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                                                                                                                         .
  226  1  1  1  0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN)                .
 14128.5   ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2)                                                                         .
  101 44.7   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J)  , SAME NUMBER PER 100 RESIDUES                              .
    3  1.3   TOTAL NUMBER OF HYDROGEN BONDS IN     PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES                              .
   14  6.2   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                              .
    2  0.9   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES                              .
    1  0.4   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                              .
   16  7.1   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES                              .
   11  4.9   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES                              .
   40 17.7   TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES                              .
    5  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  0  1  0  0  0  1  1  2  0  0  0  0  0  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      .
  2  1  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  .
  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    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   D              0   0   90      0, 0.0    50,-0.0     0, 0.0     0, 0.0   0.000 360.0 360.0 360.0 136.9   -9.1  -17.9   29.1                           
    2    2   P        -     0   0  128      0, 0.0     2,-0.1     0, 0.0    48,-0.0  -0.597 360.0-124.1 -72.1 134.9  -12.8  -18.1   29.6                           
    3    3   P        -     0   0  105      0, 0.0     2,-0.3     0, 0.0    47,-0.0  -0.455  14.2-137.5 -79.8 152.6  -14.6  -17.2   26.4                           
    4    4   D        -     0   0   90      2,-0.1     2,-2.3    -2,-0.1     0, 0.0  -0.770  28.1-110.0-102.2 153.2  -17.1  -14.5   26.2                           
    5    5   K  S    S+     0   0  108     -2,-0.3     2,-0.3     2,-0.0    98,-0.2  -0.516  82.5 107.2 -83.8  79.9  -20.2  -15.1   24.2                           
    6    6   L  S    S-     0   0   48     -2,-2.3     2,-0.5    96,-0.1    -2,-0.1  -0.981  72.0-114.3-148.6 154.3  -19.2  -12.6   21.5                           
    7    7   F        +     0   0   17     -2,-0.3    89,-0.3   217,-0.0     2,-0.3  -0.829  39.9 172.9 -91.7 131.0  -18.0  -12.8   18.0                           
    8    8   T        -     0   0   52     -2,-0.5     2,-0.2    86,-0.1    38,-0.2  -0.802  41.7 -67.0-129.9 171.2  -14.4  -11.5   17.6                           
    9    9   V        +     0   0   20     36,-2.4     3,-0.1    -2,-0.3    85,-0.0  -0.427  39.4 172.9 -73.6 125.1  -12.1  -11.5   14.6                           
   10   10   H        -     0   0  117      1,-0.4     2,-0.3    -2,-0.2    -1,-0.2   0.754  65.5 -41.7 -85.8 -44.5  -10.8  -14.8   13.3                           
   11   11   G        -     0   0   28      2,-0.0     2,-0.4    73,-0.0    -1,-0.4  -0.974  32.3-134.1-179.2 161.2   -9.1  -13.4   10.2                           
   12   12   L        -     0   0   41     -2,-0.3    72,-0.1    -3,-0.1    -3,-0.0  -0.949  38.3-173.2-128.4 107.6   -9.0  -11.1    7.3                           
   13   13   W        -     0   0  102     -2,-0.4     2,-0.4    56,-0.0    54,-0.1  -0.899  27.2-140.0-117.5 127.5   -7.9  -13.1    4.3                           
   14   14   P        -     0   0   18      0, 0.0     2,-0.3     0, 0.0    56,-0.1  -0.670  43.3-176.2 -70.2 134.9   -7.0  -11.9    0.9                           
   15   15   S        -     0   0   64     -2,-0.4     2,-0.3     6,-0.2   163,-0.1  -0.904  26.6-124.4-141.4 163.8   -8.6  -14.7   -1.1                           
   16   16   N        -     0   0   77     -2,-0.3     3,-0.1     3,-0.3     5,-0.1  -0.819  13.7-138.9-110.1 146.7   -9.0  -16.0   -4.6                           
