Secondary structure calculation program - copyright by David Keith Smith, 1989
 1rpmA.pdb                                                   
 1RPM  RECEPTOR  MOL_ID: 1;  MOL_ID: 1;  
 Sequence length -  278
             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 A 879    ALA A                    0    0  999.9  149.2 -178.3  999.9 999.9 999.9    0  0.0    0  0.0    0  0.0    0  0.0  6 31
    2 A 880    ILE I   E E  AA     -  243    0 -128.1  127.4  177.8 -126.5 999.9 171.8  243 -2.7  243 -2.9    0  0.0    0  0.0 10 34
    3 A 881    ARG R   E E >AA > T -  242    0  -66.4  138.0 -179.1 -120.1  30.2 122.4    0  0.0    6 -2.4    0  0.0    7 -1.0  9 30
    4 A 882    VAL V   T e 4   3 TS+    0    0  -56.3  -12.9  179.7   60.9 114.3  47.3  241 -2.6    0  0.0    0  0.0    0  0.0 11 35
    5 A 883    ALA A   T T 4   3 TS+    0    0  -87.7  -17.8  178.9   42.4 105.6  49.4    0  0.0    0  0.0    0  0.0    0  0.0  7 28
    6 A 884    ASP D   T h >   < TS+    0    0 -103.0   -2.8 -178.4  100.3  88.9  62.6    3 -2.4   10 -3.1    0  0.0    0  0.0  8 27
    7 A 885    LEU L   H H X     TS+    0    0  -50.9  -45.3  179.7   48.8  79.1  33.1    3 -1.0   11 -3.3    0  0.0    0  0.0 10 40
    8 A 886    LEU L   H H >     TS+    0    0  -65.9  -41.1  179.6   45.9 113.9  24.4    0  0.0   12 -2.7    0  0.0    0  0.0  8 36
    9 A 887    GLN Q   H H >     TS+    0    0  -66.0  -45.0  179.1   48.4 115.4  19.9    0  0.0   13 -2.7    0  0.0    0  0.0  7 28
   10 A 888    HIS H   H H X     TS+    0    0  -58.5  -55.0 -179.5   45.0 113.5  15.2    6 -3.1   14 -2.4    0  0.0    0  0.0  9 37
   11 A 889    ILE I   H H X     TS+    0    0  -56.5  -46.1 -179.4   52.0 113.5  17.8    7 -3.3   15 -1.2    0  0.0    0  0.0 10 46
   12 A 890    THR T   H H X   > TS+    0    0  -57.3  -49.6  178.5   46.4 109.9  25.1    8 -2.7   15 -0.8    0  0.0   16 -0.6  8 30
   13 A 891    GLN Q   H H <   > TS+    0    0  -60.3  -41.1  179.7   57.5 108.5  24.8    9 -2.7   16 -1.4    0  0.0    0  0.0  8 24
   14 A 892    MET M   H H <   3 TS+    0    0  -60.5  -26.7  179.8   53.4 104.2  40.4   10 -2.4   22 -2.0    0  0.0    0  0.0 10 34
   15 A 893    LYS K   H H X   < TS+    0    0  -84.0  -13.8 -179.9  116.2  83.9  52.3   11 -1.2   19 -2.6   12 -0.8    0  0.0 11 29
   16 A 894    CYS C   H H X   <>TS+    0    0  -58.7  147.1 -179.1   22.2  74.0 102.1   13 -1.4   20 -2.8   12 -0.6   21 -0.6  9 18
   17 A 895    ALA A   H H 4    5TS-    0    0   59.5   49.1 -178.9  -46.6 147.5  23.6    0  0.0    0  0.0    0  0.0    0  0.0  5 15
   18 A 896    GLU E   H H 4    5TS-    0    0   62.7   35.0  179.8  -50.2 114.7  33.7    0  0.0    0  0.0    0  0.0    0  0.0  5 18
   19 A 897    GLY G   H H X    5TS+    0    0   73.5   43.8 -179.1  161.4  82.1  28.1   15 -2.6   23 -3.1    0  0.0    0  0.0  9 28
   20 A 898    TYR Y   H H X    5TS+    0    0  -60.0  -44.3  179.6   52.8  75.5  24.1   16 -2.8   24 -3.0    0  0.0    0  0.0 10 22
   21 A 899    GLY G   H H >         TS+    0    0  -68.6  -42.2  179.4   52.5 114.5  25.7   14 -2.0   26 -3.3    0  0.0    0  0.0 11 38
   23 A 901    LYS K   H H X     TS+    0    0  -57.8  -48.4  179.3   41.2 115.4  20.6   19 -3.1   27 -1.8    0  0.0    0  0.0  9 32
   24 A 902    GLU E   H H X     TS+    0    0  -69.0  -40.2  179.1   50.4 115.5  29.9   20 -3.0   28 -0.8    0  0.0    0  0.0  8 25
   25 A 903    GLU E   H H <   > TS+    0    0  -64.2  -49.1 -179.6   47.7 111.3  15.1   21 -2.1   28 -1.3    0  0.0    0  0.0  8 40
   26 A 904    TYR Y   H H <   > TS+    0    0  -61.0  -35.9  180.0   57.5 107.1  29.6   22 -3.3   29 -1.4    0  0.0    0  0.0  9 42
   27 A 905    GLU E   H H <   3 TS+    0    0  -68.8  -16.6  179.3   68.4  94.1  44.5   23 -1.8    0  0.0    0  0.0    0  0.0  7 29
   28 A 906    SER S   T h <   < TS+    0    0  -73.7  -21.0  179.2   92.3  82.0  45.1   25 -1.3    0  0.0   24 -0.8    0  0.0  6 30
   29 A 907    PHE F   S t     < TS-    0    0  -69.3  155.4  179.1 -107.2  89.1 111.1   26 -1.4   31 -0.8    0  0.0    0  0.0  7 39
   30 A 908    PHE F               -    0    0  -90.5  116.1  179.1 -152.7  30.1 139.1    0  0.0    0  0.0    0  0.0    0  0.0  8 34
   31 A 909    GLU E               +    0    0  -88.0  127.7  179.4    6.8  57.6 136.4   29 -0.8    0  0.0    0  0.0    0  0.0  6 34
   32 A 910    GLY G   S S        S-    0    0  103.9 -174.4 -179.5   -5.1 109.4 118.6    0  0.0    0  0.0    0  0.0    0  0.0  7 35
   33 A 911    GLN Q               +    0    0  -62.9  114.3  179.8  164.2  51.2 115.8    0  0.0    0  0.0    0  0.0    0  0.0  6 35
   34 A 912    SER S               +    0    0 -114.2    8.6 -178.9   28.4  65.4  76.5    0  0.0    0  0.0    0  0.0    0  0.0  7 30
   35 A 913    ALA A   S S        S-    0    0 -161.7  162.6  179.6  -73.4  94.2 164.4    0  0.0    0  0.0    0  0.0    0  0.0  7 31
   36 A 914    PRO P               +    0    0  -64.2  150.1  178.2  173.5  33.0 111.0    0  0.0   58 -2.2    0  0.0    0  0.0  8 26
