Secondary structure calculation program - copyright by David Keith Smith, 1989
 1qovL.pdb                                                   
 1QOV  PHOTOSYNTHETIC REACTION CENTER  MOL_ID: 1;  MOL_ID: 1;  
 Sequence length -  281
             A       A K K                                                                        hydrogen bonding             Ooi's
 strk chain/ l amino u & S structure   bridge        dihedral angles                     donor    acceptor   donor    acceptor  N  N
 num  seq.no t acids t S + patterns   partners    phi    psi  omega  alpha kappa   tco to/energy fr/energy to/energy fr/energy  8 14
    1 L   1    ALA A                    0    0  999.9  -21.6  177.0  999.9 999.9 999.9    0  0.0    0  0.0    0  0.0    0  0.0  4 15
    2 L   2    LEU L               -    0    0 -114.5  147.8  166.2 -119.3 999.9 158.8    0  0.0    0  0.0    0  0.0    0  0.0  7 17
    3 L   3    LEU L     t     > T -    0    0  -66.0  153.6 -177.5 -103.9  41.8 111.9    0  0.0    6 -1.9    0  0.0    0  0.0  6 15
    4 L   4    SER S   T T     3 TS+    0    0  -56.5  -24.3 -178.8   37.6 121.1  38.4    0  0.0    0  0.0    0  0.0    0  0.0  5 10
    5 L   5    PHE F   T T     3 TS+    0    0 -107.9   10.8 -169.1   91.8  94.2  68.7    0  0.0    0  0.0    0  0.0    0  0.0  6 12
    6 L   6    GLU E     g >   X T +    0    0  -80.1  -32.6 -168.0   76.2  60.4  39.9    3 -1.9    9 -1.9    0  0.0   10 -0.8  8 20
    7 L   7    ARG R   G G 4   > TS+    0    0  -53.9  -42.4 -176.3   59.4  88.9  27.4    0  0.0   10 -1.4    0  0.0    0  0.0  8 19
    8 L   8    LYS K   G G 4   3 TS+    0    0  -60.9  -21.2  179.0   50.7 105.8  40.7    0  0.0    0  0.0    0  0.0    0  0.0  6 14
    9 L   9    TYR Y   G G 4   < TS+    0    0  -88.7  -14.3 -175.9   89.6  85.2  51.3    6 -1.9   11 -1.9    0  0.0    0  0.0  7 27
   10 L  10    ARG R     g <   < T +    0    0  -85.3   69.0  180.0  138.9  59.0 112.6    7 -1.4    0  0.0    6 -0.8    0  0.0  6 33
   11 L  11    VAL V               -    0    0 -104.3  161.3  173.5  -93.0  56.6 126.6    9 -1.9    0  0.0    0  0.0    0  0.0  6 28
   12 L  12    PRO P   S S        S+    0    0  -67.9  154.7  173.7   45.4  77.6 113.5    0  0.0    0  0.0    0  0.0    0  0.0  7 30
   13 L  13    GLY G               +    0    0  103.8  170.8  178.3   99.9  45.9 104.3    0  0.0    0  0.0    0  0.0    0  0.0  8 32
   14 L  14    GLY G               +    0    0   97.6   -4.7 -175.2  140.2  54.6  71.7    0  0.0    0  0.0    0  0.0    0  0.0  8 36
   15 L  15    THR T               -    0    0  -72.3  150.5  179.6 -157.6  42.1 108.7    0  0.0    0  0.0    0  0.0    0  0.0 12 37
   16 L  16    LEU L   S S        S+    0    0  -94.0  -33.6 -178.0   26.2  77.8  42.5    0  0.0    0  0.0    0  0.0    0  0.0  6 35
   17 L  17    VAL V   S S        S+    0    0 -135.4  137.4  173.9   17.4 116.3 178.1    0  0.0    0  0.0    0  0.0    0  0.0  5 31
   18 L  18    GLY G   S t     > TS-    0    0   90.8    6.0 -175.9 -127.2  79.8  60.5    0  0.0   21 -1.9    0  0.0    0  0.0  8 22
   19 L  19    GLY G   T T     3 TS-    0    0   55.3 -124.5 -177.4  -18.0  80.6 103.9    0  0.0    0  0.0    0  0.0    0  0.0  9 24
   20 L  20    ASN N   T T     > TS+    0    0  -91.4   -7.5 -174.0  101.2 110.0  57.9    0  0.0   23 -1.3    0  0.0    0  0.0  8 25
   21 L  21    LEU L   T T     < TS+    0    0  -51.1  -47.3  179.4   16.7  99.8  31.1   18 -1.9    0  0.0    0  0.0    0  0.0  6 24
   22 L  22    PHE F   T T     3 TS+    0    0 -113.5   18.4 -178.1  125.9  89.7  83.2    0  0.0   32 -2.2    0  0.0   24 -1.8  9 32
   23 L  23    ASP D     t     < T +    0    0  -79.0   79.4 -179.0   88.9  52.0 125.7   20 -1.3    0  0.0    0  0.0    0  0.0 13 38
   24 L  24    PHE F     e         -    0    0 -163.0  170.6  177.9 -118.7  64.9 167.7   22 -1.8   31 -2.7    0  0.0    0  0.0  7 36
   25 L  25    TRP W   E E  AA     -   30    0 -117.2  160.3  173.3 -149.9   4.0 147.4    0  0.0    0  0.0    0  0.0    0  0.0  8 34
   26 L  26    VAL V   E E  AA > TS-   29    0 -127.3  104.0 -172.7  -46.1  77.7 164.5   29 -2.4   29 -1.9    0  0.0    0  0.0  7 20
   27 L  27    GLY G   T T     3 TS-    0    0   65.0 -132.5  177.4  -21.7 126.6 118.3    0  0.0    0  0.0    0  0.0    0  0.0  5 16
   28 L  28    PRO P   T T     3 TS+    0    0  -75.6  -21.5 -170.5  102.5 118.7  49.2    0  0.0    0  0.0    0  0.0    0  0.0  7 20
   29 L  29    PHE F   E E  AA < T -   26    0  -80.7  132.8  173.1 -141.8  64.2 122.5   26 -1.9   26 -2.4    0  0.0    0  0.0  6 30
   30 L  30    TYR Y   E E  AA     -   25    0  -80.1  146.5  179.2 -170.5  18.1 129.8    0  0.0    0  0.0    0  0.0    0  0.0 10 45
   31 L  31    VAL V     h >     T +    0    0 -100.8  -83.1 -173.5  155.4  17.0  37.3   24 -2.7   35 -0.8    0  0.0    0  0.0 13 43
   32 L  32    GLY G   H H >   > T -    0    0   69.3  171.8  177.2  -68.0  69.4  87.0   22 -2.2   36 -1.6    0  0.0   35 -0.7 13 45
   33 L  33    PHE F   H H >   3 TS+    0    0  -59.6  -39.1  179.3   53.5 137.6  24.5    0  0.0   37 -2.5    0  0.0    0  0.0 11 41
   34 L  34    PHE F   H H >   3 TS+    0    0  -71.6  -23.9  177.1   57.3 102.3  40.2    0  0.0   38 -2.7    0  0.0    0  0.0 11 46
