Secondary structure calculation program - copyright by David Keith Smith, 1989
 1dlfH.pdb                                                   
 1DLF  IMMUNOGLOBULIN  MOL_ID: 1;  MOL_ID: 1;  
 Sequence length -  120
             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 H   1    GLU E                    0    0  999.9  124.0  171.3  999.9 999.9 999.9    0  0.0    0  0.0    0  0.0    0  0.0  5 19
    2 H   2    VAL V               -    0    0  -70.1  124.9  177.0 -176.3 999.9 125.7    0  0.0    0  0.0    0  0.0    0  0.0  8 33
    3 H   3  A LYS K   E E  AA     +   25    0 -129.5  131.1  172.8  172.5  12.3 176.3   25 -2.7   25 -1.9    0  0.0    0  0.0  9 35
    4 H   4    LEU L   E E  AA     -   24    0 -132.8  139.2  177.6 -178.0   4.3 177.8    0  0.0    0  0.0    0  0.0    0  0.0 14 45
    5 H   5    GLU E   E E  AA     -   23    0 -142.8  121.1 -179.4 -154.8  10.3 155.5   23 -1.9   23 -2.4    0  0.0    0  0.0 11 39
    6 H   6    GLU E   E E  AA     +   22    0  -87.1  152.2  169.7  171.3  17.3 122.7    0  0.0    0  0.0    0  0.0    0  0.0 15 46
    7 H   7    SER S   E E  AA     +   21    0 -149.3  163.3  171.6   62.6  43.5 163.0   21 -2.3   21 -2.5    0  0.0    0  0.0  8 38
    8 H   8    GLY G               +    0    0  110.0   -8.6 -178.9  137.9  61.3  70.3    0  0.0    0  0.0    0  0.0    0  0.0  9 39
    9 H   9    GLY G               +    0    0  -67.3  160.6  176.7  116.0  22.7 101.9    0  0.0    0  0.0    0  0.0    0  0.0 12 43
   10 H  10    GLY G     e         -    0    0  168.4 -174.6  176.3  -41.1  61.6 168.7    0  0.0  118 -2.2    0  0.0    0  0.0  8 34
   11 H  11    LEU L   E E  Bb     +  118    0  -78.0  125.8  179.3  171.3  57.7 131.4    0  0.0    0  0.0    0  0.0    0  0.0  8 31
   12 H  12    VAL V   E E  Bb     -  119    0 -139.6  152.7  179.4 -111.1  32.3 166.6  118 -3.0  120 -2.6    0  0.0    0  0.0 11 30
   13 H  13  A GLN Q     t     > T -    0    0  -80.4  138.8  171.0  -94.5  44.5 122.6    0  0.0   16 -2.5    0  0.0    0  0.0  8 24
   14 H  14    PRO P   T T     3 TS+    0    0  -46.8  138.0 -171.9   27.6 118.2 108.8    0  0.0    0  0.0    0  0.0    0  0.0 10 23
   15 H  15    GLY G   T T     3 TS+    0    0   84.2  -16.3 -179.3  118.7 104.7  80.9   88 -3.2   87 -0.7    0  0.0    0  0.0  8 26
   16 H  16    GLY G     t     < T -    0    0  -76.7 -174.6 -172.5 -122.8  57.7  87.9   13 -2.5   88 -2.6    0  0.0    0  0.0  9 29
   17 H  17  A SER S               +    0    0 -135.9  151.2 -176.9  176.8  22.4 157.2    0  0.0    0  0.0    0  0.0    0  0.0 10 35
   18 H  18    MET M   E E  A C    -    0   85 -159.5  135.7  179.7 -144.7  17.3 165.6   85 -2.2   85 -3.2    0  0.0   20 -0.5 10 42
   19 H  19  A LYS K   E E  A C    -    0   84 -110.4  125.5  177.0 -162.8  12.7 159.2    0  0.0    0  0.0    0  0.0    0  0.0 10 46
   20 H  20    LEU L   E E  A C    -    0   83 -103.0  145.3  177.7 -162.3   6.4 144.0   83 -2.9   83 -2.3   18 -0.5    0  0.0 12 54