   37 A 915    TRP W     t >     T +    0    0 -153.3   51.6 -179.4  149.4  19.8 107.7    0  0.0   41 -2.3    0  0.0    0  0.0 10 43
   38 A 916    ASP D   T T 4     TS+    0    0  -58.4  -36.5 -179.9   46.9  76.2  40.7    0  0.0    0  0.0    0  0.0    0  0.0  8 36
   39 A 917    SER S   T T 4   > TS+    0    0  -75.8  -40.3 -179.8   51.3 111.4  26.5    0  0.0   42 -1.4    0  0.0    0  0.0  8 39
   40 A 918    ALA A   T T 4   3 TS+    0    0  -63.1  -40.0 -179.5   48.1 111.1  30.3   56 -0.5    0  0.0    0  0.0    0  0.0 14 47
   41 A 919    LYS K   T T <   3 TS+    0    0  -87.3   12.5  177.3  123.3  81.9  77.5   37 -2.3    0  0.0    0  0.0    0  0.0  9 35
   42 A 920    LYS K     g     X T -    0    0  -72.6  139.3 -178.2 -128.6  68.7 125.9   39 -1.4   45 -2.3    0  0.0    0  0.0  8 30
   43 A 921    ASP D   G G     > TS+    0    0  -56.8  -36.2  179.2   58.5 109.2  31.9    0  0.0   46 -1.2    0  0.0    0  0.0  5 25
   44 A 922    GLU E   G G     3 TS+    0    0  -70.2   -8.9  178.1   46.7 108.3  57.1    0  0.0    0  0.0    0  0.0    0  0.0  6 26
   45 A 923    ASN N   G G     X TS+    0    0 -110.7    1.7 -177.4  101.9  82.1  68.7   42 -2.3   48 -2.2    0  0.0    0  0.0 12 41
   46 A 924    ARG R   G G     X TS+    0    0  -55.8  -40.5 -179.5   53.3  77.8  31.1   43 -1.2   49 -1.2    0  0.0    0  0.0 10 33
   47 A 925    MET M   G G     3 TS+    0    0  -78.1    4.8 -179.4   63.6 100.1  68.5    0  0.0    0  0.0    0  0.0    0  0.0  7 36
   48 A 926    LYS K   G G     < TS+    0    0 -106.6   -0.7  179.0   82.2  87.8  66.1   45 -2.2   77 -0.5    0  0.0    0  0.0 11 52
   49 A 927    ASN N     g     < T -    0    0 -109.7  127.6 -178.9 -165.6  57.9 157.5   46 -1.2    0  0.0    0  0.0    0  0.0 12 53
   50 A 928    ARG R   S S        S+    0    0  -73.8  -55.5  177.6   26.9  85.9  16.7    0  0.0   52 -0.5    0  0.0    0  0.0 11 45
   51 A 929    TYR Y   S t     > TS-    0    0 -112.8  120.8 -178.1 -145.6  75.9 163.9    0  0.0   54 -1.6    0  0.0    0  0.0  7 47
   52 A 930    GLY G   T T     3 TS+    0    0  -57.6  -22.2  179.9   47.3 100.4  48.4   50 -0.5    0  0.0    0  0.0    0  0.0  7 36
   53 A 931    ASN N   T T     3 TS+    0    0  -96.2  -13.5  179.1   64.2 102.9  57.2    0  0.0   55 -0.7    0  0.0    0  0.0  5 41
   54 A 932    ILE I   S t     < TS+    0    0 -111.6   78.5 -179.3  138.2  77.4 138.3   51 -1.6    0  0.0    0  0.0    0  0.0 12 59
   55 A 933    ILE I               -    0    0 -120.2  170.5 -175.0  -80.3  54.2 138.7   53 -0.7  257 -0.6    0  0.0    0  0.0 14 62
   56 A 934    ALA A               -    0    0  -84.4  121.0  178.3 -130.6  33.3 128.3    0  0.0   40 -0.5    0  0.0    0  0.0 14 58
   57 A 935    TYR Y     g >   > T -    0    0  -61.2  139.9  179.1 -129.3  18.6 106.8    0  0.0   61 -1.0    0  0.0   60 -0.7 15 50
   58 A 936    ASP D   G G 4   > TS+    0    0  -55.4  -53.0 -176.0   56.9 101.5  25.4   36 -2.2   61 -0.7    0  0.0    0  0.0 11 38
   59 A 937    HIS H   G G 4   3 TS+    0    0  -59.4  -21.5 -178.8   23.5 122.3  45.6    0  0.0    0  0.0    0  0.0    0  0.0  6 36
   60 A 938    SER S   G e 4   < TS+    0    0 -129.2    8.3 -178.8  128.8  87.0  69.8   57 -0.7   80 -2.6    0  0.0    0  0.0 11 43
   61 A 939    ARG R   E E  T -    0    0  -73.4  115.9  179.6  -81.8  49.0 131.0    0  0.0   70 -2.0    0  0.0    0  0.0  8 25
   68 A 946    GLU E   T T     3 TS+    0    0  -18.9  120.6  179.2    2.9 112.8  74.3   66 -0.6    0  0.0    0  0.0    0  0.0  4 15
   69 A 947    GLY G   T T     3 TS+    0    0   71.7    7.9 -179.3  114.3 104.9  57.8    0  0.0   71 -0.6    0  0.0    0  0.0  5 10
   70 A 948    ASP D     t     X T -    0    0 -118.0   96.6  177.7 -163.8  49.8 149.1   67 -2.0   73 -1.3    0  0.0    0  0.0  7 16
   71 A 949    THR T   T T     3 TS+    0    0  -68.7  152.2 -179.2   28.8  82.1 116.2   69 -0.6    0  0.0    0  0.0    0  0.0  7 22
   72 A 950    ASN N   T T     > TS+    0    0   73.5   -2.3  178.3  113.5  86.0  65.0    0  0.0   75 -0.9    0  0.0    0  0.0  8 33
   73 A 951    SER S   T T     < T +    0    0  -86.7   25.6  179.0   79.2  57.5  84.0   70 -1.3    0  0.0    0  0.0    0  0.0  9 37
   74 A 952    ASP D   T e     3 TS+    0    0 -109.3    6.5 -176.4   99.5  76.5  74.4    0  0.0   64 -2.1    0  0.0    0  0.0 10 46
   75 A 953    TYR Y   E E  BB < T +   63    0 -109.9  137.1  174.9  159.3  34.4 146.9   72 -0.9    0  0.0    0  0.0    0  0.0 12 56
   76 A 954    ILE I   E E  B*     -    0    0 -142.5  139.1  179.8 -113.4  48.6 168.3   62 -0.6   78 -2.3    0  0.0    0  0.0 13 67
   77 A 955    ASN N   E E  B*    S+    0    0  -75.9   80.3 -179.5  108.8  79.1 123.5   48 -0.5   94 -1.2    0  0.0    0  0.0 13 73
   78 A 956    GLY G   E E  B*C    -    0   93 -155.0  150.4 -179.3 -154.2  49.6 171.7   76 -2.3   62 -2.1    0  0.0    0  0.0 13 80
   79 A 957    ASN N   E E  BBC    -   61   92 -132.2  146.4  176.9 -119.7  19.3 167.0   92 -2.6   92 -2.8    0  0.0    0  0.0 14 67
   80 A 958    TYR Y   E E  B C    -    0   91  -78.5  145.5  180.0 -173.6  29.8 122.9   60 -2.6    0  0.0    0  0.0    0  0.0 13 57