   35 L  35    GLY G   H H X   < TS+    0    0  -69.1  -41.1  178.0   46.1 109.7  30.3   31 -0.8   39 -1.9   32 -0.7    0  0.0 12 42
   36 L  36    VAL V   H H X     TS+    0    0  -64.9  -46.9  178.2   49.1 113.2  21.3   32 -1.6   40 -2.2    0  0.0    0  0.0  9 39
   37 L  37    ALA A   H H X     TS+    0    0  -61.6  -41.0  179.5   51.1 109.9  23.5   33 -2.5   41 -2.6    0  0.0    0  0.0 11 37
   38 L  38    THR T   H H X     TS+    0    0  -64.7  -40.1  179.4   50.1 109.8  24.5   34 -2.7   42 -2.6    0  0.0    0  0.0 13 37
   39 L  39    PHE F   H H X     TS+    0    0  -60.9  -43.7 -179.6   48.4 111.9  26.5   35 -1.9   43 -2.5    0  0.0    0  0.0  9 34
   40 L  40    PHE F   H H X     TS+    0    0  -60.5  -54.2 -179.6   45.0 113.7  19.2   36 -2.2   44 -2.3    0  0.0    0  0.0  8 31
   41 L  41    PHE F   H H X     TS+    0    0  -60.0  -42.5  179.3   47.8 115.9  23.7   37 -2.6   45 -2.5    0  0.0    0  0.0 12 33
   42 L  42    ALA A   H H X     TS+    0    0  -65.4  -50.2 -178.1   48.1 111.2  27.5   38 -2.6   46 -2.4    0  0.0    0  0.0 11 29
   43 L  43    ALA A   H H X     TS+    0    0  -59.6  -43.7  179.1   48.1 113.9  23.2   39 -2.5   47 -2.0    0  0.0    0  0.0  8 29
   44 L  44    LEU L   H H X     TS+    0    0  -63.2  -47.6  177.8   49.1 112.2  16.7   40 -2.3   48 -2.3    0  0.0    0  0.0  9 29
   45 L  45    GLY G   H H X     TS+    0    0  -58.3  -42.9 -179.1   49.2 111.1  26.2   41 -2.5   49 -1.7    0  0.0    0  0.0 12 36
   46 L  46    ILE I   H H X     TS+    0    0  -65.0  -39.5  178.3   52.6 109.5  27.4   42 -2.4   50 -2.1    0  0.0    0  0.0  8 35
   47 L  47    ILE I   H H X     TS+    0    0  -60.7  -44.9 -180.0   50.0 108.9  24.6   43 -2.0   51 -2.0    0  0.0    0  0.0  8 32
   48 L  48    LEU L   H H X     TS+    0    0  -66.9  -32.0  176.4   51.6 108.7  35.7   44 -2.3   52 -2.1    0  0.0    0  0.0 10 39
   49 L  49    ILE I   H H X     TS+    0    0  -68.6  -41.0 -179.6   51.4 108.9  25.5   45 -1.7   53 -2.0    0  0.0    0  0.0 11 45
   50 L  50    ALA A   H H X     TS+    0    0  -62.0  -39.3  177.9   49.3 110.3  26.8   46 -2.1   54 -1.5    0  0.0    0  0.0  8 33
   51 L  51    TRP W   H H X     TS+    0    0  -66.7  -41.7  176.7   51.8 109.0  28.8   47 -2.0   55 -2.0    0  0.0    0  0.0  8 34
   52 L  52    SER S   H H X     TS+    0    0  -63.3  -37.1  179.6   55.7 106.6  28.7   48 -2.1   56 -1.3    0  0.0    0  0.0 12 39
   53 L  53    ALA A   H H X    >TS+    0    0  -64.3  -39.0 -179.5   49.5 105.9  29.9   49 -2.0   58 -1.7    0  0.0   57 -1.1 13 34
   54 L  54    VAL V   H H <    5TS+    0    0  -69.6  -38.1  179.2   51.5 109.9  22.0   50 -1.5    0  0.0    0  0.0    0  0.0  9 24
   55 L  55    LEU L   H H <    5TS+    0    0  -62.5  -30.1 -177.4   45.6 112.8  41.9   51 -2.0    0  0.0    0  0.0    0  0.0  7 26
   56 L  56    GLN Q   H H <    5TS-    0    0  -84.7  -22.5 -179.1 -124.8 111.9  53.4   52 -1.3    0  0.0    0  0.0    0  0.0  7 31
   57 L  57    GLY G   T h <    5TS+    0    0   82.6   28.2  178.2   97.2  70.6  42.0   53 -1.1    0  0.0    0  0.0    0  0.0  6 18
   58 L  58    THR T     t         > T -    0    0  -74.2  116.9 -179.8 -149.0  57.8 123.9    0  0.0   63 -2.5    0  0.0   64 -2.5  6 22
   61 L  61    PRO P   T T 4   3 TS+    0    0  -53.2  -35.0  176.8   57.8  97.0  39.0    0  0.0  150 -0.5    0  0.0    0  0.0  6 24
   62 L  62    GLN Q   T T 4   3 TS+    0    0  -76.6   -6.4  178.6   35.7 115.9  54.4    0  0.0    0  0.0    0  0.0    0  0.0  7 22
   63 L  63    LEU L   T T 4   < TS+    0    0 -115.9  -28.6 -178.1  109.0  85.3  48.9   60 -2.5    0  0.0    0  0.0    0  0.0 10 26
   64 L  64    ILE I     t <     T +    0    0  -53.3  131.6  178.8  168.7  43.4 104.2   60 -2.5    0  0.0    0  0.0    0  0.0 12 35
   65 L  65    SER S               -    0    0 -153.1  125.7  179.5 -157.2  26.8 158.3    0  0.0   67 -0.6    0  0.0    0  0.0 11 46
   66 L  66    VAL V   B B   A     -  148    0 -103.7  112.6 -177.6 -157.9  21.8 154.9  148 -1.7  148 -2.6    0  0.0    0  0.0 13 57
   67 L  67    TYR Y               -    0    0  -96.3  144.6  174.2 -123.6  13.6 129.9   65 -0.6    0  0.0    0  0.0    0  0.0 10 53
   68 L  68    PRO P               -    0    0  -68.4  166.1  175.0  -72.1  52.4 111.7    0  0.0    0  0.0    0  0.0    0  0.0 15 52
   69 L  69    PRO P               -    0    0  -56.5  148.5  174.5  -99.5  56.2 102.5    0  0.0    0  0.0    0  0.0    0  0.0 13 40
   70 L  70    ALA A     g     > T -    0    0  -67.3  159.5 -177.3 -100.1  40.1 100.2    0  0.0   73 -2.0    0  0.0    0  0.0 10 34
   71 L  71    LEU L   G G     > TS+    0    0  -52.7  -28.3 -176.1   72.2 115.5  39.4    0  0.0   74 -2.1    0  0.0    0  0.0  9 31
   72 L  72    GLU E   G G     3 TS+    0    0  -68.5  -16.4  175.9   61.1  89.2  40.4    0  0.0    0  0.0    0  0.0    0  0.0  6 24
   73 L  73    TYR Y   G G     X TS-    0    0  -83.6   -5.2 -179.1 -170.3  85.9  54.3   70 -2.0   76 -2.4    0  0.0    0  0.0 11 29
   74 L  74    GLY G   T g     < T -    0    0   56.0 -134.6  178.3  -31.0  64.1 107.8   71 -2.1  142 -1.7    0  0.0    0  0.0 10 29
   75 L  75    LEU L   T T     3 TS+    0    0 -100.3   15.7 -179.3  107.6 113.4  84.9    0  0.0    0  0.0    0  0.0    0  0.0  8 32
