-0.2   0.878 119.9  58.0 -70.1 -29.9   -8.7    5.0   -4.9                           
   88   88   R  H  > S+     0   0   88    -87,-1.3     4,-2.2     1,-0.2    -1,-0.2   0.957 109.0  47.7 -58.6 -43.4  -12.3    4.0   -4.9                           
   89   89   V  H  4 S+     0   0   38      1,-0.2     5,-0.3     2,-0.2    -1,-0.2   0.926 108.7  54.2 -62.0 -41.8  -12.3    5.5   -8.4                           
   90   90   G  H  X S+     0   0    0     -4,-2.4     4,-1.3     1,-0.2    -2,-0.2   0.952 108.3  47.9 -61.2 -43.2   -9.2    3.5   -9.2                           
   91   91   V  H  X S+     0   0    0     -4,-3.0     4,-2.4     2,-0.2     3,-0.4   0.917 108.5  57.1 -61.3 -39.6  -10.7    0.3   -8.2                           
   92   92   G  H  < S+     0   0    1     -4,-2.2    27,-0.4     1,-0.3    -1,-0.2   0.954 105.6  47.7 -60.4 -53.2  -13.8    1.1  -10.3                           
   93   93   P  H  4 S+     0   0   14      0, 0.0    -1,-0.3     0, 0.0    -2,-0.2   0.761 110.0  54.4 -57.0 -24.8  -11.9    1.6  -13.4                           
   94   94   M  H  < S-     0   0    1     -4,-1.3    48,-0.6    -3,-0.4    -2,-0.2   0.906 141.0 -20.6 -69.8 -37.0  -10.2   -1.6  -12.7                           
   95   95   T  S  < S-     0   0    0     -4,-2.4    28,-0.7    -5,-0.1    27,-0.3   0.642  75.2-168.9-132.4 -82.3  -13.6   -3.2  -12.4                           
   96   96   W        +     0   0   81     -5,-0.2     3,-0.1    26,-0.1    24,-0.0  -0.684  47.6 114.8 114.4-160.3  -16.9   -1.4  -11.7                           
   97   97   D        +     0   0   86      1,-0.3     2,-0.8    -2,-0.2    -1,-0.1   0.874  50.7 161.4  57.4  37.5  -20.4   -2.5  -10.8                           
   98   98   D        +     0   0   37    -85,-0.0    -1,-0.3     2,-0.0     2,-0.2  -0.818  15.2 114.6 -94.3 113.4  -19.7   -0.6   -7.6                           
   99   99   G        +     0   0   47     -2,-0.8     2,-0.3    -3,-0.1     0, 0.0  -0.751  29.1 166.6-176.5 129.3  -23.0    0.1   -5.9                           
  100  100   L        -     0   0   97     -2,-0.2     2,-2.3     2,-0.1    -2,-0.0  -0.886  54.0 -82.8-142.3 171.5  -24.5   -1.0   -2.7                           
  101  101   N  S    S+     0   0  170     -2,-0.3     2,-0.3     2,-0.1    -2,-0.0  -0.579  87.6 120.0 -77.4  84.4  -27.3   -0.2   -0.4                           
  102  102   Y  S    S-     0   0  152     -2,-2.3     2,-0.7     2,-0.0    -2,-0.1  -0.889  70.2-105.0-141.7 167.9  -25.2    2.5    1.2                           
  103  103   I        +     0   0  125     -2,-0.3     2,-0.5     2,-0.0    -2,-0.1  -0.889  38.8 175.1-104.6 115.8  -25.5    6.2    1.7                           
  104  104   D        -     0   0   99     -2,-0.7     2,-0.2     0, 0.0    -2,-0.0  -0.973  31.8-129.5-118.3 123.0  -23.1    8.1   -0.5                           
  105  105   N        -     0   0  132     -2,-0.5     2,-0.3     1,-0.1    -2,-0.0  -0.545  35.7-139.5 -66.0 136.5  -23.3   11.8   -0.6                           
  106  106   V        -     0   0  128     -2,-0.2     2,-0.4     2,-0.0    -1,-0.1  -0.767  17.2-159.8-107.3 149.1  -23.5   12.6   -4.2                           
  107  107   Y        -     0   0  189     -2,-0.3     2,-0.6     0, 0.0    -2,-0.0  -0.967  22.1-136.4-118.1 136.2  -21.9   15.3   -6.2                           