   81 A 959    ILE I   E E  B C    -    0   90 -144.0  135.4 -178.9 -116.1  22.5 176.9   90 -2.7   90 -2.8    0  0.0    0  0.0 13 58
   82 A 960    ASP D   E E  B *    -    0    0  -72.9  151.7  176.3 -143.7  21.3 115.3    0  0.0    0  0.0    0  0.0    0  0.0 10 45
   83 A 961    GLY G   E E  B C> T -    0   86 -100.1 -179.3 -178.6  -68.3  49.0 113.6   86 -3.6   86 -0.6    0  0.0    0  0.0 10 52
   84 A 962    TYR Y   T T     3 TS-    0    0  -40.0  -54.3  176.4  -15.4 124.7  35.5    0  0.0    0  0.0    0  0.0    0  0.0  8 38
   85 A 963    HIS H   T T     3 TS+    0    0 -144.1   34.0 -178.5   95.7 121.2  94.0    0  0.0    0  0.0    0  0.0    0  0.0  5 27
   86 A 964    ARG R   E E  BC X TS-   83    0 -130.3  110.8 -180.0 -133.4  71.0 164.1   83 -0.6   83 -3.6    0  0.0   89 -1.0  7 31
   87 A 965    PRO P   E E  B* 3 TS+    0    0  -65.3  140.5  178.0    1.1  87.6 111.0    0  0.0    0  0.0    0  0.0    0  0.0  7 31
   88 A 966    ASN N   E E  B* 3 TS+    0    0   50.5   44.1  179.8  154.7  78.3  33.3    0  0.0    0  0.0    0  0.0    0  0.0 10 42
   89 A 967    HIS H   E E  B* < T +    0    0  -72.7  -21.7  179.2   37.7  61.4  43.5   86 -1.0  213 -2.5    0  0.0    0  0.0 12 52
   90 A 968    TYR Y   E E  BCd    -   81  213 -131.9  160.5  177.3 -151.3  60.6 156.4   81 -2.8   81 -2.7    0  0.0    0  0.0 13 68
   91 A 969    ILE I   E E  BCd    -   80  214 -129.3  111.2  177.7 -154.1  16.2 172.1  213 -2.3  215 -3.0    0  0.0   93 -0.6 14 76
   92 A 970    ALA A   E E  BCd    +   79  215  -88.1  121.2 -178.9  162.7  30.5 147.9   79 -2.8   79 -2.6    0  0.0    0  0.0 16 76
   93 A 971    THR T   E E  BCd    -   78  216 -135.0  172.9  176.9 -101.8  38.7 151.9  215 -2.6  217 -0.7   91 -0.6    0  0.0 15 79
   94 A 972    GLN Q     e         -    0    0  -88.1  161.9  178.1  -86.7  53.1 117.0   77 -1.2    0  0.0    0  0.0    0  0.0 14 71
   95 A 973    GLY G               -    0    0  -68.6  127.0 -179.8  -98.7  61.8 124.6  218 -2.2    0  0.0    0  0.0    0  0.0 14 62
   96 A 974    PRO P               -    0    0  -46.6  153.2  178.4 -145.8  35.2  92.5    0  0.0  131 -2.0    0  0.0    0  0.0 11 59
   97 A 975    MET M     g     > T -    0    0 -112.9  163.4  179.3 -101.7  32.1 139.4    0  0.0  100 -1.4    0  0.0    0  0.0 11 44
   98 A 976    GLN Q   G G     > TS+    0    0  -55.6  -40.1  179.8   52.8 125.5  24.6    0  0.0  101 -1.1    0  0.0    0  0.0  7 31
   99 A 977    GLU E   G G     3 TS+    0    0  -67.8  -21.1 -177.5   41.9 114.7  46.1    0  0.0    0  0.0    0  0.0    0  0.0  8 31
  100 A 978    THR T   G h >   < TS+    0    0 -114.7   17.1  179.8  103.5  77.4  75.0   97 -1.4  104 -2.0    0  0.0    0  0.0 10 48
  101 A 979    ILE I   H H >   < TS+    0    0  -62.6  -44.8  178.5   45.6  88.9  20.9   98 -1.1  105 -2.1    0  0.0    0  0.0 11 45
  102 A 980    TYR Y   H H >     TS+    0    0  -63.1  -45.0  179.1   52.0 110.5  25.5    0  0.0  106 -2.8    0  0.0    0  0.0  9 46
  103 A 981    ASP D   H H >     TS+    0    0  -58.6  -38.0  179.7   52.8 109.8  31.2    0  0.0  107 -1.5    0  0.0    0  0.0  9 56
  104 A 982    PHE F   H H X     TS+    0    0  -64.0  -51.1 -179.1   42.2 112.1  20.4  100 -2.0  108 -2.4    0  0.0    0  0.0 10 70
  105 A 983    TRP W   H H X     TS+    0    0  -66.7  -40.8  178.4   51.8 112.9  26.0  101 -2.1  109 -2.4    0  0.0    0  0.0 10 69
  106 A 984    ARG R   H H X     TS+    0    0  -65.4  -29.3  176.9   49.3 111.4  33.3  102 -2.8  110 -2.7    0  0.0    0  0.0 10 52
  107 A 985    MET M   H H X     TS+    0    0  -69.8  -50.5  178.6   51.4 109.0  20.0  103 -1.5  111 -2.7    0  0.0    0  0.0  9 57
  108 A 986    VAL V   H H <    >TS+    0    0  -51.3  -41.6 -179.4   44.2 115.3  26.9  104 -2.4  113 -2.4    0  0.0    0  0.0 11 63
  109 A 987    TRP W   H H <   >5TS+    0    0  -70.5  -53.7 -179.8   45.9 114.5  15.3  105 -2.4  112 -1.6    0  0.0    0  0.0  8 50
  110 A 988    HIS H   H H <   35TS+    0    0  -60.5  -31.5  179.2   49.1 114.0  40.1  106 -2.7    0  0.0    0  0.0    0  0.0  7 43
  111 A 989    GLU E   T h <   35TS-    0    0  -87.4   -0.3 -179.3 -127.9 107.0  65.6  107 -2.7    0  0.0    0  0.0    0  0.0  8 48
  112 A 990    ASN N   T T     <5T +    0    0   53.7   41.1  178.7  178.1  43.3  28.9  109 -1.6  211 -3.3    0  0.0    0  0.0  9 45
  113 A 991    THR T     t       TS-  127    0 -137.5  133.7 -178.6   -5.3  72.4 172.2  127 -2.5  127 -2.1    0  0.0    0  0.0  9 28
  125 A1003    VAL V   T T     3 TS-    0    0   51.8   38.7  178.1  -54.3 132.5  31.3    0  0.0    0  0.0    0  0.0    0  0.0  5 16
  126 A1004    GLY G   T T     3 TS+    0    0   83.1   -6.6 -179.4  118.2 114.2  69.6    0  0.0    0  0.0    0  0.0    0  0.0  5 15
  127 A1005    ARG R   E E  CG < T -  124    0 -102.1  137.0  178.1 -125.4  67.4 140.5  124 -2.1  124 -2.5    0  0.0  129 -0.7  6 22
  128 A1006    VAL V   E E  CG     +  123    0  -77.4  113.6 -177.7  179.0  29.4 136.2    0  0.0    0  0.0    0  0.0    0  0.0  8 25