   76 L  76    GLY G   S t     < TS-    0    0  -87.8 -179.8  175.9  -81.4  80.3 106.6   73 -2.4    0  0.0    0  0.0    0  0.0  5 30
   77 L  77    GLY G               -    0    0  -74.9  159.1 -179.8 -153.5  46.1 111.3    0  0.0    0  0.0    0  0.0    0  0.0  7 31
   78 L  78    ALA A               -    0    0 -134.7  158.4  177.4  -86.2  26.7 159.1    0  0.0    0  0.0    0  0.0    0  0.0  9 27
   79 L  79    PRO P     g     >>T -    0    0  -58.4  147.4 -178.9 -112.2  46.2 114.6    0  0.0   84 -2.1    0  0.0   82 -1.9  8 29
   80 L  80    LEU L   G G     >>TS+    0    0  -50.5  -49.7 -176.2   46.5 115.1  37.8    0  0.0   85 -1.9    0  0.0   83 -0.9  8 34
   81 L  81    ALA A   G G     35TS+    0    0  -74.9  -11.9 -178.5   48.5 115.3  49.7    0  0.0    0  0.0    0  0.0    0  0.0  8 32
   82 L  82    LYS K   G G     <5TS-    0    0 -121.8   42.1  178.6  -45.9 141.6 102.6   79 -1.9    0  0.0    0  0.0    0  0.0 11 38
   83 L  83    GLY G   T h >   <5TS+    0    0  124.2  -24.3 -178.7   99.6 110.9  82.8   80 -0.9   87 -1.7    0  0.0    0  0.0 14 44
   84 L  84    GLY G   H H >             TS+    0    0  -62.2  -41.5 -179.1   51.7 108.0  29.4    0  0.0   90 -2.2    0  0.0    0  0.0 14 56
   87 L  87    GLN Q   H H X     TS+    0    0  -65.0  -41.9 -178.9   42.7 113.5  27.2   83 -1.7   91 -1.3    0  0.0    0  0.0 10 53
   88 L  88    ILE I   H H X     TS+    0    0  -71.4  -41.0  179.6   52.7 112.7  30.0   84 -2.0   92 -2.0    0  0.0    0  0.0  9 44
   89 L  89    ILE I   H H X     TS+    0    0  -60.9  -41.9  176.5   54.2 106.8  27.3   85 -2.7   93 -2.6    0  0.0    0  0.0 11 51
   90 L  90    THR T   H H X     TS+    0    0  -58.9  -41.2  176.9   49.6 107.4  33.9   86 -2.2   94 -2.2    0  0.0    0  0.0  9 57
   91 L  91    ILE I   H H X     TS+    0    0  -64.9  -44.4  178.3   47.7 113.0  25.6   87 -1.3   95 -2.3    0  0.0    0  0.0  8 43
   92 L  92    CYS C   H H X     TS+    0    0  -61.6  -45.5  178.6   50.0 111.2  30.1   88 -2.0   96 -2.5    0  0.0    0  0.0 12 38
   93 L  93    ALA A   H H X     TS+    0    0  -60.2  -47.0  178.0   48.1 111.9  21.9   89 -2.6   97 -2.4    0  0.0    0  0.0 11 46
   94 L  94    THR T   H H X     TS+    0    0  -59.6  -43.5  178.4   49.6 112.6  23.1   90 -2.2   98 -2.5    0  0.0    0  0.0 10 42
   95 L  95    GLY G   H H X     TS+    0    0  -63.8  -42.6  178.8   48.1 111.7  27.8   91 -2.3   99 -2.0    0  0.0    0  0.0 11 38
   96 L  96    ALA A   H H X     TS+    0    0  -66.3  -44.0 -177.9   46.8 113.3  28.0   92 -2.5  100 -1.9    0  0.0    0  0.0 13 41
   97 L  97    PHE F   H H X     TS+    0    0  -67.0  -46.2  179.7   45.3 114.7  23.8   93 -2.4  101 -2.0    0  0.0    0  0.0 10 43
   98 L  98    VAL V   H H X     TS+    0    0  -64.7  -42.1  178.1   51.3 113.2  28.7   94 -2.5  102 -2.1    0  0.0    0  0.0  9 41
   99 L  99    SER S   H H X     TS+    0    0  -62.5  -40.4  177.4   53.8 107.1  29.4   95 -2.0  103 -1.9    0  0.0    0  0.0 12 42
  100 L 100    TRP W   H H X     TS+    0    0  -60.0  -44.4  176.9   49.3 109.1  20.9   96 -1.9  104 -1.9    0  0.0    0  0.0 11 45
  101 L 101    ALA A   H H X     TS+    0    0  -60.4  -49.1 -178.4   47.6 111.3  27.8   97 -2.0  105 -1.5    0  0.0    0  0.0 11 44
  102 L 102    LEU L   H H X     TS+    0    0  -67.5  -29.8  176.6   55.1 108.2  38.3   98 -2.1  106 -1.6    0  0.0    0  0.0 10 45
  103 L 103    ARG R   H H X     TS+    0    0  -68.4  -40.7  175.0   53.5 105.6  30.5   99 -1.9  107 -2.1    0  0.0    0  0.0 13 49
  104 L 104    GLU E   H H X     TS+    0    0  -57.8  -40.8  177.4   53.9 105.6  28.3  100 -1.9  108 -2.4    0  0.0    0  0.0 10 44
  105 L 105    VAL V   H H X     TS+    0    0  -60.5  -43.0 -179.4   51.0 106.8  28.8  101 -1.5  109 -2.1    0  0.0    0  0.0 10 38
  106 L 106    GLU E   H H X     TS+    0    0  -63.2  -40.8  177.9   48.5 110.8  25.2  102 -1.6  110 -2.0    0  0.0    0  0.0 12 48
  107 L 107    ILE I   H H X     TS+    0    0  -63.9  -44.7  176.5   53.3 108.8  26.1  103 -2.1  111 -2.1    0  0.0    0  0.0 10 44
  108 L 108    CYS C   H H X    >TS+    0    0  -54.6  -45.0  179.4   48.6 110.2  26.2  104 -2.4  113 -2.0    0  0.0  112 -0.6 11 35
  109 L 109    ARG R   H H <   >5TS+    0    0  -65.8  -43.4  179.5   50.0 109.5  27.7  105 -2.1  112 -0.7    0  0.0    0  0.0 10 33
  110 L 110    LYS K   H H <   35TS+    0    0  -60.6  -42.3 -176.6   44.2 116.1  29.7  106 -2.0    0  0.0    0  0.0    0  0.0 12 36
  111 L 111    LEU L   H H <   35TS-    0    0  -79.8  -10.4 -175.7 -125.9 106.6  63.0  107 -2.1    0  0.0    0  0.0    0  0.0  7 31
  112 L 112    GLY G   T h <   <5T +    0    0   65.5   33.8 -178.0  134.6  63.6  39.3  109 -0.7    0  0.0  108 -0.6    0  0.0  6 21
  113 L 113    ILE I     t           TS+    0    0  -94.1   16.3 -175.7  118.0  74.2  82.9    0  0.0  119 -1.9    0  0.0    0  0.0  8 26
  116 L 116    HIS H   H H >     T +    0    0  -57.2  -37.9 -177.3   57.0  69.0  36.4    0  0.0  120 -2.1    0  0.0    0  0.0  6 30
  117 L 117    ILE I   H H >     TS+    0    0  -60.9  -56.4  179.9   39.9 110.0  14.2    0  0.0  121 -2.4    0  0.0    0  0.0  8 34