   21 H  21    SER S   E E  AAC    -    7   82 -123.5  158.9  177.0 -159.1   7.0 153.0    7 -2.5    7 -2.3    0  0.0    0  0.0 11 51
   22 H  22    CYS C   E E  AAC    -    6   81 -142.5  115.6  178.2 -159.6   4.3 162.7   81 -1.8   81 -1.7    0  0.0    0  0.0 12 55
   23 H  23    ALA A   E E  AAC    -    5   80  -93.8  132.5 -177.0 -175.0  20.9 147.1    5 -2.4    5 -1.9    0  0.0    0  0.0 11 47
   24 H  24    THR T   E E  AA     +    4    0 -129.6  157.9  169.6  159.7  15.9 151.8   79 -1.5    0  0.0    0  0.0    0  0.0 10 46
   25 H  25    SER S   E E  AA     +    3    0 -160.7  164.5  172.7   61.6  48.1 164.9    3 -1.9    3 -2.7    0  0.0    0  0.0 10 35
   26 H  26    GLY G   S S        S+    0    0   95.9    7.0  174.1   62.2  92.3  58.3    0  0.0    0  0.0    0  0.0    0  0.0  7 32
   27 H  27    PHE F   S S        S-    0    0 -151.3  168.0  179.9  -81.4  96.9 163.3    0  0.0   29 -1.4    0  0.0    0  0.0  8 38
   28 H  28    THR T     t >   > T -    0    0  -77.8   94.5 -174.8 -175.2  42.6 124.9    0  0.0   31 -1.3    0  0.0   32 -1.0  8 36
   29 H  29    PHE F   T T 4   3 TS+    0    0  -62.1  -33.6 -179.1   65.7  74.6  32.1   27 -1.4    0  0.0    0  0.0    0  0.0  9 44
   30 H  30  A SER S   T T 4   3 TS+    0    0  -59.6  -31.1 -178.0   39.2 108.8  43.6    0  0.0   54 -0.6    0  0.0    0  0.0  8 34
   31 H  31    ASP D   T T 4   < TS+    0    0  -89.0  -23.2 -169.1  109.5  95.7  47.3   28 -1.3    0  0.0    0  0.0    0  0.0  8 38
   32 H  32    ALA A     t <     T -    0    0  -66.2  137.9  162.5 -145.4  59.7 101.0   28 -1.0   34 -0.6    0  0.0    0  0.0 11 52
   33 H  33    TRP W   E E  BD     -  101    0  -91.4  124.8 -172.9 -151.0  30.8 158.3  101 -1.0  101 -3.2    0  0.0    0  0.0 11 52
   34 H  34    MET M   E E  BDE    -  100   51 -108.9  151.6 -167.8 -172.6  15.6 142.1   51 -2.4   51 -2.6   32 -0.6    0  0.0 13 67
   35 H  35    ASP D   E E  BDE    -   99   50 -143.1  151.6  164.0 -144.1  23.5 163.6   99 -3.1   99 -2.1    0  0.0    0  0.0 12 62
   36 H  36    TRP W   E E  BDE    +   98   49 -113.1  134.5  175.3  179.4  21.9 167.9   49 -2.3   48 -2.9    0  0.0   49 -1.6 14 69
   37 H  37    VAL V   E E  BDE    -   97   47 -127.4  140.4  175.6 -156.1  10.4 168.1   97 -2.6   97 -3.5    0  0.0    0  0.0 13 62
   38 H  38    ARG R   E E  BDE    -   96   46 -118.1  154.2  170.6 -145.0  16.9 154.8   46 -2.8   46 -2.8    0  0.0   40 -0.7 13 56
   39 H  39    GLN Q   E E  BDE    -   95   45 -109.8   93.3 -177.5 -173.3  31.5 158.1   95 -2.6   95 -2.3    0  0.0    0  0.0 11 36
   40 H  40    SER S   E E >B E  T -    0   44  -89.8  146.9  178.4 -129.6  32.0 136.8   44 -2.5   44 -2.3   38 -0.7    0  0.0 13 32
   41 H  41    PRO P   T T 4     TS+    0    0  -71.5   -6.3  176.4   45.6 108.6  50.2    0  0.0    0  0.0    0  0.0    0  0.0  7 24
   42 H  42  A GLU E   T T 4     TS+    0    0  -98.3  -39.9 -171.4   15.6 129.2  31.5    0  0.0    0  0.0    0  0.0    0  0.0  5 22
   43 H  43    LYS K   T T 4     TS-    0    0 -111.4  -17.3 -169.5 -140.1  90.4  56.9    0  0.0    0  0.0    0  0.0    0  0.0  7 23