  129 A1007    LYS K     e         -    0    0  -92.7  -18.6 -176.9   -1.2  64.3  49.6  122 -2.5    0  0.0  127 -0.7    0  0.0 12 43
  130 A1008    CYS C   S S        S-    0    0 -169.4  143.9  177.8 -113.0  73.9 160.8  122 -1.0    0  0.0    0  0.0    0  0.0 13 46
  131 A1009    CYS C               -    0    0  -83.0  158.1  178.9  -99.3  41.5 119.1   96 -2.0  133 -1.5    0  0.0    0  0.0 10 40
  132 A1010    LYS K               +    0    0  -78.0   94.6 -177.5  172.2  49.7 133.3    0  0.0    0  0.0    0  0.0    0  0.0  6 44
  133 A1011    TYR Y               +    0    0  -85.2   -1.1 -179.5   68.5  53.5  65.4  131 -1.5    0  0.0    0  0.0    0  0.0  8 56
  134 A1012    TRP W   S S        S-    0    0 -117.4  159.6 -179.5 -112.2  82.8 144.7    0  0.0    0  0.0    0  0.0    0  0.0  6 55
  135 A1013    PRO P               -    0    0  -92.8  157.3  178.2 -142.7   3.1 122.4    0  0.0    0  0.0    0  0.0    0  0.0 10 37
  136 A1014    ASP D   S S        S-    0    0  -84.3  -21.7  177.6   -6.0 101.3  46.5    0  0.0    0  0.0    0  0.0    0  0.0  6 27
  137 A1015    ASP D   S e        S-    0    0 -131.1  -82.5  179.7  -33.3 127.2  69.6    0  0.0  148 -3.0    0  0.0    0  0.0  6 21
  138 A1016    THR T   E E  BH     +  147    0 -151.1  152.0 -179.8  176.9  52.4 174.1    0  0.0    0  0.0    0  0.0    0  0.0  9 30
  139 A1017    GLU E   E E  BH     -  146    0 -158.5  143.9  179.8 -137.3  23.0 170.9  146 -1.8  146 -2.9    0  0.0  141 -0.6  9 28
  140 A1018    ILE I   E E  BH     -  145    0 -108.1  115.7  178.8 -165.9  11.8 159.2    0  0.0  142 -0.9    0  0.0    0  0.0  8 31
  141 A1019    TYR Y   E E  BH > T -  144    0 -102.0   86.6 -178.7  -67.0  66.3 143.7  144 -3.4  144 -1.8  139 -0.6  143 -1.3 10 37
  142 A1020    LYS K   T T     3 TS-    0    0   67.9  -92.1 -179.8  -11.2 121.9 122.9  140 -0.9    0  0.0    0  0.0    0  0.0  6 31
  143 A1021    ASP D   T e     3 TS+    0    0 -119.6    6.1  179.2   87.8 120.4  72.4  141 -1.3  167 -2.1    0  0.0  145 -0.5  7 32
  144 A1022    ILE I   E E  BHI< T -  141  166 -109.9  118.8  178.4 -159.6  60.3 160.2  141 -1.8  141 -3.4    0  0.0    0  0.0 12 42
  145 A1023    LYS K   E E  BHI    -  140  165  -99.3  131.7 -179.9 -167.7   5.9 152.0  165 -3.1  165 -2.6  143 -0.5    0  0.0 13 41
  146 A1024    VAL V   E E  BHI    -  139  164 -123.4  120.9 -179.6 -174.0   3.6 166.4  139 -2.9  139 -1.8    0  0.0    0  0.0 14 48
  147 A1025    THR T   E E  BHI    -  138  163 -120.4  122.5  178.5 -131.1  24.7 163.3  163 -1.9  163 -2.2    0  0.0    0  0.0 12 36
  148 A1026    LEU L   E E  B I    +    0  162  -69.5  122.9 -176.2  171.0  31.7 127.0  137 -3.0    0  0.0    0  0.0    0  0.0 13 35
  149 A1027    ILE I   E E  B *    +    0    0 -112.7  -18.1  177.3    0.1  59.2  57.5  161 -3.1    0  0.0    0  0.0    0  0.0  8 29
  150 A1028    GLU E   E E  B I    -    0  161 -168.9  155.6  178.2 -157.5  49.9 164.1  161 -1.2  161 -2.2    0  0.0    0  0.0  8 28
  151 A1029    THR T   E E  B I    -    0  160 -141.8  121.8  179.6 -171.2  11.1 164.0    0  0.0  153 -0.5    0  0.0    0  0.0  9 30
  152 A1030    GLU E   E E  B I    -    0  159 -121.8  117.6 -178.2 -156.1   9.2 166.1  159 -2.5  159 -2.9    0  0.0    0  0.0  7 26
  153 A1031    LEU L   E E  B I    +    0  158  -98.4  131.2  177.5  167.2  18.4 143.4  151 -0.5    0  0.0    0  0.0    0  0.0  7 23
  154 A1032    LEU L   E E  B I> T -    0  157 -131.4  174.3 -178.6  -79.4  50.2 142.0  157 -2.3  157 -0.6    0  0.0    0  0.0  6 28
  155 A1033    ALA A   T T     3 TS+    0    0  -39.9  -65.4 -177.0    5.3 120.3  28.0    0  0.0    0  0.0    0  0.0    0  0.0  6 26
  156 A1034    GLU E   T e     3 TS+    0    0 -115.3   19.6  179.5   31.5 129.3  82.2    0  0.0  181 -1.7    0  0.0  182 -1.7 10 38
  157 A1035    TYR Y   E E  BIJ< T -  154  180 -165.8  164.5  178.9 -139.0  59.1 169.4  154 -0.6  154 -2.3    0  0.0    0  0.0 12 41
  158 A1036    VAL V   E E  BIJ    -  153  179 -129.0  143.5  176.0 -145.0  13.4 165.5  179 -1.9  179 -2.4    0  0.0  160 -0.6 12 42
  159 A1037    ILE I   E E  BIJ    -  152  178 -111.9  117.1  177.5 -168.3  14.2 163.9  152 -2.9  152 -2.5    0  0.0  161 -0.6 12 48
  160 A1038    ARG R   E E  BIJ    -  151  177 -105.0  122.8 -179.3 -157.5   6.9 158.4  177 -2.5  177 -2.8  158 -0.6    0  0.0 13 44
  161 A1039    THR T   E E  BIJ    -  150  176 -102.4  133.7 -178.1 -165.9  11.3 149.8  150 -2.2  149 -3.1  159 -0.6  150 -1.2 12 43
  162 A1040    PHE F   E E  BIJ    -  148  175 -122.8  155.3  176.9 -144.3  24.5 148.0  175 -2.3  175 -1.6    0  0.0  164 -0.6 14 46
  163 A1041    ALA A   E E  BIJ    -  147  174 -112.5  105.4 -176.8 -167.3  33.4 167.1  147 -2.2  147 -1.9    0  0.0    0  0.0 12 42
  164 A1042    VAL V   E E  BIJ    +  146  173 -106.8  135.5 -176.6  179.8   9.2 149.0  173 -3.1  173 -2.7  162 -0.6    0  0.0 12 49
  165 A1043    GLU E   E E  BI     -  145    0 -135.5  146.0  179.3 -150.9  16.8 167.2  145 -2.6  145 -3.1    0  0.0    0  0.0 11 40
  166 A1044    LYS K   E E  BI > T -  144    0 -114.0  144.4 -179.9  -97.4  38.1 153.3    0  0.0  169 -1.6    0  0.0    0  0.0 10 35