   17   17   L  S    S+     0   0  139     -2,-0.3     2,-0.4     1,-0.2    -1,-0.1   0.921  94.9  30.6 -66.8 -43.5  -12.2  -16.8   -6.4                           
   18   18   N  S    S-     0   0  154      2,-0.1    -1,-0.2    -3,-0.1     0, 0.0  -0.958 117.9  -3.9-121.5 134.1  -10.9  -19.9   -7.9                           
   19   19   G  S    S-     0   0   43     -2,-0.4    -3,-0.3    -3,-0.1     0, 0.0  -0.184 103.4 -18.3  84.7-179.1   -8.2  -22.0   -6.4                           
   20   20   P        -     0   0  110      0, 0.0    -2,-0.1     0, 0.0     3,-0.1  -0.170  68.1-109.3 -63.1 152.0   -6.2  -21.6   -3.3                           
   21   21   H        -     0   0   73      1,-0.1    -6,-0.2    -6,-0.1     2,-0.1  -0.347  39.2 -99.3 -77.7 159.3   -5.8  -18.3   -1.5                           
   22   22   P        -     0   0   44      0, 0.0     2,-0.3     0, 0.0    -1,-0.1  -0.463  44.5-172.4 -75.9 156.0   -2.5  -16.5   -1.5                           
   23   23   E        +     0   0  119      1,-0.1    43,-0.2    -2,-0.1    42,-0.1  -0.988  52.0   1.3-153.0 147.6   -0.3  -16.9    1.5                           
   24   24   N  S    S-     0   0   87     41,-1.8    41,-0.2    -2,-0.3     2,-0.1   0.896  74.7-177.2  46.7  55.4    2.9  -15.5    2.9                           
   25   25   a        -     0   0   42     40,-0.4    -1,-0.1    39,-0.3    45,-0.1  -0.461  38.7 -79.7 -81.8 160.9    3.5  -13.1    0.0                           
   26   26   T        -     0   0  138     -2,-0.1     2,-0.2     1,-0.1    -1,-0.1  -0.334  50.6-120.5 -63.9 136.2    6.6  -11.0   -0.0                           
   27   27   N        -     0   0   59      1,-0.1    -1,-0.1    -3,-0.1     3,-0.1  -0.537  11.7-154.8 -83.1 138.8    6.4   -8.0    2.2                           
   28   28   A  S    S-     0   0   83     -2,-0.2     2,-0.3     1,-0.2    -1,-0.1   0.848  78.3  -0.3 -72.7 -42.9    6.8   -4.5    0.9                           
   29   29   T        -     0   0   74     46,-0.1     2,-0.5     2,-0.0    -1,-0.2  -0.910  65.3-124.0-145.0 169.1    8.0   -3.0    4.2                           
   30   30   V        -     0   0  117     -2,-0.3     3,-0.1    -3,-0.1    46,-0.0  -0.968  11.9-163.1-121.3 118.1    8.7   -4.0    7.7                           
   31   31   N        -     0   0   57     -2,-0.5    -2,-0.0     1,-0.2     3,-0.0  -0.874  13.8-154.8 -98.4 103.8    6.9   -2.2   10.4                           
   32   32   P        +     0   0   91      0, 0.0     2,-0.3     0, 0.0    -1,-0.2   0.789  66.8   3.1 -51.5 -34.0    9.1   -3.2   13.2                           
   33   33   H        -     0   0  147     -3,-0.1     2,-0.3     0, 0.0    45,-0.1  -0.994  59.3-128.8-156.9 160.0    6.4   -2.7   15.6                           
   34   34   R        -     0   0   13     -2,-0.3     2,-0.1     1,-0.1    44,-0.0  -0.781  41.8-102.3-104.3 153.4    2.8   -1.9   16.3                           
   35   35   I     >  -     0   0   87     -2,-0.3     4,-2.0     1,-0.1     5,-0.2  -0.368  25.7-119.4 -74.5 151.3    1.8    0.7   18.9                           
   36   36   K  H  > S+     0   0  162      1,-0.2     4,-2.4     2,-0.2     5,-0.2   0.908 112.5  55.9 -59.4 -41.5    0.6   -0.3   22.3                           
   37   37   N  H  > S+     0   0   96      1,-0.2     4,-1.8     2,-0.2    -1,-0.2   0.895 105.7  50.3 -63.4 -37.7   -2.7    1.3   21.8                           
   38   38   I  H  > S+     0   0    5      1,-0.2     4,-2.2     2,-0.2    -1,-0.2   0.941 110.8  50.5 -63.4 -40.8   -3.4   -0.6   18.6                           
   39   39   Q  H  X S+     0   0   53     -4,-2.0     4,-2.0     1,-0.2    -2,-0.2   0.866 105.4  57.0 -62.7 -36.4   -2.5   -3.8   20.5                           
   40   40   A  H  X S+     0   0   50     -4,-2.4     4,-1.1     1,-0.2    -1,-0.2   0.904 108.1  46.6 -61.9 -41.5   -4.9   -2.7   23.2                           
   41   41   Q  H  X S+     0   0   82     -4,-1.8     4,-2.9     1,-0.2     3,-0.5   0.903 110.4  52.9 -66.4 -40.9   -7.7   -2.6   20.6                           