  118 L 118    PRO P   H H >     TS+    0    0  -61.6  -38.8  175.7   55.7 115.0  28.7    0  0.0  122 -1.9    0  0.0    0  0.0 11 32
  119 L 119    PHE F   H H <     TS+    0    0  -58.8  -45.0  178.4   45.7 109.4  22.3  115 -1.9    0  0.0    0  0.0    0  0.0  8 35
  120 L 120    ALA A   H H X   > TS+    0    0  -64.9  -43.3  179.9   54.6 109.3  26.5  116 -2.1  123 -1.4    0  0.0  124 -0.7 10 36
  121 L 121    PHE F   H H X   > TS+    0    0  -62.0  -33.7  179.2   69.1  95.2  32.1  117 -2.4  125 -1.8    0  0.0  124 -1.0  9 37
  122 L 122    ALA A   H H X   3 TS+    0    0  -55.4  -28.7  178.5   60.4  91.8  41.8  118 -1.9  126 -2.1    0  0.0    0  0.0  9 37
  123 L 123    PHE F   H H >   < TS+    0    0  -67.3  -38.4  178.3   49.2 103.7  31.3  120 -1.4  127 -1.5    0  0.0    0  0.0 11 36
  124 L 124    ALA A   H H X   < TS+    0    0  -67.5  -43.7  177.7   50.5 110.5  24.0  121 -1.0  128 -2.0  120 -0.7    0  0.0  9 42
  125 L 125    ILE I   H H X     TS+    0    0  -58.8  -40.3  178.0   53.1 108.4  25.8  121 -1.8  129 -2.8    0  0.0    0  0.0 11 41
  126 L 126    LEU L   H H X     TS+    0    0  -63.6  -39.9  177.7   51.2 107.3  34.4  122 -2.1  130 -1.6    0  0.0    0  0.0  9 40
  127 L 127    ALA A   H H X     TS+    0    0  -64.2  -47.2  177.6   47.1 111.5  27.4  123 -1.5  131 -1.4    0  0.0    0  0.0 12 41
  128 L 128    TYR Y   H H X     TS+    0    0  -58.0  -49.2  179.5   49.1 112.9  20.2  124 -2.0  132 -2.0    0  0.0    0  0.0  8 47
  129 L 129    LEU L   H H X    >TS+    0    0  -61.7  -33.6  175.4   59.8 104.7  38.3  125 -2.8  134 -2.5    0  0.0  133 -2.0 10 42
  130 L 130    THR T   H H <    >TS+    0    0  -59.0  -44.4 -178.1   41.1 110.9  24.8  126 -1.6  135 -2.6    0  0.0    0  0.0 12 41
  131 L 131    LEU L   H H <    5TS+    0    0  -74.4  -38.3 -175.6   29.4 126.8  35.7  127 -1.4    0  0.0    0  0.0    0  0.0 14 52
  132 L 132    VAL V   H H <    5TS+    0    0 -101.8  -10.4 -175.2   12.9 136.1  57.1  128 -2.0    0  0.0    0  0.0    0  0.0 13 57
  133 L 133    LEU L   T h X    5TS+    0    0 -133.1  -56.6 -173.2   41.9 120.7  46.8  129 -2.0  137 -2.0    0  0.0    0  0.0 10 47
  134 L 134    PHE F   H H >            >TS+    0    0  -54.6  -46.8  176.4   49.3 112.6  26.7    0  0.0  141 -1.8    0  0.0  140 -1.1 14 48
  137 L 137    VAL V   H H <   >5TS+    0    0  -61.0  -43.9 -178.1   47.5 112.8  18.6  133 -2.0  140 -0.7    0  0.0    0  0.0 10 37
  138 L 138    MET M   H H <   35TS+    0    0  -67.5  -33.3  179.7   45.7 114.5  34.4  134 -2.3    0  0.0    0  0.0    0  0.0  8 31
  139 L 139    MET M   H H <   35TS-    0    0  -82.2  -15.0  178.9 -114.9 117.0  60.1  135 -2.2    0  0.0    0  0.0    0  0.0  9 34
  140 L 140    GLY G   T h <   <5TS+    0    0   92.2   12.5  178.9   72.2  79.9  58.0  136 -1.1    0  0.0  137 -0.7    0  0.0  8 32
  141 L 141    ALA A     g     > TS+    0    0  -61.2  -29.8 -178.5   79.1  96.8  36.7   74 -1.7  145 -2.7    0  0.0    0  0.0 16 47
  143 L 143    GLY G   G G     3 TS+    0    0  -58.9  -13.3  176.6   68.1  77.5  54.2    0  0.0    0  0.0    0  0.0    0  0.0 11 46
  144 L 144    TYR Y   G G     < TS+    0    0  -84.3   -2.4  178.5   97.8  84.0  51.4  141 -1.6    0  0.0    0  0.0    0  0.0 10 54
  145 L 145    ALA A   S g     < TS-    0    0  -77.6  166.2 -180.0  -97.5  84.1 100.3  142 -2.7    0  0.0    0  0.0    0  0.0 11 60
  146 L 146    PHE F               -    0    0  -89.3  149.9  176.7 -117.2  34.2 126.6    0  0.0    0  0.0    0  0.0    0  0.0 12 49
  147 L 147    PRO P               -    0    0  -77.9  150.7  175.4 -114.6  23.7 122.8    0  0.0  149 -1.3    0  0.0    0  0.0 12 51
  148 L 148    TYR Y   B B   A    S+   66    0  -93.8   94.4  176.9  103.7  70.9 128.0   66 -2.6   66 -1.7    0  0.0    0  0.0 10 52
  149 L 149    GLY G   S h >     TS-    0    0 -165.6  149.4 -177.8 -116.2  72.7 165.9  147 -1.3  153 -2.0    0  0.0    0  0.0 11 36
  150 L 150    ILE I   H H >     TS+    0    0  -54.3  -58.5 -178.1   16.5 113.3  19.6   61 -0.5  154 -0.5    0  0.0    0  0.0 11 24
  151 L 151    TRP W   H H >     TS+    0    0  -89.8  -33.5 -177.8   62.8 120.5  35.4    0  0.0  155 -1.9    0  0.0    0  0.0  8 21
  152 L 152    THR T   H H >     TS+    0    0  -65.2  -31.2  179.7   57.1  98.0  31.8    0  0.0  156 -2.1    0  0.0    0  0.0 10 28
  153 L 153    HIS H   H H X     TS+    0    0  -68.6  -28.5  173.9   49.3 107.7  28.2  149 -2.0  157 -1.5    0  0.0    0  0.0 11 30
  154 L 154    LEU L   H H X     TS+    0    0  -70.0  -34.3  174.9   55.5 106.3  33.1  150 -0.5  158 -2.5    0  0.0    0  0.0  8 25
  155 L 155    ASP D   H H X     TS+    0    0  -61.2  -40.2  178.5   50.4 108.0  24.2  151 -1.9  159 -2.9    0  0.0    0  0.0  8 26
  156 L 156    TRP W   H H X     TS+    0    0  -64.2  -40.1 -179.0   51.0 108.3  29.8  152 -2.1  160 -2.7    0  0.0    0  0.0 10 32
  157 L 157    VAL V   H H X     TS+    0    0  -61.7  -48.6 -179.9   44.2 114.5  19.1  153 -1.5  161 -2.2    0  0.0    0  0.0  9 36
  158 L 158    SER S   H H X     TS+    0    0  -62.1  -46.0  179.0   44.6 116.5  11.9  154 -2.5  162 -2.7    0  0.0    0  0.0  8 23
  159 L 159    ASN N   H H X     TS+    0    0  -67.6  -41.0 -179.3   49.2 114.4  26.7  155 -2.9  163 -1.4    0  0.0    0  0.0  8 26