  167 A1045    ARG R   T e     3 TS+    0    0  -65.2  131.6  179.1    6.0 105.8 112.8  143 -2.1    0  0.0    0  0.0    0  0.0  8 24
  168 A1046    GLY G   T T     3 TS+    0    0   79.5   -2.2  179.6  108.6 102.2  65.2    0  0.0  170 -0.6    0  0.0    0  0.0  4 15
  169 A1047    VAL V     t     < T -    0    0 -109.3  112.8 -179.5 -142.7  66.7 162.3  166 -1.6  171 -2.1    0  0.0    0  0.0  6 19
  170 A1048    HIS H               +    0    0  -76.6   77.4 -178.8  102.6  64.1 121.2  168 -0.6    0  0.0    0  0.0    0  0.0  6 15
  171 A1049    GLU E               -    0    0 -157.1  151.2  178.4 -156.7  53.7 168.6  169 -2.1    0  0.0    0  0.0    0  0.0  6 22
  172 A1050    ILE I               -    0    0 -134.4  118.6 -178.6 -162.1  19.8 165.8    0  0.0    0  0.0    0  0.0    0  0.0  7 30
  173 A1051    ARG R   E E  B J    -    0  164 -109.2  139.5  178.3 -136.5  15.3 151.6  164 -2.7  164 -3.1    0  0.0  175 -0.7  9 40
  174 A1052    GLU E   E E  B J    +    0  163  -92.8  118.3  179.0  178.3  28.3 144.6    0  0.0    0  0.0    0  0.0    0  0.0  9 43
  175 A1053    ILE I   E E  B J    -    0  162 -124.2  124.8  180.0 -155.6  11.9 172.5  162 -1.6  162 -2.3  173 -0.7    0  0.0 12 57
  176 A1054    ARG R   E E  BeJ    -  115  161 -104.4  138.6  176.6 -152.7   5.2 148.3  114 -2.6  116 -2.9    0  0.0  178 -0.5 11 57
  177 A1055    GLN Q   E E  BeJ    -  116  160 -106.7  120.9  179.8 -156.9   7.7 159.5  160 -2.8  160 -2.5    0  0.0  179 -0.8 12 63
  178 A1056    PHE F   E E  BeJ    -  117  159 -102.4  101.9 -178.8 -168.0  12.5 155.6  116 -3.3  118 -2.7  176 -0.5  180 -0.8 14 62
  179 A1057    HIS H   E E  BeJ    -  118  158  -97.2   99.4  177.4 -157.1   7.9 146.9  158 -2.4  158 -1.9  177 -0.8  181 -0.6 12 60
  180 A1058    PHE F   E E  B J    +    0  157  -78.0  116.2 -179.1  171.7  18.2 133.3  118 -2.5    0  0.0  178 -0.8    0  0.0 15 58
  181 A1059    THR T     e         +    0    0 -104.1   -2.9 -178.5   86.5  56.3  66.5  156 -1.7    0  0.0  179 -0.6    0  0.0 10 48
  182 A1060    GLY G               +    0    0  -86.4   14.3  179.9  112.1  54.6  76.4  156 -1.7    0  0.0    0  0.0    0  0.0 10 42
  183 A1061    TRP W   S S        S-    0    0  -91.6  124.7 -179.7 -116.0  70.1 142.7    0  0.0    0  0.0    0  0.0    0  0.0  9 50
  184 A1062    PRO P               -    0    0  -58.6  149.2  179.0 -112.7  17.3  97.6    0  0.0    0  0.0    0  0.0    0  0.0  7 37
  185 A1063    ASP D   S S        S+    0    0  -51.6  -20.2 -178.3   17.1 104.7  53.2    0  0.0    0  0.0    0  0.0    0  0.0  6 28
  186 A1064    HIS H   S S        S+    0    0 -154.2  153.1  179.6    2.4 118.7 167.4    0  0.0    0  0.0    0  0.0    0  0.0  4 29
  187 A1065    GLY G   S S        S-    0    0   68.7 -149.0 -178.3  -61.8  94.1 112.1    0  0.0    0  0.0    0  0.0    0  0.0  7 28
  188 A1066    VAL V               -    0    0 -130.3  165.9  179.8  -62.2  68.5 141.7    0  0.0    0  0.0    0  0.0    0  0.0  9 42
  189 A1067    PRO P               -    0    0  -54.3  143.2  178.7 -138.0  35.1 101.7    0  0.0    0  0.0    0  0.0    0  0.0  9 42
  190 A1068    TYR Y   S S        S+    0    0  -69.5  -31.6  177.8   31.6  96.9  39.4    0  0.0    0  0.0    0  0.0    0  0.0  4 26
  191 A1069    HIS H               -    0    0 -128.0  133.4  178.1 -153.4  67.6 174.2    0  0.0    0  0.0    0  0.0    0  0.0  5 33
  192 A1070    ALA A   S h >     TS+    0    0  -78.4   -9.8 -177.8   97.2  78.6  52.5    0  0.0  196 -2.4    0  0.0    0  0.0 11 44
  193 A1071    THR T   H H >     TS+    0    0  -45.3  -49.7 -178.6   47.0  80.0  31.9    0  0.0  197 -2.4    0  0.0    0  0.0  8 38
  194 A1072    GLY G   H H >     TS+    0    0  -64.3  -45.8  179.4   45.5 113.6  26.0    0  0.0  198 -2.3    0  0.0    0  0.0 10 42
  195 A1073    LEU L   H H >     TS+    0    0  -67.3  -32.0  178.0   53.9 112.4  33.6    0  0.0  199 -2.4    0  0.0    0  0.0 11 55
  196 A1074    LEU L   H H X     TS+    0    0  -67.0  -44.2  177.6   47.6 108.9  23.0  192 -2.4  200 -2.0    0  0.0    0  0.0 10 50
  197 A1075    GLY G   H H X     TS+    0    0  -61.6  -42.8  178.5   51.7 111.7  22.9  193 -2.4  201 -1.4    0  0.0    0  0.0  8 42
  198 A1076    PHE F   H H X     TS+    0    0  -58.9  -45.3 -179.9   53.0 107.0  26.4  194 -2.3  202 -2.2    0  0.0    0  0.0 12 53
  199 A1077    VAL V   H H X     TS+    0    0  -58.4  -47.4  179.6   49.6 108.2  22.2  195 -2.4  203 -2.8    0  0.0    0  0.0 10 58
  200 A1078    ARG R   H H X     TS+    0    0  -63.5  -31.4  178.1   53.6 108.6  36.2  196 -2.0  204 -2.5    0  0.0    0  0.0  8 42
  201 A1079    GLN Q   H H X     TS+    0    0  -69.5  -43.4  179.6   45.8 111.3  22.6  197 -1.4  205 -2.7    0  0.0    0  0.0  8 42
  202 A1080    VAL V   H H X     TS+    0    0  -64.5  -47.5 -179.9   46.6 114.9  19.6  198 -2.2  206 -2.2    0  0.0    0  0.0 10 54
  203 A1081    LYS K   H H <     TS+    0    0  -59.3  -46.7 -178.5   44.3 116.8  24.5  199 -2.8    0  0.0    0  0.0    0  0.0  7 46