   42   42   L  H  X S+     0   0    0     -4,-2.2     4,-2.1     1,-0.3    -1,-0.2   0.832  98.6  65.1 -64.5 -32.6   -6.7   -5.9   19.2                           
   43   43   K  H  < S+     0   0   97     -4,-2.0    -1,-0.3     1,-0.2    -2,-0.2   0.922 113.4  32.7 -57.5 -44.4   -6.9   -7.4   22.6                           
   44   44   I  H  < S+     0   0  126     -4,-1.1    -2,-0.2    -3,-0.5    -1,-0.2   0.940 132.1  30.0 -75.5 -50.0  -10.6   -6.7   22.6                           
   45   45   I  H  < S+     0   0    8     -4,-2.9   -36,-2.4     1,-0.2    -3,-0.2   0.876 133.3  25.9 -75.6 -49.9  -11.4   -7.2   18.9                           
   46   46   W  S  < S+     0   0    1     -4,-2.1    -1,-0.2    -5,-0.3    -3,-0.1  -0.140  80.7 162.1-102.2  21.8   -8.8   -9.8   17.8                           
   47   47   P        -     0   0   19      0, 0.0     2,-0.9     0, 0.0     3,-0.1  -0.153  46.5-118.9 -52.9 151.0   -7.9  -11.7   20.9                           
   48   48   N        -     0   0   23      1,-0.2     6,-0.1     4,-0.1     7,-0.1  -0.851  29.1-160.0 -85.6 107.9   -6.2  -15.1   20.8                           
   49   49   V  S    S+     0   0   84     -2,-0.9     3,-0.3     1,-0.2    -1,-0.2   0.835  82.7  55.1 -63.6 -38.2   -8.9  -17.0   22.5                           
   50   50   L  S    S-     0   0  136      1,-0.3     2,-0.3    -3,-0.1    -1,-0.2   0.940 130.0  -3.9 -64.6 -48.1   -6.8  -19.9   23.5                           
   51   51   D    >   -     0   0   75      1,-0.1     3,-1.1     3,-0.1    -1,-0.3  -0.850  52.5-162.0-153.5 115.2   -4.2  -17.9   25.3                           
   52   52   R  G >  S+     0   0  104     -2,-0.3     3,-1.6     1,-0.3     4,-0.2   0.803  88.4  73.6 -63.7 -29.3   -4.1  -14.1   25.6                           
   53   53   T  G 3  S+     0   0  108      1,-0.3     3,-0.5     2,-0.1    -1,-0.3   0.875  95.9  47.9 -57.1 -38.5   -0.5  -14.3   26.6                           
   54   54   N  G <> S+     0   0   88     -3,-1.1     4,-1.6     1,-0.2    -1,-0.3  -0.115  72.5 120.2 -99.2  44.3    0.6  -15.2   23.1                           
   55   55   H  H <> S+     0   0   17     -3,-1.6     4,-3.0     1,-0.2     5,-0.2   0.926  71.6  55.5 -66.3 -42.2   -1.3  -12.4   21.3                           
   56   56   V  H  > S+     0   0   75     -3,-0.5     4,-2.3     1,-0.2    -1,-0.2   0.924 110.3  41.5 -61.1 -48.7    1.8  -10.9   19.9                           
   57   57   G  H  > S+     0   0   29      1,-0.2     4,-2.0     2,-0.2    -1,-0.2   0.896 114.9  54.7 -64.8 -37.8    3.1  -14.0   18.1                           
   58   58   F  H  X S+     0   0   47     -4,-1.6     4,-1.6     1,-0.2    -2,-0.2   0.916 109.5  44.9 -61.0 -47.5   -0.5  -14.7   17.0                           
   59   59   W  H  X S+     0   0    3     -4,-3.0     4,-2.2     1,-0.2    -1,-0.2   0.897 108.8  57.4 -66.0 -38.7   -0.9  -11.3   15.4                           
   60   60   N  H  X S+     0   0   69     -4,-2.3     4,-2.8     1,-0.2    -1,-0.2   0.917 106.8  48.8 -59.7 -42.1    2.4  -11.5   13.8                           
   61   61   K  H  X S+     0   0  102     -4,-2.0     4,-3.4     1,-0.2     5,-0.4   0.882 106.6  55.9 -65.9 -37.5    1.5  -14.7   12.0                           
   62   62   Q  H  X>S+     0   0   10     -4,-1.6     4,-2.0     1,-0.2     5,-1.7   0.928 111.9  43.9 -61.4 -43.4   -1.8  -13.2   10.9                           
   63   63   W  H  <>S+     0   0   25     -4,-2.2     5,-2.3     3,-0.2    -2,-0.2   0.952 115.8  46.6 -64.3 -48.5    0.1  -10.4    9.2                           
   64   64   I  H  <5S+     0   0   71     -4,-2.8   -39,-0.3    -5,-0.2    -2,-0.2   0.941 122.0  34.3 -63.9 -47.9    2.7  -12.6    7.7                           
   65   65   K  H  <5S+     0   0   76     -4,-3.4   -41,-1.8    -5,-0.2   -40,-0.4   0.980 138.1   7.0 -70.4 -59.8    0.4  -15.2    6.4                           
   66   66   H  T ><5S+     0   0   12     -4,-2.0     3,-1.9    -5,-0.4     4,-0.3   0.917 121.5  54.3 -90.0 -51.7   -2.7  -13.2    5.4                           
   67   67   G  G >   S+     0   0    2     -3,-1.9     4,-1.5    -4,-0.3     3,-0.8   0.510  72.7 163.3 -71.9 -20.6   -3.5   -7.6    0.7                           