   44 H  44    GLY G   E E >T -    0    0  -75.8  171.1 -178.4  -95.3  43.6 101.3    0  0.0   58 -2.2    0  0.0   56 -1.6 13 37
   54 H  52B   LYS K   G G     >5TS+    0    0  -54.3  -38.5 -178.2   61.3 123.1  29.7   30 -0.6   57 -1.8    0  0.0    0  0.0  8 27
   55 H  52C   ALA A   G G     35TS+    0    0  -67.5  -18.2  171.0   49.6 104.6  48.3    0  0.0    0  0.0    0  0.0    0  0.0  6 18
   56 H  53    ASN N   G G     X5TS-    0    0 -109.3   36.0  171.7  -96.7 128.5 100.3   53 -1.6   59 -1.7    0  0.0    0  0.0  7 21
   57 H  54    ASN N   T g     <5T -    0    0   66.5   22.2 -175.8  -85.3  57.3  49.1   54 -1.8    0  0.0    0  0.0    0  0.0  7 21
   58 H  55    HIS H   T T     3   > T -    0    0  -59.1  140.6  179.5 -115.8  41.9 113.8   48 -2.7   66 -1.7    0  0.0   67 -1.4  9 31
   64 H  61  A GLU E   T T 4   3 TS+    0    0  -50.5  -35.5 -176.1   62.1 112.5  31.9    0  0.0    0  0.0    0  0.0    0  0.0  5 24
   65 H  62    SER S   T T 4   3 TS+    0    0  -70.5  -17.4  179.1   28.9 115.4  48.2    0  0.0    0  0.0    0  0.0    0  0.0  4 32
   66 H  63    VAL V   T T >   X TS+    0    0 -116.3   -8.2 -176.5  126.7  85.8  61.1   63 -1.7   69 -2.5    0  0.0   70 -2.0  9 41
   67 H  64    LYS K   T T <   3 TS+    0    0  -59.1  125.6 -175.2   17.0  80.9 106.3   63 -1.4    0  0.0    0  0.0    0  0.0  8 30
   68 H  65    GLY G   T T 4   3 TS+    0    0   94.3  -19.2  176.7   59.4 124.0  81.9    0  0.0    0  0.0    0  0.0    0  0.0  5 26
   69 H  66    ARG R   T e 4   < TS+    0    0 -106.7  -30.9 -177.0   57.0  98.4  48.0   66 -2.5   86 -1.3    0  0.0    0  0.0  9 33
   70 H  67    PHE F   E E AG  >T -   80    0 -119.0  104.9 -177.6 -172.3  11.9 152.9   80 -3.0   80 -1.9    0  0.0   79 -1.4  8 37
   76 H  73    ASP D   T T 4    5TS+    0    0  -67.3  -34.3  178.3   52.4  84.8  28.9    0  0.0    0  0.0    0  0.0    0  0.0  8 35
   77 H  74    SER S   T T 4    5TS+    0    0  -71.4  -29.1  175.2   35.8 119.8  31.8    0  0.0    0  0.0    0  0.0    0  0.0  4 23
   78 H  75  A LYS K   T T 4    5TS-    0    0  -88.8  -17.8 -170.4 -134.3 104.1  52.7    0  0.0    0  0.0    0  0.0    0  0.0  6 26
   79 H  76    ARG R   T e <    5T +    0    0   54.3   50.8  177.9  134.8  59.7  19.4   75 -1.4   24 -1.5    0  0.0    0  0.0 12 40
   80 H  77    ARG R   E E  ACG  T -    0    0 -120.3  161.8  176.8 -106.4  34.9 144.5    0  0.0   92 -1.9    0  0.0    0  0.0  9 35
   90 H  84    ALA A   G G     > TS+    0    0  -53.9  -39.4  175.1   64.4 119.6  25.2    0  0.0   93 -2.0    0  0.0    0  0.0  8 33
   91 H  85    GLU E   G G     3 TS+    0    0  -50.0  -33.6 -174.0   64.0  91.9  44.0    0  0.0    0  0.0    0  0.0    0  0.0  6 42
   92 H  86    ASP D   G G     < TS+    0    0  -78.0  -11.3  174.7  116.8  72.9  57.4   89 -1.9    0  0.0    0  0.0    0  0.0 10 56
   93 H  87    THR T     g     < T +    0    0  -55.1  133.5  178.9   85.1  48.0 110.6   90 -2.0    0  0.0    0  0.0    0  0.0 12 48