  204 A1082    SER S   H H <     TS+    0    0  -67.2  -47.0 -179.0   41.3 118.5  21.6  200 -2.5    0  0.0    0  0.0    0  0.0  6 26
  205 A1083    LYS K   H H <     TS+    0    0  -74.7  -26.4 -178.5   99.6  90.9  39.8  201 -2.7    0  0.0    0  0.0    0  0.0  6 34
  206 A1084    SER S   S h <     TS-    0    0  -71.5  118.0  179.9 -121.0  77.9 120.3  202 -2.2    0  0.0    0  0.0    0  0.0  9 37
  207 A1085    PRO P     t     > T -    0    0  -58.1  120.2 -179.6 -142.2  12.4 108.4    0  0.0  210 -2.3    0  0.0    0  0.0  6 30
  208 A1086    PRO P   T T     3 TS+    0    0  -64.3   -1.7 -179.7   58.2  99.8  62.8    0  0.0    0  0.0    0  0.0    0  0.0  4 29
  209 A1087    SER S   T T     3 TS+    0    0 -107.1   -6.7 -179.0   95.8  88.5  62.9    0  0.0    0  0.0    0  0.0    0  0.0  4 23
  210 A1088    ALA A   S t     < TS-    0    0  -83.1  175.7  178.7  -92.7  77.8 100.5  207 -2.3    0  0.0    0  0.0    0  0.0  9 33
  211 A1089    GLY G               -    0    0  -71.8 -173.6 -179.7  -50.6  67.0  91.5  112 -3.3    0  0.0    0  0.0    0  0.0  9 42
  212 A1090    PRO P               -    0    0  -62.5  152.2  177.7 -105.7  58.6  97.9    0  0.0    0  0.0    0  0.0    0  0.0 12 54
  213 A1091    LEU L   E E  Bd     -   90    0  -78.6  129.8  178.0 -137.5  28.9 131.9   89 -2.5   91 -2.3    0  0.0  215 -0.6 12 65
  214 A1092    VAL V   E E  Bdf    -   91  116  -90.7  118.2 -179.7 -172.5  25.7 147.0  115 -1.9  117 -3.5    0  0.0    0  0.0 13 72
  215 A1093    VAL V   E E  Bdf    +   92  117 -114.8  139.2  178.9  160.3  10.8 161.3   91 -3.0   93 -2.6  213 -0.6    0  0.0 15 73
  216 A1094    HIS H   E E  Bdf    +   93  118 -159.4  150.2  176.3  166.3  21.0 171.8  117 -2.2  119 -2.7    0  0.0    0  0.0 18 73
  217 A1095    CYS C   S e        S-    0    0 -125.6 -124.7  178.3  -62.4  70.9  91.8   93 -0.7    0  0.0    0  0.0    0  0.0 18 68
  218 A1096    SER S   S S        S+    0    0  -96.2  -59.1  179.0   13.1 132.0  26.4    0  0.0   95 -2.2    0  0.0    0  0.0 10 65
  219 A1097    ALA A   S S        S-    0    0  -87.8  -29.4  179.6 -121.8 102.2  41.8    0  0.0    0  0.0    0  0.0    0  0.0 12 59
  220 A1098    GLY G   S S        S+    0    0   89.9   39.6 -178.6   80.4  86.4  36.2    0  0.0    0  0.0    0  0.0    0  0.0 17 65
  221 A1099    ALA A   S h >     TS+    0    0 -136.8  -55.5 -177.2   41.1  82.3  52.7    0  0.0  260 -2.2    0  0.0  225 -1.2 18 69
  222 A1100    GLY G   H H >     TS+    0    0  -68.8  -77.8 -178.9   20.0 125.8   3.7    0  0.0  226 -2.0    0  0.0    0  0.0 14 64
  223 A1101    ARG R   H H >     TS+    0    0  -65.9  -29.4  176.6   57.6 125.3  38.3    0  0.0  227 -2.3    0  0.0    0  0.0 14 71
  224 A1102    THR T   H H >     TS+    0    0  -63.5  -46.9  178.4   45.4 109.3  19.9    0  0.0  228 -2.4    0  0.0    0  0.0 16 73
  225 A1103    GLY G   H H X     TS+    0    0  -64.9  -36.3  178.2   54.7 110.5  33.7  221 -1.2  229 -2.7    0  0.0    0  0.0 15 74
  226 A1104    CYS C   H H X     TS+    0    0  -63.1  -49.8  178.5   44.7 110.1  21.4  222 -2.0  230 -2.2    0  0.0    0  0.0 13 74
  227 A1105    PHE F   H H X     TS+    0    0  -57.6  -55.8 -178.7   46.6 116.8  12.4  223 -2.3  231 -2.7    0  0.0    0  0.0  9 76
  228 A1106    ILE I   H H X     TS+    0    0  -55.8  -47.1 -179.9   46.6 113.3  26.1  224 -2.4  232 -2.2    0  0.0    0  0.0 10 76
  229 A1107    VAL V   H H X     TS+    0    0  -64.3  -42.8  179.5   48.5 114.0  24.6  225 -2.7  233 -2.3    0  0.0    0  0.0 12 75
  230 A1108    ILE I   H H X     TS+    0    0  -61.8  -41.7 -179.0   50.4 112.3  23.3  226 -2.2  234 -1.5    0  0.0    0  0.0 11 69
  231 A1109    ASP D   H H X     TS+    0    0  -63.6  -45.2  179.6   43.2 112.9  28.1  227 -2.7  235 -1.0    0  0.0    0  0.0  9 70
  232 A1110    ILE I   H H X     TS+    0    0  -67.0  -45.8 -178.6   53.8 112.8  26.8  228 -2.2  236 -2.0    0  0.0    0  0.0 10 59
  233 A1111    MET M   H H X     TS+    0    0  -64.1  -29.1  177.1   55.1 102.5  40.6  229 -2.3  237 -2.5    0  0.0    0  0.0 14 57
  234 A1112    LEU L   H H X     TS+    0    0  -71.4  -32.4  178.7   52.3 108.6  30.4  230 -1.5  238 -2.4    0  0.0    0  0.0 11 52
  235 A1113    ASP D   H H X     TS+    0    0  -66.2  -45.2  179.1   42.4 112.7  20.0  231 -1.0  239 -2.6    0  0.0    0  0.0  9 40
  236 A1114    MET M   H H X     TS+    0    0  -67.6  -43.7 -179.7   52.4 113.5  25.8  232 -2.0  240 -2.0    0  0.0  242 -0.7 12 38
  237 A1115    ALA A   H H X     TS+    0    0  -58.7  -43.0  179.5   45.8 113.0  23.8  233 -2.5  241 -2.0    0  0.0    0  0.0 12 37
  238 A1116    GLU E   H H <     TS+    0    0  -63.7  -58.3 -177.7   36.8 120.6   7.1  234 -2.4    0  0.0    0  0.0    0  0.0  7 30
  239 A1117    ARG R   H H <     TS+    0    0  -75.3   -7.6 -178.5   15.1 136.4  55.9  235 -2.6    0  0.0    0  0.0    0  0.0  6 22
  240 A1118    GLU E   H H <     TS-    0    0 -143.2   -9.4 -178.5 -122.9  85.6  59.3  236 -2.0    0  0.0    0  0.0    0  0.0  6 24