   71   71   Y  T <4  +     0   0  142     -3,-0.5     4,-0.1     1,-0.3   108,-0.1  -0.178  55.8  20.0 -51.6 147.2   -1.2   -4.9   -0.9                           
   72   72   P  T 34 S+     0   0   63      0, 0.0    -1,-0.3     0, 0.0    -2,-0.1  -0.994 130.6  42.4 -84.7 -12.3   -1.9   -2.3   -2.0                           
   73   73   A  T <4 S+     0   0   31     -3,-0.8     2,-0.9     1,-0.2    -2,-0.2   0.917 120.2  49.5 -60.8 -38.9   -5.2   -1.9   -0.3                           
   74   74   I  S  < S-     0   0   15     -4,-1.5    -1,-0.2     1,-0.2     6,-0.1  -0.871  79.5-177.0 -96.7 105.0   -3.6   -3.2    2.8                           
   75   75   M        -     0   0   91     -2,-0.9     2,-0.3     1,-0.1    -1,-0.2   0.889  52.8 -23.8 -70.9 -44.5   -0.4   -1.1    2.9                           
   76   76   N  S  > S-     0   0   31    -48,-0.1     4,-2.5     1,-0.1     5,-0.2  -0.915  74.6 -75.9-160.1-178.3    1.5   -2.5    5.9                           
   77   77   D  H  > S+     0   0    9     -2,-0.3     4,-1.7     1,-0.2     5,-0.2   0.898 127.3  44.6 -59.5 -45.3    1.3   -4.3    9.1                           
   78   78   T  H  > S+     0   0   20      1,-0.2     4,-2.5     2,-0.2    -1,-0.2   0.939 113.8  50.7 -64.9 -43.4   -0.2   -1.4   11.1                           
   79   79   H  H  > S+     0   0   48      1,-0.2     4,-2.8     2,-0.2    -2,-0.2   0.855 104.9  58.1 -63.2 -37.0   -2.6   -0.6    8.3                           
   80   80   Y  H  X S+     0   0    0     -4,-2.5     4,-1.8     1,-0.2    -1,-0.2   0.947 111.2  40.4 -60.4 -48.8   -3.8   -4.2    8.2                           
   81   81   F  H  X S+     0   0    0     -4,-1.7     4,-2.2     1,-0.2    -1,-0.2   0.894 114.3  52.8 -67.8 -39.4   -4.8   -4.2   11.8                           
   82   82   Q  H  X S+     0   0   96     -4,-2.5     4,-2.5     1,-0.2    -1,-0.2   0.895 107.1  53.9 -63.0 -37.7   -6.2   -0.7   11.6                           
   83   83   T  H  X S+     0   0   39     -4,-2.8     4,-2.4     1,-0.2    -1,-0.2   0.916 107.5  49.5 -62.3 -43.5   -8.3   -1.9    8.6                           
   84   84   V  H  X S+     0   0    0     -4,-1.8     4,-2.7     1,-0.2    -1,-0.2   0.915 111.5  48.9 -62.2 -42.5   -9.7   -4.8   10.6                           
   85   85   I  H  X>S+     0   0   16     -4,-2.2     4,-3.2     1,-0.2     5,-0.6   0.916 109.2  53.6 -62.4 -42.5  -10.6   -2.4   13.4                           
   86   86   N  I  <>S+     0   0   76     -4,-2.5     5,-2.6     1,-0.2     6,-0.3   0.925 111.5  44.6 -61.0 -44.5  -12.2   -0.1   11.0                           
   87   87   M  I  <5S+     0   0   33     -4,-2.4     6,-2.1     3,-0.2     7,-0.2   0.953 117.3  44.4 -65.6 -45.6  -14.4   -2.8    9.6                           
   88   88   Y  I  <5S+     0   0   30     -4,-2.7     6,-1.5     5,-0.2    -2,-0.2   0.946 130.9  17.8 -65.1 -55.3  -15.4   -4.2   13.0                           
   89   89   I  I  <5S+     0   0   70     -4,-3.2     3,-0.4    -5,-0.2    -3,-0.2   0.965 132.8  33.3 -81.8 -61.0  -16.1   -0.9   14.8                           
   90   90   T  I     -     0   0   10     -6,-1.5     4,-1.9    -7,-0.2     3,-0.4  -0.332  51.7-149.1 -46.6 115.4  -19.2   -6.7   14.6                           
   95   95   V  H  > S+     0   0   15      1,-0.3     4,-2.7     2,-0.2     5,-0.3   0.833  93.7  58.0 -63.8 -36.6  -21.3   -9.9   14.0                           
   96   96   S  H  > S+     0   0   12    -89,-0.3     4,-2.9     1,-0.2    -1,-0.3   0.925 109.3  47.5 -61.2 -38.4  -22.6   -9.9   17.6                           
   97   97   E  H  4 S+     0   0   33     -3,-0.4    31,-0.2     2,-0.2    -2,-0.2   0.870 109.8  51.0 -68.2 -40.5  -24.0   -6.5   16.9                           
   98   98   I  H  < S+     0   0   13     -4,-1.9    30,-1.4     1,-0.2    -1,-0.2   0.956 115.4  42.8 -63.0 -46.7  -25.5   -7.4   13.6                           
   99   99   L  H  < S-     0   0    6     -4,-2.7    31,-3.1     1,-0.2     2,-0.3   0.918 137.7 -45.5 -65.0 -44.2  -27.2  -10.3   15.2                           