  160 L 160    THR T   H H X     TS+    0    0  -66.5  -39.4  176.6   47.4 113.0  16.7  156 -2.7  164 -0.5    0  0.0    0  0.0  8 41
  161 L 161    GLY G   H H <   > TS+    0    0  -64.3  -51.6 -177.2   50.2 110.2  19.8  157 -2.2  164 -2.0    0  0.0    0  0.0 10 38
  162 L 162    TYR Y   H H <   > TS+    0    0  -71.6   -6.1  167.1   76.6  92.6  44.7  158 -2.7  165 -1.8    0  0.0    0  0.0  9 26
  163 L 163    THR T   H H <   3 TS+    0    0  -62.8  -26.4 -177.9   39.8 103.7  39.8  159 -1.4    0  0.0    0  0.0    0  0.0  7 28
  164 L 164    TYR Y   T h <   < TS-    0    0 -112.5   22.4 -179.7 -113.4 118.3  85.2  161 -2.0  259 -1.7  160 -0.5    0  0.0 11 35
  165 L 165    GLY G   S g     < TS+    0    0   85.0 -137.2  174.2    1.6  87.4 129.1  162 -1.8  167 -0.8    0  0.0    0  0.0  9 26
  166 L 166    ASN N     g     > T -    0    0  -85.5  110.8 -178.9 -154.9  68.9 132.5    0  0.0  169 -2.0    0  0.0    0  0.0 10 27
  167 L 167    PHE F   G G     > TS+    0    0  -62.9  -13.7  175.5   85.1  82.8  46.6  165 -0.8  170 -2.1    0  0.0    0  0.0 10 38
  168 L 168    HIS H   G G     3 TS+    0    0  -56.1  -27.9 -178.1   67.3  80.1  38.6    0  0.0    0  0.0    0  0.0    0  0.0  7 33
  169 L 169    TYR Y   G G     < T +    0    0  -73.8  -11.1  173.6  107.8  68.1  53.4  166 -2.0    0  0.0    0  0.0    0  0.0  9 35
  170 L 170    ASN N     h >   < T -    0    0  -65.9  117.0 -176.1 -148.6  65.3 124.5  167 -2.1  174 -1.6    0  0.0    0  0.0 10 41
  171 L 171    PRO P   H H >     TS+    0    0  -59.4  -37.5  179.1   52.2  95.0  33.4    0  0.0  175 -1.4    0  0.0    0  0.0  8 40
  172 L 172    ALA A   H H >     TS+    0    0  -70.2  -28.1  179.7   55.4 107.3  38.3    0  0.0  176 -2.4    0  0.0    0  0.0 10 37
  173 L 173    HIS H   H H >     TS+    0    0  -73.3  -33.2  175.4   53.9 103.2  31.3    0  0.0  177 -2.7    0  0.0    0  0.0 13 41
  174 L 174    MET M   H H X     TS+    0    0  -65.5  -42.6  178.6   46.2 111.2  25.5  170 -1.6  178 -1.8    0  0.0    0  0.0 10 33
  175 L 175    ILE I   H H X     TS+    0    0  -65.5  -46.8  177.3   51.4 111.4  23.0  171 -1.4  179 -2.0    0  0.0    0  0.0 10 31
  176 L 176    ALA A   H H X     TS+    0    0  -55.7  -48.0  179.5   48.5 111.0  21.6  172 -2.4  180 -2.2    0  0.0    0  0.0 15 36
  177 L 177    ILE I   H H X     TS+    0    0  -57.5  -50.3 -177.0   55.0 107.3  30.4  173 -2.7  181 -2.5    0  0.0    0  0.0  9 31
  178 L 178    SER S   H H X     TS+    0    0  -55.0  -40.8  176.0   48.1 109.2  27.3  174 -1.8  182 -2.3    0  0.0    0  0.0  9 30
  179 L 179    PHE F   H H X     TS+    0    0  -66.1  -42.9  177.3   51.7 110.2  26.5  175 -2.0  183 -2.9    0  0.0    0  0.0 12 32
  180 L 180    PHE F   H H X     TS+    0    0  -58.2  -49.4 -176.8   42.4 114.4  25.2  176 -2.2  184 -1.8    0  0.0    0  0.0 11 32
  181 L 181    PHE F   H H X     TS+    0    0  -65.4  -42.9 -179.3   49.8 115.0  23.1  177 -2.5  185 -1.9    0  0.0    0  0.0  8 28
  182 L 182    THR T   H H X     TS+    0    0  -64.6  -38.1  177.1   54.4 108.5  21.4  178 -2.3  186 -2.6    0  0.0    0  0.0  9 30
  183 L 183    ASN N   H H X     TS+    0    0  -60.1  -46.7 -177.7   47.7 108.4  26.1  179 -2.9  187 -2.4    0  0.0    0  0.0 11 33
  184 L 184    ALA A   H H X     TS+    0    0  -64.4  -41.5  178.1   51.4 111.2  33.6  180 -1.8  188 -2.0    0  0.0    0  0.0  8 28
  185 L 185    LEU L   H H X     TS+    0    0  -57.8  -50.3 -178.6   45.6 112.7  18.1  181 -1.9  189 -2.1    0  0.0    0  0.0  8 25
  186 L 186    ALA A   H H X     TS+    0    0  -65.4  -33.6  176.4   53.6 110.6  31.4  182 -2.6  190 -2.7    0  0.0    0  0.0  9 37
  187 L 187    LEU L   H H X     TS+    0    0  -67.1  -46.6  177.8   48.0 109.3  25.1  183 -2.4  191 -2.5    0  0.0    0  0.0  9 31
  188 L 188    ALA A   H H X     TS+    0    0  -59.9  -44.8  179.6   47.7 113.5  26.5  184 -2.0  192 -2.2    0  0.0    0  0.0  8 23
  189 L 189    LEU L   H H X     TS+    0    0  -63.6  -39.4 -179.8   48.5 113.2  25.1  185 -2.1  193 -2.5    0  0.0    0  0.0  8 34
  190 L 190    HIS H   H H X     TS+    0    0  -65.9  -52.3  177.7   44.8 113.6  16.9  186 -2.7  194 -2.3    0  0.0    0  0.0  9 36
  191 L 191    GLY G   H H X     TS+    0    0  -55.8  -48.5 -178.3   46.6 117.1  21.2  187 -2.5  195 -2.3    0  0.0    0  0.0  8 26
  192 L 192    ALA A   H H X     TS+    0    0  -64.1  -40.9 -177.2   52.4 110.2  28.3  188 -2.2  196 -2.0    0  0.0    0  0.0  8 27
  193 L 193    LEU L   H H X     TS+    0    0  -64.1  -53.0  175.3   43.5 112.4  15.3  189 -2.5  197 -1.1    0  0.0    0  0.0  9 41
  194 L 194    VAL V   H H X   > TS+    0    0  -55.5  -49.3 -179.9   47.5 116.4  25.6  190 -2.3  198 -2.3    0  0.0  197 -0.7  9 34
  195 L 195    LEU L   H H X   3 TS+    0    0  -60.8  -40.4 -175.6   55.0 108.0  37.1  191 -2.3  199 -1.9    0  0.0    0  0.0  8 26
  196 L 196    SER S   H H <   3 TS+    0    0  -67.1  -24.9  178.9   44.0 112.8  47.8  192 -2.0    0  0.0    0  0.0    0  0.0  8 29
  197 L 197    ALA A   H H <   < TS+    0    0  -85.6  -37.7  178.2   44.1 116.8  36.3  193 -1.1  207 -2.8  194 -0.7    0  0.0 13 29