   94 H  88    GLY G   E E  B H   S-    0  117  160.4 -179.5  175.1  -55.9  81.0 155.6  117 -2.7  117 -2.9    0  0.0   96 -0.6 11 45
   95 H  89    ILE I   E E  BDH    -   39  116  -92.9  123.8 -176.7 -150.9  48.5 145.2   39 -2.3   39 -2.6    0  0.0   97 -0.5 11 47
   96 H  90    TYR Y   E E  BDH    -   38  115 -102.5  126.0 -179.2 -172.5  14.0 149.1  115 -3.1  115 -2.0   94 -0.6    0  0.0 14 61
   97 H  91    TYR Y   E E  BD     -   37    0 -114.7  139.5  163.8 -145.7  15.2 158.4   37 -3.5   37 -2.6   95 -0.5    0  0.0 13 54
   98 H  92    CYS C   E E  BD     +   36    0  -99.5  143.1 -177.8  134.0  38.6 143.0    0  0.0  112 -2.0    0  0.0    0  0.0 16 62
   99 H  93    THR T   E E  BD     +   35    0 -159.6 -165.3  179.9  160.3  17.2 144.6   35 -2.1   35 -3.1    0  0.0    0  0.0 14 62
  100 H  94    GLY G   E E  BD     -   34    0  162.1 -161.9 -172.8  -48.0  45.7 169.7    0  0.0  102 -0.6    0  0.0  109 -0.5 14 62
  101 H  95    ILE I   E E  BD    S+   33    0 -114.1  110.4 -178.5  109.1  74.0 155.0   33 -3.2   33 -1.0    0  0.0    0  0.0 12 45
  102 H  96    TYR Y   B B   A > T +  105    0 -166.0 -178.2 -172.7   34.7  48.3 160.7  105 -0.8  105 -1.1  100 -0.6    0  0.0 13 38
  103 H  97    TYR Y   T T     3 TS-    0    0   50.7 -141.8 -169.2  -36.1 116.1 103.8    0  0.0    0  0.0    0  0.0    0  0.0  7 27
  104 H  98    HIS H   T T     3 TS+    0    0  -95.4    2.0 -174.0   74.3 121.4  64.8    0  0.0    0  0.0    0  0.0    0  0.0  4 20
  105 H  99    TYR Y   B B   A < T -  102    0 -123.7  115.2 -176.9 -150.7  65.4 160.4  102 -1.1  107 -1.7    0  0.0  102 -0.8  8 21
  106 H 100    PRO P   S S        S+    0    0  -82.0   48.9  172.7   59.7  77.0  97.8    0  0.0    0  0.0    0  0.0    0  0.0  8 24
  107 H 101    TRP W   S S        S-    0    0 -153.3 -177.2 -174.6  -62.3 109.3 153.8  105 -1.7  109 -2.1    0  0.0    0  0.0  7 27
  108 H 102    PHE F               +    0    0  -77.3   77.2 -175.1  145.4  69.0 117.8    0  0.0    0  0.0    0  0.0    0  0.0  9 36
  109 H 103    ALA A               +    0    0  -86.4  -25.9 -177.4   42.7  62.5  41.5  107 -2.1    0  0.0  100 -0.5    0  0.0  9 30
  110 H 104    TYR Y               +    0    0 -130.1  124.6 -178.3  179.2  67.3 171.7    0  0.0    0  0.0    0  0.0    0  0.0  9 38
  111 H 105    TRP W               -    0    0 -117.0  157.3  168.6 -117.2  26.2 150.4    0  0.0    0  0.0    0  0.0    0  0.0 11 47
  112 H 106    GLY G               -    0    0  -74.7 -172.6  176.4  -91.6  43.5  97.7   98 -2.0    0  0.0    0  0.0    0  0.0 11 42
  113 H 107  A GLN Q               -    0    0  -75.4  -15.0 -177.3 -120.2  66.4  47.0    0  0.0    0  0.0    0  0.0    0  0.0  8 33
  114 H 108    GLY G               -    0    0   85.8  144.6  175.5 -123.6  14.7  81.9    0  0.0    0  0.0    0  0.0    0  0.0 11 45
  115 H 109    THR T   E E  BH     -   96    0 -126.5  132.8 -174.3 -124.2  22.7 176.1   96 -2.0   96 -3.1    0  0.0  117 -0.5 12 43
  116 H 110    LEU L   E E  BH     -   95    0  -84.7  122.6  174.6 -169.1  20.8 132.7    0  0.0  118 -0.5    0  0.0    0  0.0 10 41