  100  100   S  S  < S-     0   0    6     -4,-2.9    27,-0.2    -5,-0.3    -1,-0.2  -0.881  85.5 -41.9-167.1-167.1  -28.2   -8.3   18.2                           
  101  101   G        -     0   0   11     25,-0.3     2,-0.2    -2,-0.3     6,-0.1  -0.365  57.6-120.3 -72.0 156.4  -26.8   -5.9   20.7                           
  102  102   S        -     0   0   22     29,-0.1     2,-1.5    -5,-0.1     3,-0.4  -0.621  23.4-114.5 -90.7 159.6  -23.4   -6.5   22.0                           
  103  103   L        +     0   0   28      1,-0.2     3,-0.2    -2,-0.2     6,-0.1  -0.483  61.9 140.9 -93.6  68.9  -22.9   -6.9   25.7                           
  104  104   T  S    S+     0   0  120     -2,-1.5     2,-0.3     4,-0.4    -1,-0.2   0.947  90.9  11.9 -66.3 -42.5  -20.9   -3.8   26.3                           
  105  105   Q  B >  S-A  108   0A 108      3,-0.7     3,-1.7    -3,-0.4    -1,-0.3  -0.926 110.9 -89.7-124.4 148.6  -23.1   -3.7   29.4                           
  106  106   F  T 3  S-     0   0  162     -2,-0.3     3,-0.1     1,-0.3    -3,-0.1  -0.461 102.5 -18.7 -70.5 126.8  -25.1   -6.7   30.3                           
  107  107   R  T 3  S+     0   0  211     -2,-0.3     2,-0.3     1,-0.2    -1,-0.3   0.776 116.2 111.7  54.8  30.7  -28.5   -6.5   28.7                           
  108  108   N  B <   +A  105   0A  77     -3,-1.7    -3,-0.7    -6,-0.2    -4,-0.4  -0.958  36.1 161.8-133.7 153.5  -28.0   -2.8   28.2                           
  109  109   C        -     0   0   60     -2,-0.3    -6,-0.0     1,-0.3    16,-0.0  -0.741  46.3 -57.3-147.0-167.1  -27.6   -0.8   25.1                           
  110  110   P  S    S-     0   0   81      0, 0.0    -1,-0.3     0, 0.0    15,-0.0  -0.166  95.1 -31.8 -72.0-178.9  -27.9    2.8   24.0                           
  111  111   H        -     0   0  169      1,-0.2     0, 0.0     3,-0.0     0, 0.0   0.043  62.9-132.7 -42.4 130.8  -31.1    4.7   24.4                           
  112  112   P        +     0   0  105      0, 0.0    -1,-0.2     0, 0.0    -4,-0.0   0.640  69.6 105.6 -66.1 -20.6  -33.9    2.3   24.1                           
  113  113   P        -     0   0   95      0, 0.0     2,-0.2     0, 0.0     0, 0.0  -0.454  59.5-144.4 -72.6 137.0  -36.1    4.2   21.7                           
  114  114   P        -     0   0  100      0, 0.0     2,-0.8     0, 0.0    -3,-0.0  -0.473  24.1-115.3 -82.5 164.9  -36.3    3.0   18.2                           
  115  115   G        +     0   0   41      1,-0.2     5,-0.4    -2,-0.2     3,-0.4  -0.485  64.9 136.8-104.5  64.8  -36.7    5.6   15.5                           
  116  116   S        +     0   0  106     -2,-0.8    -1,-0.2     1,-0.2     6,-0.0   0.784  57.9  70.9 -74.6 -29.0  -40.1    4.6   14.3                           
  117  117   P  S    S+     0   0  108      0, 0.0     2,-0.5     0, 0.0    -1,-0.2   0.803  96.7  52.3 -64.2 -26.8  -41.4    8.2   14.1                           
  118  118   Y  S    S-     0   0  188     -3,-0.4     2,-2.2     2,-0.1     4,-0.0  -0.924  75.6-142.3-112.4 131.7  -39.3    9.1   11.1                           
  119  119   L  S    S+     0   0  189     -2,-0.5    -3,-0.1     2,-0.0    -1,-0.0  -0.524  71.5 101.6 -86.0  73.5  -39.3    6.9    8.1                           
  120  120   C  S    S-     0   0   85     -2,-2.2     2,-0.2    -5,-0.4    -2,-0.1  -0.933  88.3 -78.7-145.1 162.0  -35.6    7.5    7.6                           
  121  121   P        -     0   0  123      0, 0.0     2,-0.1     0, 0.0     3,-0.1  -0.539  50.7-151.0 -67.3 131.7  -32.7    5.4    8.3                           
  122  122   A        -     0   0   53     -2,-0.2     3,-0.1     1,-0.2    -6,-0.0  -0.356  35.0 -71.9 -93.1 176.7  -31.9    5.7   12.0                           
  123  123   D        -     0   0  141      1,-0.1     2,-0.2    -2,-0.1    -1,-0.2  -0.314  69.8 -85.3 -63.9 157.1  -28.5    5.3   13.6                           
  124  124   V        +     0   0   99     -3,-0.1     2,-0.2     2,-0.0    -1,-0.1  -0.494  58.8 167.4 -73.5 133.3  -27.4    1.8   13.4                           