  198 L 198    ALA A   H H <     TS+    0    0  -77.7  -26.0 -178.2   37.7 123.2  43.5  194 -2.3    0  0.0    0  0.0    0  0.0  8 23
  199 L 199    ASN N   S h <     TS+    0    0 -130.4   79.5 -177.7  169.7  84.0 137.4  195 -1.9    0  0.0    0  0.0    0  0.0  8 20
  200 L 200    PRO P               -    0    0  -80.0 -176.8  173.6  -45.3  50.0  91.3    0  0.0    0  0.0    0  0.0    0  0.0 11 22
  201 L 201    GLU E   S t     > TS-    0    0  -49.8  139.1 -178.3  -77.6  86.5 104.8    0  0.0  204 -2.5    0  0.0    0  0.0  5 17
  202 L 202    LYS K   T T     3 TS+    0    0  -44.7  130.3 -179.8   13.3 117.4  95.0    0  0.0    0  0.0    0  0.0    0  0.0  5 12
  203 L 203    GLY G   T T     3 TS+    0    0   83.9  -11.1  179.0  119.3  99.6  73.2    0  0.0    0  0.0    0  0.0    0  0.0  5 11
  204 L 204    LYS K     t     < T -    0    0  -85.2  162.6  175.7 -102.1  68.7 115.5  201 -2.5    0  0.0    0  0.0    0  0.0  6 14
  205 L 205    GLU E               -    0    0  -73.6  153.5  174.0  -84.3  48.8 122.3    0  0.0    0  0.0    0  0.0    0  0.0  5 16
  206 L 206    MET M               -    0    0  -55.9  139.0  175.2 -123.3  49.6 102.7    0  0.0    0  0.0    0  0.0    0  0.0  8 19
  207 L 207    ARG R               -    0    0  -78.2  173.6 -179.0 -128.9  21.3  99.8  197 -2.8    0  0.0    0  0.0    0  0.0 10 25
  208 L 208    THR T     h >   > T -    0    0 -118.3  168.7  173.7  -99.1  29.3 139.0    0  0.0  212 -1.0    0  0.0  211 -0.8  7 23
  209 L 209    PRO P   H H >   3 TS+    0    0  -57.7  -28.5  178.2   66.4 121.3  36.9    0  0.0  213 -2.5    0  0.0    0  0.0  8 30
  210 L 210    ASP D   H H >   3 TS+    0    0  -64.3  -37.1  175.4   49.5 100.3  27.5    0  0.0  214 -2.5    0  0.0    0  0.0  7 25
  211 L 211    HIS H   H H >   < TS+    0    0  -67.1  -34.9 -179.9   53.5 108.2  34.4  208 -0.8  215 -2.4    0  0.0    0  0.0  9 32
  212 L 212    GLU E   H H X     TS+    0    0  -66.0  -46.5  178.3   44.8 111.5  22.9  208 -1.0  216 -1.9    0  0.0    0  0.0 12 35
  213 L 213    ASP D   H H X     TS+    0    0  -64.2  -35.2 -179.8   50.3 114.6  15.4  209 -2.5  217 -2.4    0  0.0    0  0.0 12 30
  214 L 214    THR T   H H X     TS+    0    0  -69.9  -41.5  178.3   54.7 106.1  29.6  210 -2.5  218 -3.0    0  0.0    0  0.0  9 23
  215 L 215    PHE F   H H X     TS+    0    0  -55.7  -49.7 -179.9   42.8 112.6  20.4  211 -2.4  219 -2.5    0  0.0    0  0.0  8 29
  216 L 216    PHE F   H H X     TS+    0    0  -69.3  -36.5  176.8   50.7 113.1  34.5  212 -1.9  220 -2.9    0  0.0  222 -1.0 11 31
  217 L 217    ARG R   H H X     TS+    0    0  -67.8  -41.2  175.2   47.6 113.0  16.2  213 -2.4  221 -1.8    0  0.0    0  0.0 10 19
  218 L 218    ASP D   H H <     TS+    0    0  -58.7  -46.2 -178.0   42.0 118.4  22.8  214 -3.0    0  0.0    0  0.0    0  0.0  8 16
  219 L 219    LEU L   H H <     TS-    0    0  -69.2  -53.2 -173.8   -2.0 139.7  22.4  215 -2.5    0  0.0    0  0.0    0  0.0  7 16
  220 L 220    VAL V   H H <     TS-    0    0 -125.6   -0.6  178.1 -106.9  94.5  67.6  216 -2.9    0  0.0    0  0.0    0  0.0  6 16
  221 L 221    GLY G   S h <     TS+    0    0   88.3    6.6 -177.5   69.2  91.5  54.6  217 -1.8    0  0.0    0  0.0    0  0.0  7 14
  222 L 222    TYR Y               -    0    0 -160.0  142.6  175.5 -165.6  52.4 163.5  216 -1.0    0  0.0    0  0.0    0  0.0  9 21
  223 L 223    SER S               -    0    0 -126.6  125.3  179.5 -157.7  10.7 177.0    0  0.0    0  0.0    0  0.0    0  0.0  8 28
  224 L 224    ILE I               -    0    0  -75.8  -23.9  178.0 -129.0  46.1  41.2    0  0.0    0  0.0    0  0.0    0  0.0  8 33
  225 L 225    GLY G     h >     T -    0    0   99.8  168.2 -172.7  -70.5  22.9  90.5    0  0.0  229 -2.2    0  0.0    0  0.0  7 32
  226 L 226    THR T   H H >     TS+    0    0  -73.1  -34.3  174.0   39.6 131.5  34.3    0  0.0  230 -0.6    0  0.0    0  0.0  7 33
  227 L 227    LEU L   H H >   > TS+    0    0  -75.8  -50.4 -179.2   53.4 114.8  21.2    0  0.0  231 -1.8    0  0.0  230 -0.8  7 20
  228 L 228    GLY G   H H >   3 TS+    0    0  -53.7  -41.1 -178.9   58.9 100.9  37.5    0  0.0  232 -2.5    0  0.0    0  0.0  8 25
  229 L 229    ILE I   H H X   3 TS+    0    0  -63.0  -31.6 -179.3   47.1 107.6  32.6  225 -2.2  233 -2.3    0  0.0    0  0.0 10 32
  230 L 230    HIS H   H H X   < TS+    0    0  -77.9  -40.4  173.6   48.3 112.9  29.2  227 -0.8  234 -2.0  226 -0.6    0  0.0  8 31
  231 L 231    ARG R   H H X     TS+    0    0  -61.2  -43.0 -179.8   50.3 113.1  23.2  227 -1.8  235 -2.3    0  0.0    0  0.0  8 26
  232 L 232    LEU L   H H X     TS+    0    0  -64.2  -46.9 -180.0   49.5 108.3  24.4  228 -2.5  236 -3.0    0  0.0    0  0.0  8 32
  233 L 233    GLY G   H H X     TS+    0    0  -62.4  -40.5  176.5   49.9 112.1  26.1  229 -2.3  237 -2.1    0  0.0    0  0.0 11 36
  234 L 234    LEU L   H H X     TS+    0    0  -60.3  -50.2 -179.4   43.5 114.8  19.4  230 -2.0  238 -2.1    0  0.0    0  0.0  9 38
  235 L 235    LEU L   H H X     TS+    0    0  -64.2  -45.6  178.3   50.5 112.9  29.8  231 -2.3  239 -2.1    0  0.0    0  0.0  8 38
  236 L 236    LEU L   H H X     TS+    0    0  -58.4  -46.6 -178.6   45.6 113.6  24.3  232 -3.0  240 -2.0    0  0.0    0  0.0 12 37