  108  108   G        +     0   0   75     -2,-0.4     2,-0.1     3,-0.0    -2,-0.0  -0.860  25.7 172.5-111.0 124.7  -23.5   16.1   -9.4                           
  109  109   D        -     0   0  148     -2,-0.6     2,-0.8     1,-0.1     0, 0.0  -0.302  59.8 -68.0 -97.9-171.8  -21.6   16.6  -12.6                           
  110  110   L        -     0   0  127     -2,-0.1     2,-1.0     1,-0.1    -1,-0.1  -0.766  58.2-157.6 -80.0 118.7  -23.3   17.0  -15.9                           
  111  111   E        +     0   0  176     -2,-0.8    -1,-0.1     1,-0.1    -3,-0.0  -0.738  49.5 119.5-109.0  91.8  -24.6   13.5  -16.3                           
  112  112   E        +     0   0  162     -2,-1.0     2,-0.3     2,-0.1    -1,-0.1  -0.519  62.5  76.7-136.1  66.3  -25.3   12.7  -19.9                           
  113  113   Q        -     0   0  157      3,-0.0     3,-0.0     0, 0.0    -2,-0.0  -0.980  58.8-142.5-164.8 167.7  -23.0    9.8  -20.2                           
  114  114   K        -     0   0  182     -2,-0.3     2,-0.1     1,-0.1    -2,-0.1  -0.670  61.4 -53.0-126.0-177.6  -22.2    6.2  -19.6                           
  115  115   P        +     0   0   90      0, 0.0     3,-0.1     0, 0.0    -1,-0.1  -0.450  60.1 157.2 -66.9 133.7  -18.9    4.8  -18.7                           
  116  116   D        +     0   0   90      1,-0.7     2,-0.2    -2,-0.1     4,-0.0   0.618  67.1  21.4-113.1 -81.0  -16.2    5.7  -21.2                           
  117  117   F  S    S+     0   0  146      2,-0.1    -1,-0.7     3,-0.1     2,-0.3  -0.632 100.7  64.0 -87.9 155.0  -12.9    5.4  -19.5                           
  118  118   D  S    S-     0   0   60     -2,-0.2     2,-2.6   -25,-0.2     3,-0.2  -0.889 119.4 -13.7 129.3-154.5  -12.6    3.2  -16.4                           
  119  119   S  S  > S-     0   0    3    -27,-0.4     4,-0.5    -2,-0.3     3,-0.2  -0.551  78.0-177.2 -73.6  85.2  -13.1   -0.5  -16.5                           
  120  120   K  T  4 S-     0   0  123     -2,-2.6    -1,-0.2     1,-0.3    -3,-0.1   0.924  79.4 -16.8 -55.8 -52.3  -14.7    0.1  -19.9                           
  121  121   L  T  > S+     0   0  118     -3,-0.2     4,-1.6    17,-0.2    -1,-0.3  -0.152  99.3 119.9-141.6  43.2  -15.5   -3.5  -20.1                           
  122  122   E  H  > S+     0   0    7    -27,-0.3     4,-1.6     2,-0.2    -2,-0.1   0.928  84.0  48.3 -73.5 -34.9  -13.4   -5.1  -17.6                           
  123  123   L  H >< S+     0   0   25    -28,-0.7     3,-1.0    -4,-0.5    -1,-0.1   0.984 118.8  38.0 -62.9 -50.3  -16.6   -6.3  -16.0                           
  124  124   P  H 34 S+     0   0   84      0, 0.0    -1,-0.2     0, 0.0    -2,-0.2   0.724 107.7  68.0 -70.1 -19.3  -17.9   -7.6  -19.2                           
  125  125   N  H 3< S+     0   0   10     -4,-1.6     9,-3.3    13,-0.1     2,-0.4   0.815  96.0  61.5 -67.8 -34.3  -14.5   -8.7  -20.1                           
  126  126   Y  E << S-E  133   0C  30     -4,-1.6     2,-0.4    -3,-1.0     7,-0.2  -0.756  70.2-170.9 -92.3 142.4  -14.7  -11.3  -17.4                           
  127  127   D  E  >> -E  132   0C  75      5,-1.6     4,-1.7    -2,-0.4     5,-1.2  -0.937  14.2-163.8-135.3 114.7  -17.4  -13.9  -17.8                           