  125  125   K        -     0   0  103     -2,-0.2     2,-1.3    -3,-0.1   -25,-0.0  -0.648  52.2 -75.6-127.8-173.4  -28.6   -0.4   16.3                           
  126  126   Y        +     0   0   68     -2,-0.2   -25,-0.3     1,-0.2     3,-0.2  -0.727  58.0 172.9 -96.2  92.3  -28.6   -4.1   16.9                           
  127  127   K        +     0   0  140     -2,-1.3    -1,-0.2   -27,-0.2   -28,-0.1   0.868  57.9  62.0 -71.7 -46.6  -31.4   -5.0   14.6                           
  128  128   A  S    S-     0   0   28    -30,-1.4   -28,-0.2   -31,-0.2    -1,-0.2   0.770  80.3-147.6 -63.8 -31.2  -31.7   -8.7   14.4                           
  129  129   K        +     0   0  134      1,-0.3     2,-0.6    -3,-0.2   -29,-0.3   0.862  48.2 140.6  67.0  34.2  -32.5   -9.2   18.0                           
  130  130   I        -     0   0   19    -31,-3.1    -1,-0.3   -34,-0.2    -2,-0.1  -0.956  32.5-170.9-112.3 119.1  -30.7  -12.5   18.0                           
  131  131   E    >   -     0   0   42     -2,-0.6     3,-0.6    95,-0.2     4,-0.3  -0.453  40.7 -96.5-109.8 171.8  -28.8  -12.9   21.2                           
  132  132   P  T 3  S+     0   0   28      0, 0.0    78,-0.1     0, 0.0    94,-0.1   0.005  77.9 127.7 -71.0  22.6  -26.3  -15.2   22.8                           
  133  133   L  T 3  S-     0   0   91     93,-0.2    75,-0.1    -2,-0.2    77,-0.0   0.808  74.4-119.8 -58.9 -37.5  -29.2  -17.0   24.5                           
  134  134   G    <   +     0   0    1     92,-1.0     2,-0.4    -3,-0.6    -1,-0.1   0.796  58.1 153.7  96.9  31.6  -28.3  -20.4   23.4                           
  135  135   I        -     0   0   70     91,-1.1    -1,-0.3    -4,-0.3     2,-0.1  -0.801  50.6-113.8-102.8 140.3  -31.5  -21.1   21.6                           
  136  136   Q        -     0   0   71     -2,-0.4    85,-0.3    83,-0.1    83,-0.2  -0.482  46.0-169.3 -65.4 137.2  -31.7  -23.5   18.7                           
  137  137   R  B     -B  220   0B  21     83,-2.0    83,-1.6    80,-0.2    75,-0.3  -0.921  25.9-103.7-134.6 161.6  -32.4  -21.4   15.7                           
  138  138   P     >  -     0   0   38      0, 0.0     4,-1.2     0, 0.0    79,-0.2  -0.523  30.4-127.4 -74.9 151.0  -33.4  -21.8   12.2                           
  139  139   L  H  > S+     0   0   11     77,-2.9     4,-2.3     1,-0.2     3,-0.4   0.909 106.6  57.6 -65.8 -41.2  -30.7  -21.3    9.7                           
  140  140   V  H  > S+     0   0   69     76,-0.4     4,-3.3     1,-0.3    -1,-0.2   0.835 101.1  55.9 -60.6 -37.8  -32.6  -18.7    7.7                           
  141  141   H  H  > S+     0   0   99      2,-0.2     4,-2.0     1,-0.2    -1,-0.3   0.915 109.5  46.3 -61.9 -42.2  -33.1  -16.5   10.7                           
  142  142   I  H  X S+     0   0    1     -4,-1.2     4,-1.9    -3,-0.4    -2,-0.2   0.947 116.0  45.1 -63.1 -50.4  -29.3  -16.3   11.2                           
  143  143   E  H  X S+     0   0   49     -4,-2.3     4,-2.8     1,-0.2    -2,-0.2   0.890 110.7  53.1 -64.2 -42.0  -28.7  -15.7    7.5                           
  144  144   N  H  X S+     0   0   74     -4,-3.3     4,-2.1     1,-0.2    -1,-0.2   0.911 107.1  53.0 -62.6 -40.8  -31.4  -13.1    7.2                           
  145  145   A  H  X S+     0   0    6     -4,-2.0     4,-1.1    -5,-0.2    -1,-0.2   0.921 112.9  42.6 -62.0 -45.4  -30.0  -11.2   10.1                           
  146  146   I  H >X S+     0   0    0     -4,-1.9     4,-1.5     1,-0.2     3,-0.6   0.918 110.0  55.9 -68.3 -40.7  -26.5  -11.0    8.7                           
  147  147   R  H 3<>S+     0   0   57     -4,-2.8     5,-2.5     1,-0.3     3,-0.4   0.891 103.1  57.4 -59.3 -37.9  -27.8  -10.2    5.2                           
  148  148   N  H 3<5S+     0   0   80     -4,-2.1     3,-0.5     1,-0.3    -1,-0.3   0.864 114.0  36.8 -61.4 -39.8  -29.6   -7.2    6.6                           
  149  149   S  H <<5S+     0   0   48     -4,-1.1    -1,-0.3    -3,-0.6    -2,-0.2   0.604 115.3  60.7 -82.0 -18.9  -26.4   -5.8    8.0                           
  150  150   T  T ><5S-     0   0    2     -4,-1.5     3,-1.1    -3,-0.4    -1,-0.2   0.113 115.4-100.0 -93.1   3.3  -24.4   -7.0    4.9                           