  237 L 237  A SER S   H H X     TS+    0    0  -65.8  -45.7 -179.2   44.4 115.9  29.3  233 -2.1  241 -1.5    0  0.0    0  0.0 11 43
  238 L 238    LEU L   H H X     TS+    0    0  -67.2  -37.6 -179.4   51.9 112.7  35.8  234 -2.1  242 -2.1    0  0.0    0  0.0 10 41
  239 L 239    SER S   H H X     TS+    0    0  -66.2  -40.3  178.8   56.9 105.1  29.8  235 -2.1  243 -2.6    0  0.0    0  0.0 10 39
  240 L 240    ALA A   H H X     TS+    0    0  -56.3  -46.6  178.7   39.1 113.6  20.4  236 -2.0  244 -1.3    0  0.0    0  0.0 14 42
  241 L 241    VAL V   H H X     TS+    0    0  -73.3  -37.3  176.2   56.1 112.3  34.4  237 -1.5  245 -2.5    0  0.0    0  0.0 12 42
  242 L 242    PHE F   H H X     TS+    0    0  -59.1  -51.2  178.3   43.5 111.6  19.8  238 -2.1  246 -1.9    0  0.0    0  0.0 11 41
  243 L 243    PHE F   H H X     TS+    0    0  -65.4  -28.8  175.1   57.6 110.4  41.1  239 -2.6  247 -2.1    0  0.0    0  0.0 12 39
  244 L 244    SER S   H H X     TS+    0    0  -63.3  -53.5  179.4   44.6 108.8  16.5  240 -1.3  248 -1.2    0  0.0    0  0.0 12 46
  245 L 245    ALA A   H H X     TS+    0    0  -56.8  -44.1 -179.6   50.6 114.2  30.6  241 -2.5  249 -2.3    0  0.0    0  0.0 12 44
  246 L 246    LEU L   H H X     TS+    0    0  -62.5  -42.0 -176.5   55.7 105.0  27.6  242 -1.9  250 -1.2    0  0.0    0  0.0  9 42
  247 L 247    CYS C   H H <     TS+    0    0  -65.1  -28.2 -179.5   40.8 114.5  39.9  243 -2.1    0  0.0    0  0.0    0  0.0 13 47
  248 L 248    MET M   H H <   > TS+    0    0  -87.8  -36.7 -179.5   58.9 107.7  32.4  244 -1.2  251 -1.2    0  0.0    0  0.0 10 57
  249 L 249    ILE I   H H <   3 TS+    0    0  -64.7  -31.9 -178.0   46.1 108.8  46.6  245 -2.3    0  0.0    0  0.0    0  0.0 12 44
  250 L 250    ILE I   T h <   3>TS+    0    0  -87.6   -9.7 -176.7   94.8  93.5  62.3  246 -1.2  255 -1.8    0  0.0  252 -0.7  9 43
  251 L 251    THR T   B B   b <5TS+  255    0  -93.1  108.3 -179.2    4.5 100.1 141.7  248 -1.2    0  0.0    0  0.0    0  0.0  9 49
  252 L 252    GLY G   T T      5TS+    0    0   99.5    0.5 -178.8   63.1 129.6  65.8  255 -3.4    0  0.0  250 -0.7    0  0.0  8 42
  253 L 253    THR T   T T      5TS+    0    0 -119.4  -69.7  177.7    2.9 121.4  46.9  255 -0.5    0  0.0    0  0.0    0  0.0 10 31
  254 L 254    ILE I   T T      5TS+    0    0  -92.6  -24.4  178.9   37.5 139.6  44.4    0  0.0    0  0.0    0  0.0    0  0.0  6 26
  255 L 255    TRP W   B B   b     > T -    0    0  -75.6  129.2 -180.0 -138.7  44.6 124.8    0  0.0  261 -1.3    0  0.0  262 -0.7 10 31
  259 L 259    TRP W   H H >   > TS+    0    0  -57.4  -33.8  179.3   63.4 100.8  34.1  164 -1.7  262 -1.2    0  0.0  263 -0.6 13 34
  260 L 260    VAL V   H H 4   > TS+    0    0  -60.4  -27.7 -177.5   56.5  98.2  24.5    0  0.0  263 -1.1    0  0.0    0  0.0  9 29
  261 L 261    ASP D   H H 4   X TS+    0    0  -78.5  -18.7  178.2   74.4  89.2  43.6  258 -1.3  264 -1.7    0  0.0    0  0.0  7 26
  262 L 262    TRP W   H H <   X TS+    0    0  -58.6  -35.5 -174.0   64.9  85.6  30.0  259 -1.2  265 -1.6  258 -0.7    0  0.0  7 30
  263 L 263    TRP W   T h X   X TS+    0    0  -66.8  -10.3  180.0   86.4  76.7  55.5  260 -1.1  267 -1.3  259 -0.6  266 -0.9  8 28
  264 L 264    GLN Q   H H >   < TS+    0    0  -62.1  -25.3  177.5   73.1  73.8  33.8  261 -1.7  268 -2.5    0  0.0    0  0.0  7 24
  265 L 265    TRP W   H H 4   < TS+    0    0  -53.5  -40.9 -178.6   43.3 101.0  27.8  262 -1.6    0  0.0    0  0.0    0  0.0  7 22
  266 L 266    TRP W   H H 4   X TS+    0    0  -72.7  -47.3 -178.4   46.6 114.3  24.0  263 -0.9  269 -1.2    0  0.0    0  0.0  6 21
  267 L 267    VAL V   H H <   3 TS+    0    0  -71.5  -19.4 -179.8   56.6 109.5  33.9  263 -1.3    0  0.0    0  0.0    0  0.0  9 21
  268 L 268    LYS K   T h <   3 TS+    0    0  -97.1   19.2  177.6  134.6  70.4  81.4  264 -2.5    0  0.0    0  0.0    0  0.0  9 21
  269 L 269    LEU L     h >   X T -    0    0  -71.2  128.7 -172.8 -124.3  64.3 121.5  266 -1.2  273 -2.5    0  0.0  272 -2.1  8 16
  270 L 270    PRO P   H H >   3 TS+    0    0  -43.2  -43.6 -179.3   67.2 103.2  31.1    0  0.0  274 -0.6    0  0.0    0  0.0  6 14
  271 L 271    TRP W   H H 4   3 TS+    0    0  -54.3  -28.2 -178.8    5.1 126.6  49.9    0  0.0    0  0.0    0  0.0    0  0.0  5 14
  272 L 272    TRP W   H H 4   X TS+    0    0 -138.7   -3.9 -177.8  106.7  97.9  70.2  269 -2.1  275 -0.6    0  0.0    0  0.0  8 17
  273 L 273    ALA A   H H <   3 TS+    0    0  -49.6  -41.6 -177.9   30.5  93.7  33.2  269 -2.5    0  0.0    0  0.0    0  0.0  8 18
  274 L 274    ASN N   T h <   3 TS+    0    0 -101.5   -3.1  176.5  120.8  85.9  59.8  270 -0.6    0  0.0    0  0.0    0  0.0  8 17
  275 L 275    ILE I     t     < T -    0    0  -61.1  127.8 -177.1 -126.3  64.3 112.9  272 -0.6    0  0.0    0  0.0    0  0.0  6 15
  276 L 276    PRO P               +    0    0  -77.7  163.3 -179.1   35.4  62.7 106.8    0  0.0    0  0.0    0  0.0    0  0.0  6 14
  277 L 277    GLY G   S S        S+    0    0   87.6 -175.6  179.8   82.4  70.6 105.7    0  0.0    0  0.0    0  0.0    0  0.0  6 11
  278 L 278    GLY G   S S        S-    0    0   81.3 -141.4 -178.7  -54.3 103.4 126.0    0  0.0    0  0.0    0  0.0    0  0.0  5 11