  241 A1119    GLY G   S h <     TS+    0    0   67.9   20.4 -179.7   99.1  82.8  44.3  237 -2.0    4 -2.6    0  0.0    0  0.0 10 27
  242 A1120    VAL V   E E  AA     -    3    0 -139.6  146.1  176.0 -156.7  56.4 169.7  236 -0.7    0  0.0    0  0.0    0  0.0 10 37
  243 A1121    VAL V   E E  AA     -    2    0 -123.4  139.7  177.8 -174.4   7.3 165.5    2 -2.9    2 -2.7    0  0.0    0  0.0 12 46
  244 A1122    ASP D     h >     T +    0    0 -130.7   67.5 -178.4  157.0  20.7 123.2    0  0.0  248 -1.8    0  0.0    0  0.0  9 48
  245 A1123    ILE I   H H >     T +    0    0  -58.0  -50.0  179.6   56.1  69.8  24.4    0  0.0  249 -2.6    0  0.0    0  0.0 10 59
  246 A1124    TYR Y   H H >     TS+    0    0  -52.4  -50.1 -178.8   41.5 112.0  25.0    0  0.0  250 -2.3    0  0.0    0  0.0  6 51
  247 A1125    ASN N   H H >     TS+    0    0  -70.7  -28.8  177.5   58.3 110.8  32.2    0  0.0  251 -2.7    0  0.0    0  0.0  7 40
  248 A1126    CYS C   H H X     TS+    0    0  -63.0  -50.0  179.8   41.9 110.4  16.3  244 -1.8  252 -2.7    0  0.0    0  0.0 10 58
  249 A1127    VAL V   H H X     TS+    0    0  -63.2  -44.1  179.7   54.0 113.1  21.8  245 -2.6  253 -2.8    0  0.0    0  0.0 12 59
  250 A1128    ARG R   H H X     TS+    0    0  -56.6  -44.0  178.3   46.3 111.4  23.3  246 -2.3  254 -0.7    0  0.0    0  0.0  9 46
  251 A1129    GLU E   H H X   > TS+    0    0  -66.6  -44.1 -179.9   50.9 110.2  26.1  247 -2.7  254 -0.9    0  0.0  255 -0.8  8 49
  252 A1130    LEU L   H H X   > TS+    0    0  -60.3  -40.2  180.0   57.6 106.4  22.8  248 -2.7  256 -2.0    0  0.0  255 -1.3 11 64
  253 A1131    ARG R   H H <   3 TS+    0    0  -62.3  -21.3  178.7   58.9  98.4  43.4  249 -2.8    0  0.0    0  0.0    0  0.0 11 59
  254 A1132    SER S   H H <   < TS+    0    0  -78.0  -22.2 -179.8   45.0 110.3  42.7  251 -0.9    0  0.0  250 -0.7    0  0.0  9 46
  255 A1133    ARG R   H H <   < TS+    0    0  -87.1  -40.5 -178.9    3.6 128.7  32.4  252 -1.3    0  0.0  251 -0.8    0  0.0 12 54
  256 A1134    ARG R   S h <   > TS-    0    0 -150.4  148.6 -179.8  -83.5  86.8 174.8  252 -2.0  259 -0.9    0  0.0    0  0.0 14 66
  257 A1135    VAL V   T T     3 TS-    0    0  -55.9  138.4  174.9  -14.0  95.5 102.5   55 -0.6    0  0.0    0  0.0    0  0.0 15 59
  258 A1136    ASN N   T T     3 TS-    0    0   43.4   33.5  177.7 -175.6  70.5  50.6    0  0.0    0  0.0    0  0.0    0  0.0 12 58
  259 A1137    MET M   S t     < TS+    0    0  -54.8  133.7 -176.7   30.8  75.2 109.9  256 -0.9    0  0.0    0  0.0    0  0.0 14 71
  260 A1138    VAL V   S S        S-    0    0   69.8   79.8 -172.7 -159.9  86.1  16.3  221 -2.2    0  0.0    0  0.0    0  0.0 14 63
  261 A1139    GLN Q               +    0    0  -72.6  -16.5  179.5   35.6  59.3  55.5    0  0.0    0  0.0    0  0.0    0  0.0 11 57
  262 A1140    THR T   S h >     TS-    0    0 -137.7  160.9  179.1 -123.0  73.1 158.3    0  0.0  266 -1.9    0  0.0    0  0.0  7 44
  263 A1141    GLU E   H H >     TS+    0    0  -68.0  -34.3 -179.7   56.7 115.5  32.1    0  0.0  267 -2.3    0  0.0    0  0.0 10 44
  264 A1142    GLU E   H H >     TS+    0    0  -65.3  -36.8  177.1   48.8 106.7  31.8    0  0.0  268 -1.9    0  0.0    0  0.0  8 44
  265 A1143    GLN Q   H H >     TS+    0    0  -66.7  -41.9  179.6   53.6 109.9  23.5    0  0.0  269 -1.6    0  0.0    0  0.0 14 53
  266 A1144    TYR Y   H H X     TS+    0    0  -60.3  -42.9  179.1   44.1 110.8  29.5  262 -1.9  270 -0.9    0  0.0    0  0.0 12 58
  267 A1145    VAL V   H H X     TS+    0    0  -71.4  -34.7  179.0   59.5 108.3  29.5  263 -2.3  271 -2.0    0  0.0    0  0.0  9 55
  268 A1146    PHE F   H H X     TS+    0    0  -59.9  -37.1  179.7   58.1  98.7  33.3  264 -1.9  272 -2.5    0  0.0    0  0.0 11 57
  269 A1147    ILE I   H H X     TS+    0    0  -61.1  -37.3  179.4   47.9 107.6  28.2  265 -1.6  273 -2.1    0  0.0    0  0.0 11 67
  270 A1148    HIS H   H H X     TS+    0    0  -70.8  -41.6  178.9   49.9 110.6  27.9  266 -0.9  274 -2.3    0  0.0    0  0.0 10 67
  271 A1149    ASP D   H H X     TS+    0    0  -63.5  -40.8  179.3   48.8 112.5  26.6  267 -2.0  275 -2.6    0  0.0    0  0.0 10 52
  272 A1150    ALA A   H H X     TS+    0    0  -66.0  -45.5  179.6   44.1 113.5  27.2  268 -2.5  276 -2.4    0  0.0    0  0.0 13 51
  273 A1151    ILE I   H H X     TS+    0    0  -69.5  -36.1  178.0   51.9 113.9  27.5  269 -2.1  277 -2.7    0  0.0    0  0.0 11 59
  274 A1152    LEU L   H H X     TS+    0    0  -64.0  -49.3  178.9   46.5 111.2  19.2  270 -2.3  278 -2.6    0  0.0    0  0.0 11 50
  275 A1153    GLU E   H H <     TS+    0    0  -57.0  -48.6  179.7   50.2 112.7  19.1  271 -2.6    0  0.0    0  0.0    0  0.0  9 39
  276 A1154    ALA A   H H <     TS+    0    0  -56.3  -44.5  179.5   45.5 113.8  24.6  272 -2.4    0  0.0    0  0.0    0  0.0  8 43
  277 A1155    CYS C   H H <     T      0    0  -70.8  -31.1  178.2  999.9 999.9  37.5  273 -2.7    0  0.0    0  0.0    0  0.0  7 41
  278 A1156    LEU L     h <     T      0    0  -81.7  999.9  999.9  999.9 999.9  64.5  274 -2.6    0  0.0    0  0.0    0  0.0  4 29
 