  117 H 111    VAL V   E E  BH     -   94    0 -107.5  120.0  178.1 -171.7   5.5 163.0   94 -2.9   94 -2.7  115 -0.5  119 -0.5 13 48
  118 H 112    THR T   E E  Bb     -   11    0 -115.8  114.3  174.3 -161.5   9.3 164.7   10 -2.2   12 -3.0  116 -0.5  120 -0.6 11 37
  119 H 113    VAL V   E E  Bb         12    0  -93.7  116.1 -171.7  999.9 999.9 150.9  117 -0.5    0  0.0    0  0.0    0  0.0 12 34
  120 H 114    SER S     e              0    0  -71.1  999.9  999.9  999.9 999.9 101.4   12 -2.6    0  0.0  118 -0.6    0  0.0  7 23
 
 1dlfH.pdb                                                   
 1DLF  IMMUNOGLOBULIN  MOL_ID: 1;  MOL_ID: 1;  
 
    author                                                                                                        author   
 Kabs/Sand    EEEEE   EE TT  EEEEEEEESS TTT EEEEEEEETTTEEEEEEEE  GGGTT EEE TTTTTTEEEEEETTTTEEEEEE S  GGG EEEEEEE  Kabs/Sand
 chirality   -+--++++-+--++-+------+++--+++----+----++-++-+------++--------++++++--+---++-+-----++---++++----++-  chirality
     bends               SS          SS SSS         SSS S        SSS S     SSSSSS      SSS        S  SSS S        bends    
     turns              TTTT           TTTTT       TTTTT        TTTTTTT   TTTTTTTT    TTTTTT        TTTTT         turns    
   5-turns                                                      >5555<                >5555<                      5-turns  
   3-turns              >33<           >33<                     >>3X<3<   >33X33<                   >>3<<         3-turns  
  bridge-2                   CCCCCC          EEEEEEE        FFF                            GGGGGG        HHH      bridge-2 
  bridge-1    AAAAA   bb        AAAAA       DDDDDDD    EEEE*EEE        FFF       GGGGGG    CCCCCC         DDDDDD  bridge-1 
    sheets    AAAAA   BB     AAAAAAAA       BBBBBBBB   BBBBBBBB        BBB       AAAAAA    AAAAAA        BBBBBBB  sheets   
   4-turns                             >444<       >444<                  >44><44<    >444<                       4-turns  
   summary    EEEEE  eEEtTTt EEEEEEEESStTTTtEEEEEEEETTTEEEEEEEEegGGGgTeEEEeTTTTTeEEEEEETTTeEEEEEEeS gGGGgEEEEEEE  summary  
  sequence  EVKLEESGGGLVQPGGSMKLSCATSGFTFSDAWMDWVRQSPEKGLEWVAEIRNKANNHATYYAESVKGRFTISRDDSKRRVYLQMNTLRAEDTGIYYCTG  sequence 
                    10        20        30        40        50        60        70        80        90       100
 
    author                        author   
 Kabs/Sand  EBTTBSS       EEEEE   Kabs/Sand
 chirality  ++-+-+-+++--------    chirality
     bends  S SS SS               bends    
     turns   TTTT                 turns    
   5-turns                        5-turns  
   3-turns   >33<                 3-turns  
  bridge-2                        bridge-2 
  bridge-1  DA  A         HHHbb   bridge-1 
    sheets  B             BBBBB   sheets   
   4-turns                        4-turns  
   summary  EBTTBSS       EEEEEe  summary  
  sequence  IYYHYPWFAYWGQGTLVTVS  sequence 
                   110       120