  279 L 279    ILE I   S S        S+    0    0 -103.2  -38.9 -176.1   40.1 136.2  38.7    0  0.0    0  0.0    0  0.0    0  0.0  4 14
  280 L 280    ASN N                    0    0 -103.0   26.6 -179.4  999.9 999.9  91.8    0  0.0    0  0.0    0  0.0    0  0.0  6 20
  281 L 281    GLY G                    0    0 -135.6  999.9  999.9  999.9 999.9 123.5    0  0.0    0  0.0    0  0.0    0  0.0  7 16
 
 1qovL.pdb                                                   
 1QOV  PHOTOSYNTHETIC REACTION CENTER  MOL_ID: 1;  MOL_ID: 1;  
 
    author                                                                                                        author   
 Kabs/Sand     TT GGG  S   SSSTTTT  EETTEE HHHHHHHHHHHHHHHHHHHHHHHHHT   TTT  B    GGGTTS   GGGTHHHHHHHHHHHHHHHHH  Kabs/Sand
 chirality   --+++++++-+++-++--++++----+--+-+++++++++++++++++++++++-+-+-++++------++--+----++-++++++++++++++++++  chirality
     bends     SS SSS  S   SSSSSSS   SSS    SSSSSSSSSSSSSSSSSSSSSSSSS   SSS       SSS SS   SSSSSSSSSSSSSSSSSSSSS  bends    
     turns    TTTTTTTT       TTTTTT  TTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTT     TTTTTTT  TTTTTTTTTTTTTTTTTTTTTT  turns    
   5-turns                                                      >5555<                    >>555<<                 5-turns  
   3-turns    >33X>3<<       >3><3<  >33<  >33<                        >33<      >>3X<3<  >>3<<                   3-turns  
  bridge-2                                                                                                        bridge-2 
  bridge-1                          AA  AA                                   A                                    bridge-1 
    sheets                          AA  AA                                                                        sheets   
   4-turns       >444<                    >>>>XXXXXXXXXXXXXXXXXXX<<<<  >444<                  >>>>XXXXXXXXXXXXXX  4-turns  
   summary    tTTgGGGg S   SStTTTTteEETTEEhHHHHHHHHHHHHHHHHHHHHHHHHHht tTTTt B   gGGGgTt  gGGGhHHHHHHHHHHHHHHHHH  summary  
  sequence  ALLSFERKYRVPGGTLVGGNLFDFWVGPFYVGFFGVATFFFAALGIILIAWSAVLQGTWNPQLISVYPPALEYGLGGAPLAKGGLWQIITICATGAFVSW  sequence 
                    10        20        30        40        50        60        70        80        90       100
 
    author                                                                                                        author   
 Kabs/Sand  HHHHHHHHHHHT  SHHHHHHHHHHHHHHHHHTHHHHHHT GGGS  BSHHHHHHHHHHHHHHTS GGG HHHHHHHHHHHHHHHHHHHHHHHHHHHHS   Kabs/Sand
 chirality  ++++++++++-+--++++++++++++++++++++++++-+-+++---+-++++++++++++++-+-+++-+++++++++++++++++++++++++++++-  chirality
     bends  SSSSSSSSSSS   S SSSSSSSSSSSSSSSSSSSSSSSS SSSS  SSSSSSSSSSSSSSSSSS SS  SSSSSSSSSSSSSSSSSSSSSSSSSSSSS   bends    
     turns  TTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT   TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT   turns    
   5-turns         >5555<               >>555<<>5555<                                                             5-turns  
   3-turns          >33<       >>3<<            >33<>>3<<               >>3<<>>3<<                       >33<     3-turns  
  bridge-2                                                                                                        bridge-2 
  bridge-1                                                 A                                                      bridge-1 
    sheets                                                                                                        sheets   
   4-turns  XXXXXXXX<<<<  >>>>XXXXXX<<>><<<<        >>>>XXXXXXXX<<<<     >>>>XXXXXXXXXXXXXXXXXXXXXX<<<<   4-turns  
   summary  HHHHHHHHHHHht hHHHHHHHHHHHHHHHHHhHHHHHHhgGGGg  BhHHHHHHHHHHHHHHhggGGGhHHHHHHHHHHHHHHHHHHHHHHHHHHHHh   summary  
  sequence  ALREVEICRKLGIGYHIPFAFAFAILAYLTLVLFRPVMMGAWGYAFPYGIWTHLDWVSNTGYTYGNFHYNPAHMIAISFFFTNALALALHGALVLSAANP  sequence 
                   110       120       130       140       150       160       170       180       190       200
 
    author                                                                                     author   
 Kabs/Sand  STT     HHHHHHHHHHHHS    HHHHHHHHHHHHHHHHHHHHHHHHTBTTTB S HHHHTHHHHT HHHHT  SSS    Kabs/Sand
 chirality  -++-----++++++++++--+----+++++++++++++++++++++++++++++++--++++++++++-+++++-++-+    chirality
     bends  SSS     SSSSSSSSSSSSS    SSSSSSSSSSSSSSSSSSSSSSSSSSSSS  S SSSSSSSSSS SSSSS  SSS    bends    
     turns  TTTT   TTTTTTTTTTTTTT   TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT  TTTTTTTTTTTTTTTTTT        turns    
   5-turns                                                   >5555<                            5-turns  
   3-turns  >33<   >33<               >33<                 >33<      >>>XXX<>>>XXXXXX<<<<   >>>>XXXXXXXXXXXXXXXXXX<<<<       >>4444<<>>44<<         4-turns  
   summary  tTTt   hHHHHHHHHHHHHh   hHHHHHHHHHHHHHHHHHHHHHHHHhBTTTB ShHHHHhHHHHhhHHHHht SSS    summary  
  sequence  EKGKEMRTPDHEDTFFRDLVGYSIGTLGIHRLGLLLSLSAVFFSALCMIITGTIWFDQWVDWWQWWVKLPWWANIPGGING  sequence 
                   210       220       230       240       250       260       270       280