 1rpmA.pdb                                                   
 1RPM  RECEPTOR  MOL_ID: 1;  MOL_ID: 1;  
 
    author                                                                                                        author   
 Kabs/Sand   EETTTHHHHHHHHHHHHHHHHHHHHHTS  S  S  TTTT GGGGGG SSTTS   GGGEEE    TT TTTTEEEEEEEEETTEEEEEEEE    GGG  Kabs/Sand
 chirality   --+++++++++++++--++++++++++--+-++-++++++-++++++-+-+++---+++-------++-+++++-+-------+-+++--+-----+++  chirality
     bends     SSSSSSSSSSSSSSSSSSSSSSSSSS  S  S  SSSS SSSSSS SSSSS   SSS       SS SS S  S      SSSSS         SSS  bends    
     turns    TTTTTTTTTTTTTTTTTTTTTTTTTTT       TTTTTTTTTTTTT TTTT  TTTTT     TTTTTTTTT       TTTTTTT       TTTT  turns    
   5-turns                 >5555<                                                                                 5-turns  
   3-turns    >33<     >>3<<        >>3<<         >33X>3XX3<< >33<  >>3<<     >33X3><3<       >33X33<       >>3<  3-turns  
  bridge-2                                                                               CCCC*C      dddd         bridge-2 
  bridge-1   AA                                                         B*B           B***B      C***CCCC         bridge-1 
    sheets   AA                                                         BBB           BBBBBBBBB  BBBBBBBB         sheets   
   4-turns    >44>X>>XXX<>XX<<<<        >444<               >444<                                      >  4-turns  
   summary   EEeThHHHHHHHHHHHHHHHHHHHHHht  S  S tTTTTgGGGGGGgStTTt  gGGeEEEe  tTTtTTTeEEEEEEEEETTEEEEEEEEe  gGGh  summary  
  sequence  AIRVADLLQHITQMKCAEGYGFKEEYESFFEGQSAPWDSAKKDENRMKNRYGNIIAYDHSRVRLQTIEGDTNSDYINGNYIDGYHRPNHYIATQGPMQET  sequence 
                    10        20        30        40        50        60        70        80        90       100
 
    author                                                                                                        author   
 Kabs/Sand  HHHHHHHHHHTT  EEEE S SEETTEE S   S SSEEEETTEEEEEEEEEEETTEEEEEEEEEETT    EEEEEEEE  S SSS  S SHHHHHHHH  Kabs/Sand
 chirality  ++++++++++-+++---++--++--+-+---++----+----+----++---+-++-------+--++-+---+-----+++--++---+-+++++++++  chirality
     bends  SSSSSSSSSSS        S S SSS   S   S SS    SS           SS          SS              S SSS  S SSSSSSSSS  bends    
     turns  TTTTTTTTTTTTT          TTTT             TTTT         TTTT        TTTT                      TTTTTTTTT  turns    
   5-turns         >5555<                                                                                         5-turns  
   3-turns  <       >33<           >33<             >33<         >33<        >33<                                 3-turns  
  bridge-2                 fff                         IIIII*IIIII  JJJJJJJJ        JJJJJJJJ                      bridge-2 
  bridge-1                eeee    GG  GG         HHHH  HHHH         IIIIIIIIII         eeee                       bridge-1 
    sheets                BBBB    CC  CC         BBBB  BBBBBBBBBBB  BBBBBBBBBB      BBBBBBBB                      sheets   
   4-turns  >>>XXXX<<<<                                                                                >>>>XXXXX  4-turns  
   summary  HHHHHHHHHHhTteEEEEeS eEETTEEeS   S SeEEEETeEEEEEEEEEEETeEEEEEEEEEEeTt   EEEEEEEEe S SSS  S hHHHHHHHH  summary  
  sequence  IYDFWRMVWHENTASIIMVTNLVEVGRVKCCKYWPDDTEIYKDIKVTLIETELLAEYVIRTFAVEKRGVHEIREIRQFHFTGWPDHGVPYHATGLLGFVR  sequence 
                   110       120       130       140       150       160       170       180       190       200
 
    author                                                                                  author   
 Kabs/Sand  HHHHHS TTS  EEEESSSSSHHHHHHHHHHHHHHHHHHHSEE HHHHHHHHHHHSTTSS SHHHHHHHHHHHHHHH   Kabs/Sand
 chirality  +++++--++-----++-+-++++++++++++++++++++-+--++++++++++++---+-+-++++++++++++++    chirality
     bends  SSSSSS SSS      SSSSSSSSSSSSSSSSSSSSSSSSS    SSSSSSSSSSSSSSS SSSSSSSSSSSSSSS    bends    
     turns  TTTTTTTTTT          TTTTTTTTTTTTTTTTTTTTT  TTTTTTTTTTTTTTTT  TTTTTTTTTTTTTTTTT  turns    
   5-turns                                                                                  5-turns  
   3-turns        >33<                                        >>3<<>33<                     3-turns  
  bridge-2               fff                                                                bridge-2 
  bridge-1              dddd                         AA                                     bridge-1 
    sheets              BBBB                         AA                                     sheets   
   4-turns  XX<<<<              >>>>XXXXXXXXXXXXX<<<<  >>>>XXXXX<<<<     >>>>XXXXXXXXX<<<<  4-turns  
   summary  HHHHHhtTTt  EEEEeSSShHHHHHHHHHHHHHHHHHHHhEEhHHHHHHHHHHHhTTtS hHHHHHHHHHHHHHHHh  summary  
  sequence  QVKSKSPPSAGPLVVHCSAGAGRTGCFIVIDIMLDMAEREGVVDIYNCVRELRSRRVNMVQTEEQYVFIHDAILEACL  sequence 
                   210       220       230       240       250       260       270