  128  128   Y  T  45S+     0   0  104     -2,-0.4    -1,-0.1     2,-0.2     5,-0.0   0.863  89.5  63.0 -64.9 -36.2  -18.1  -16.2  -15.0                           
  129  129   N  T  45S+     0   0  143      1,-0.3    -1,-0.2     2,-0.1    -2,-0.0   0.931 114.7  33.1 -56.3 -46.6  -20.0  -18.6  -17.2                           
  130  130   S  T  45S-     0   0   58      2,-0.2    -1,-0.3    -3,-0.2    -2,-0.2   0.726 101.2-145.6 -76.4 -23.8  -16.9  -19.2  -19.2                           
  131  131   N  T  <5S+     0   0   99     -4,-1.7     2,-0.3     1,-0.3    -3,-0.2   0.808  70.4  76.8  60.5  31.9  -14.9  -18.7  -15.9                           
  132  132   T  E     +     0   0   18     -3,-0.1     2,-1.5     1,-0.1     4,-1.0   0.330  38.3 104.6 -87.5  -7.3   -8.7   -8.2  -19.0                           
  140  140   G  T  4 S+     0   0   59      1,-0.2    -1,-0.1     2,-0.1   -18,-0.0  -0.554  75.7  36.1 -93.4  84.6   -5.6   -7.3  -16.9                           
  141  141   H  T >> S+     0   0   31     -2,-1.5     4,-1.9   -19,-0.1     3,-0.9  -0.134 106.4  55.3-176.5 -63.7   -6.9   -5.5  -13.8                           
  142  142   Y  H 3> S+     0   0   10    -48,-0.6     4,-2.8     1,-0.3     5,-0.3   0.895 102.6  64.2 -52.5 -41.0  -10.2   -6.9  -12.7                           
  143  143   T  H 3X S+     0   0   40     -4,-1.0     4,-1.1     1,-0.2    -1,-0.3   0.864 104.1  44.3 -54.2 -44.8   -8.5  -10.2  -12.6                           
  144  144   Q  H <4 S+     0   0    3     -3,-0.9     3,-0.4     2,-0.2    -1,-0.2   0.932 111.9  51.6 -68.0 -42.8   -6.2   -9.0   -9.8                           
  145  145   V  H  < S+     0   0    9     -4,-1.9    -2,-0.2     1,-0.3    -1,-0.2   0.922 118.3  38.4 -58.9 -44.6   -8.9   -7.4   -7.9                           
  146  146   V  H  < S+     0   0   21     -4,-2.8    -1,-0.3    -5,-0.2    -2,-0.2   0.620  83.1 138.7 -75.9 -19.8  -10.9  -10.6   -8.0                           
  147  147   W    ><  -     0   0   75     -4,-1.1     3,-0.7    -3,-0.4    -3,-0.1  -0.042  40.1-160.7 -42.2 109.9   -7.9  -12.8   -7.5                           
  148  148   R  T 3  S+     0   0  162      1,-0.2    -1,-0.2  -133,-0.0    -4,-0.0   0.846  82.6  65.8 -63.8 -36.2   -9.1  -15.4   -5.2                           
  149  149   K  T 3  S+     0   0  119     25,-0.1     2,-0.6     2,-0.1    -1,-0.2   0.842  84.0  83.2 -60.0 -35.9   -5.6  -16.4   -4.1                           
  150  150   S    <   +     0   0    9     -3,-0.7    -1,-0.0     1,-0.2    25,-0.0  -0.612  42.4 166.2 -85.6 116.7   -4.8  -13.1   -2.5                           
  151  151   V        +     0   0   96     21,-0.8  -126,-1.9    -2,-0.6    -1,-0.2   0.768  61.2  72.4 -83.3 -40.4   -6.0  -12.8    1.1                           
  152  152   R  E     +a   25   0A  81     20,-1.2    20,-0.4  -128,-0.2     2,-0.3  -0.422  58.7 177.3 -82.2 152.3   -4.0   -9.7    1.9                           
  153  153   L  E     +a   26   0A   4   -128,-0.6  -126,-2.2    18,-0.1  -125,-0.5  -0.969  10.5 153.3-154.3 141.6   -4.8   -6.3    0.6                           
  154  154   G  E     +D  170   0B   2     16,-1.1    16,-2.7    -2,-0.3     2,-0.3  -0.870  12.7 171.0-165.2 139.7   -3.3   -2.9    1.2                           