  151  151   N  T 3 5S-     0   0  104     -3,-0.5    -3,-0.2    -4,-0.3     3,-0.1   0.911  79.7 -62.8  70.0  36.0  -26.0   -5.3    2.0                           
  152  152   N  T 3    -     0   0  150      2,-0.2     3,-0.7     3,-0.2     4,-0.2   0.495  62.2-101.3 -35.1 159.7  -11.1   -7.1   -4.4                           
  178  178   G  T 3  S+     0   0   46      1,-0.3     2,-1.3  -163,-0.1    -1,-0.1   0.896 125.2  54.9 -54.9 -39.9   -7.9   -6.8   -2.5                           
  179  179   I  T 3  S+     0   0  115   -106,-0.1    -1,-0.3  -108,-0.1    -2,-0.2  -0.490 119.1  26.4 -96.4  67.4   -7.8   -3.3   -3.6                           
  180  180   T    <   +     0   0   51     -2,-1.3    -3,-0.2    -3,-0.7    -2,-0.1  -0.501  44.3 174.9-171.4-101.4  -11.2   -2.4   -2.2                           
  181  181   G        +     0   0   44      2,-0.2    -4,-0.1    -4,-0.2    -3,-0.1   0.498  59.9 113.4  86.6  -0.5  -12.9   -4.2    0.6                           
  182  182   M        +     0   0  135     -5,-0.2     2,-0.3     1,-0.1    -2,-0.0   0.843  68.6  44.7 -69.9 -40.3  -15.4   -1.4   -0.0                           
  183  183   I  S    S-     0   0   60     -6,-0.1    -7,-2.8     0, 0.0     2,-0.2  -0.846  78.3-125.2-120.6 148.6  -18.2   -3.6   -1.2                           
  184  184   Y  E     +E  175   0C  38     -2,-0.3    -9,-0.3    -9,-0.3     2,-0.2  -0.591  32.3 163.9 -88.7 145.9  -19.7   -6.9    0.1                           
  185  185   I  E     -E  174   0C  48    -11,-1.2   -11,-0.7    -2,-0.2     2,-0.3  -0.818  28.6-124.4-144.1-179.1  -20.0  -10.1   -2.1                           
  186  186   V        +     0   0   41     -2,-0.2     2,-0.3   -13,-0.1     3,-0.1  -0.999  30.1 165.3-134.5 134.3  -20.6  -13.8   -1.4                           
  187  187   T        -     0   0   53     -2,-0.3    -2,-0.0   -33,-0.2  -170,-0.0  -0.978  48.4  -2.4-153.9 147.8  -18.4  -17.0   -2.6                           
  188  188   M        -     0   0  118     -2,-0.3     2,-0.1     1,-0.1    -1,-0.1   0.915  61.9-167.7  46.2  73.3  -17.9  -20.8   -2.0                           
  189  189   V        -     0   0   58      1,-0.1    -1,-0.1    -3,-0.1   -33,-0.1  -0.492  32.1 -88.9 -83.4 154.7  -20.2  -21.9    0.9                           
  190  190   F        -     0   0   59    -33,-0.3    24,-0.2    -2,-0.1    -1,-0.1  -0.294  42.0-119.4 -63.4 143.3  -19.8  -25.3    2.6                           
  191  191   S        -     0   0   70      1,-0.1     3,-0.1    -3,-0.1    -1,-0.1  -0.427  22.3-114.1 -79.4 160.8  -21.7  -28.2    1.1                           
  192  192   L  S    S-     0   0  112      1,-0.2     2,-0.3    -2,-0.1    -1,-0.1   0.963  98.9  -3.5 -61.6 -48.3  -24.3  -30.0    3.2                           
  193  193   I  S    S-     0   0  118     21,-0.1     2,-0.3     5,-0.1    -1,-0.2  -0.940  73.9-176.9-138.1 155.9  -22.2  -33.1    3.2                           
  194  194   V        -     0   0   66     -2,-0.3     4,-0.3     1,-0.1     5,-0.2  -0.976  41.7-101.8-151.9 166.8  -18.9  -33.8    1.4                           
  195  195   L  S    S+     0   0  169     -2,-0.3     2,-0.4     2,-0.1    -1,-0.1   0.929 114.5  51.4 -58.2 -46.9  -16.5  -36.7    1.0                           
  196  196   I  S    S-     0   0  127      1,-0.1     2,-0.5    -3,-0.1    -2,-0.1  -0.780 118.0 -91.9 -90.1 136.6  -14.1  -35.3    3.5                           
  197  197   L        +     0   0  149     -2,-0.4    -2,-0.1     1,-0.2    -1,-0.1  -0.241  51.6 169.5 -55.4 101.4  -16.1  -34.6    6.7                           
  198  198   S        +     0   0   28     -2,-0.5    -1,-0.2    -4,-0.3     3,-0.1   0.605  57.9  93.2 -80.1 -12.1  -17.0  -31.0    6.1                           
  199  199   S  S    S-     0   0   51     -5,-0.2     2,-0.3     1,-0.2   -40,-0.2   0.933  94.4 -50.6 -52.8 -75.6  -19.2  -31.5    9.1                           
  200  200   S        -     0   0   29    -40,-0.2    -1,-0.2     1,-0.2   -40,-0.1  -0.942  23.8-137.7-170.5 145.9  -17.2  -30.4   12.1                           
  201  201   T  S    S-     0   0  109     -2,-0.3     2,-0.3     1,-0.3    -1,-0.2   0.954  78.5 -59.0 -68.7 -50.9  -13.9  -30.7   13.9                           
  202  202   V        -     0   0   79    -40,-0.0    -1,-0.3     2,-0.0     2,-0.3  -0.943  50.3-158.9-175.5-175.4  -15.4  -30.9   17.3                           
  203  203   G        -     0   0   11     -2,-0.3     2,-0.4    -3,-0.1    20,-0.1  -0.967  21.6-104.8-169.8 178.2  -17.6  -29.1   19.8                           
  204  204   Y        -     0   0  157     -2,-0.3     2,-0.2    18,-0.2   -42,-0.1  -0.947  35.2-108.0-124.4 145.7  -18.5  -28.8   23.5                           
  205  205   D        +     0   0  130     -2,-0.4     2,-0.3     2,-0.0     3,-0.1  -0.439  49.5 150.8 -72.6 136.3  -21.6  -30.0   25.2                           
  206  206   Y        -     0   0  129     -2,-0.2     3,-0.1     1,-0.1   -72,-0.0  -0.924  58.6 -96.8-152.4 175.7  -24.0  -27.4   26.4                           
  207  207   F  S    S-     0   0  178      1,-0.3     2,-0.2    -2,-0.3    -1,-0.1   0.969  89.7 -60.1 -62.1 -53.1  -27.7  -27.0   27.0                           
  208  208   Q  S    S+     0   0   37     13,-0.1    -1,-0.3    15,-0.1     2,-0.1  -0.861  75.1 124.1 172.7 157.4  -28.3  -25.4   23.6                           
  209  209   F        +     0   0   41    -43,-0.3   -72,-0.2    -2,-0.2   -75,-0.1  -0.495  32.5  75.2-172.4-119.6  -27.1  -22.4   21.6                           
  210  210   T        -     0   0    0     13,-0.3    16,-0.5   -42,-0.2     2,-0.4   0.088  61.5-113.7 -49.4 130.1  -25.4  -21.5   18.3                           
  211  211   Q        -     0   0    0     14,-1.8   -42,-0.3   -44,-0.3   -53,-0.1  -0.418  33.7-156.6 -71.0 118.2  -26.7  -21.5   14.6                           
  212  212   Q        -     0   0    0     -2,-0.4   -43,-0.4     5,-0.3   -42,-0.2   0.957   7.8-153.9 -71.6 -66.5  -25.0  -24.1   12.5                           
  213  213   Y  S    S+     0   0   44      2,-0.9   -55,-0.1     4,-0.2   -46,-0.1  -0.275  84.1  70.8  76.1 166.1  -24.7  -24.0    8.8                           
  214  214   Q  S    S+     0   0   15    -24,-0.2    -1,-0.1   -57,-0.2   -21,-0.1  -0.871 101.3  50.8  64.5-135.3  -24.5  -27.0    7.7                           
  215  215   P        -     0   0   42      0, 0.0    -2,-0.9     0, 0.0    -3,-0.1   0.225  59.1-154.7 -55.5 144.4  -28.1  -27.6    8.6                           
  216  216   A        +     0   0   68     -4,-0.1   -77,-2.9   -77,-0.1   -76,-0.4   0.842  67.0 117.1 -67.2 -32.3  -31.1  -25.5    7.6                           
  217  217   V  S    S-     0   0   80    -79,-0.2    -5,-0.3     1,-0.2   -80,-0.2  -0.134  75.8-125.8 -58.4 135.6  -32.6  -26.9   10.7                           
  218  218   C  S    S+     0   0   63      1,-0.3     2,-1.7   -82,-0.1    -1,-0.2   0.488  94.4  90.4 -57.1 -17.2  -33.6  -24.8   13.5                           
  219  219   N        +     0   0   47    -83,-0.2     2,-1.1     2,-0.1   -53,-0.6  -0.164  45.9 139.7 -84.9  60.0  -31.7  -26.8   15.8                           
  220  220   S  E     +Bd 137 166B   0     -2,-1.7   -83,-2.0   -83,-1.6   -53,-0.2  -0.860  42.5 133.1 -92.7 101.2  -28.7  -24.6   15.1                           
  221  221   K  E     + d   0 167B  28    -55,-2.8   -53,-0.7    -2,-1.1   -11,-0.2  -0.125  20.2  43.8-141.3-140.9  -27.8  -24.7   18.8                           
  222  222   P  S    S+     0   0    0      0, 0.0   -18,-0.2     0, 0.0    -1,-0.2   0.170  77.9  56.9 -52.7 119.3  -25.1  -25.2   21.5                           
  223  223   T  S    S-     0   0    8    -15,-0.1     3,-0.3     1,-0.1   -13,-0.3  -0.861 103.7 -34.1 174.9-147.3  -21.7  -23.6   21.4                           
  224  224   P  S    S+     0   0   64      0, 0.0     2,-0.8     0, 0.0   -55,-0.2   0.978 122.6  38.1 -58.4 -61.6  -20.6  -20.0   21.1                           
  225  225   C              0   0    3    -57,-1.1   -14,-1.8     1,-0.1   -57,-0.2  -0.693 360.0 360.0-113.3  94.1  -23.2  -18.1   18.9                           
  226  226   K              0   0    8     -2,-0.8   -91,-1.1   -16,-0.5   -92,-1.0  -0.455 360.0 360.0 -77.5 360.0  -26.7  -19.3   19.5