  155  155   c  E     -D  169   0B   4     -2,-0.3     2,-0.3    14,-0.3  -120,-0.3  -0.897   7.8-173.0-145.8 170.2   -3.2    0.2   -1.1                           
  156  156   A  E     -D  168   0B   8     12,-2.5    12,-2.5    -2,-0.3     2,-0.4  -0.985  16.1-134.2-163.9 161.8   -2.3    3.8   -1.2                           
  157  157   R  E     +D  167   0B 115     -2,-0.3     2,-0.3    10,-0.2    10,-0.2  -0.934  20.3 176.3-120.6 144.7   -2.4    6.9   -3.2                           
  158  158   V  E     -D  166   0B  22      8,-3.0     8,-3.7    -2,-0.4     2,-0.4  -0.991  31.7-113.2-143.2 149.5    0.3    9.4   -3.8                           
  159  159   R  E     -D  165   0B 180     -2,-0.3     6,-0.3     6,-0.3     5,-0.1  -0.658  31.1-136.2 -88.3 136.5    0.4   12.5   -6.0                           
  160  160   a    >   -     0   0    7      4,-3.3     3,-1.9    -2,-0.4  -117,-0.2  -0.365  26.7-103.7 -85.7 172.1    2.7   12.4   -8.9                           
  161  161   N  T 3  S+     0   0   87   -119,-1.5    -1,-0.1     1,-0.3  -118,-0.1   0.735 118.2  65.7 -64.0 -25.5    5.0   15.1  -10.0                           
  162  162   S  T 3  S-     0   0   45   -120,-0.2    -1,-0.3     2,-0.1     3,-0.1   0.391 118.2-107.2 -77.3  -1.3    2.6   15.9  -12.8                           
  163  163   G  S <  S+     0   0   44     -3,-1.9    -2,-0.1     1,-0.4    -1,-0.1   0.228  89.7 113.0  95.3 -17.9   -0.1   17.0  -10.3                           
  164  164   W  S    S-     0   0  102     -5,-0.1    -4,-3.3   -83,-0.1     2,-0.5  -0.290  70.9-108.2 -85.0 170.4   -2.0   13.8  -11.1                           
  165  165   V  E     - D   0 159B   5     -6,-0.3   -84,-1.6    -3,-0.1     2,-0.3  -0.900  21.8-158.2-112.9 135.8   -2.5   11.0   -8.6                           
  166  166   F  E     -CD  80 158B   1     -8,-3.7    -8,-3.0    -2,-0.5     2,-0.3  -0.771  12.4-171.9 -99.9 141.8   -0.8    7.7   -8.6                           
  167  167   I  E     -CD  79 157B   1    -88,-2.9   -88,-2.5    -2,-0.3     2,-0.3  -0.994   4.7-172.5-136.5 147.7   -2.3    4.7   -6.7                           
  168  168   T  E     - D   0 156B   1    -12,-2.5   -12,-2.5    -2,-0.3     2,-0.3  -0.935   7.0-166.6-131.5 154.8   -1.0    1.3   -6.0                           
  169  169   c  E     - D   0 155B   0    -92,-0.4   -92,-1.6    -2,-0.3   -14,-0.3  -0.896  13.7-154.2-143.9 113.3   -2.7   -1.8   -4.4                           
  170  170   N  E     -BD  76 154B  13    -16,-2.7   -16,-1.1    -2,-0.3     2,-0.3  -0.593  11.8-176.0 -92.4 149.2   -0.5   -4.7   -3.3                           
  171  171   Y        -     0   0    3    -96,-2.5     4,-0.2    -2,-0.2   -18,-0.1  -0.995  15.5-128.8-142.4 144.4   -1.6   -8.3   -3.1                           
  172  172   D  S    S+     0   0   71    -20,-0.4   -20,-1.2    -2,-0.3   -21,-0.8  -0.990  85.4  38.6-137.1 137.6    0.1  -11.4   -1.8                           
  173  173   P  S    S-     0   0   56      0, 0.0   -21,-0.0     0, 0.0   -23,-0.0   0.681 111.4 -92.6 -71.4 175.8    0.4  -14.1   -3.0                           
  174  174   P              0   0   42      0, 0.0   -99,-0.3     0, 0.0    -2,-0.1  -0.139 360.0 360.0 -59.3 150.5    1.1  -12.8   -6.5                           
  175  175   G              0   0   12   -101,-1.0   -31,-0.2    -4,-0.2   -99,-0.2  -0.512 360.0 360.0-154.0 360.0   -1.9  -12.5   -8.7