tab_phd_sec

PHDsec: secondary structure prediction

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*                                                                          *
*                                                                          *
*  Position-specific reliability index                                     *
*  ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~                                     *
*                                                                          *
*  The network predicts the three secondary structure types using real     *
*  numbers from the output units. The prediction is assigned by choosing   *
*  the maximal unit ("winner takes all").  However, the real numbers       *
*  contain additional information.                                         *
*  E.g. the difference between the maximal and the second largest output   *
*  unit can be used to derive a "reliability index".  This index is given  *
*  for each residue along with the prediction.  The index is scaled to     *
*  have values between 0 (lowest reliability), and 9 (highest).            *
*  The accuracies (Qtot) to be expected for residues with values above a   *
*  particular value of the index are given below as well as the fraction   *
*  of such residues (%res).:                                               *
*                                                                          *
*  +------+-----+-----+-----+-----+-----+-----+-----+-----+-----+-----+    *
*  | index|  0  |  1  |  2  |  3  |  4  |  5  |  6  |  7  |  8  |  9  |    *
*  | %res |100.0| 99.2| 90.4| 80.9| 71.6| 62.5| 52.8| 42.3| 29.8| 14.1|    *
*  +------+-----+-----+-----+-----+-----+-----+-----+-----+-----+-----+    *
*  |      |     |     |     |     |     |     |     |     |     |     |    *
*  | Qtot | 72.1| 72.3| 74.8| 77.7| 80.3| 82.9| 85.7| 88.5| 91.1| 94.2|    *
*  |      |     |     |     |     |     |     |     |     |     |     |    *
*  +------+-----+-----+-----+-----+-----+-----+-----+-----+-----+-----+    *
*  | H%obs| 70.4| 70.6| 73.7| 77.1| 80.1| 83.1| 86.0| 89.3| 92.5| 96.4|    *
*  | E%obs| 61.5| 61.7| 63.7| 66.6| 69.1| 71.7| 74.6| 77.0| 77.8| 68.1|    *
*  |      |     |     |     |     |     |     |     |     |     |     |    *
*  | H%prd| 77.8| 78.0| 80.0| 82.6| 84.7| 86.9| 89.2| 91.3| 93.1| 95.4|    *
*  | E%prd| 64.5| 64.7| 67.8| 71.0| 74.2| 77.6| 81.4| 85.1| 89.8| 93.5|    *
*  +------+-----+-----+-----+-----+-----+-----+-----+-----+-----+-----+    *
*                                                                          *
*  The above table gives the cumulative results, e.g. 62.5% of all         *
*  residues have a reliability of at least 5.  The overall three-state     *
*  accuracy for this subset of almost two thirds of all residues is 82.9%. *
*  For this subset, e.g., 83.1% of the observed helices are correctly      *
*  predicted, and 86.9% of all residues predicted to be in helix are       *
*  correct.                                                                *
*                                                                          *
*..........................................................................*
*                                                                          *
*  The following table gives the non-cumulative quantities, i.e. the       *
*  values per reliability index range.  These numbers answer the question: *
*  how reliable is the prediction for all residues labeled with the        *
*  particular index i.                                                     *
*                                                                          *
*  +------+-----+-----+-----+-----+-----+-----+-----+-----+-----+          *
*  | index|  1  |  2  |  3  |  4  |  5  |  6  |  7  |  8  |  9  |          *
*  | %res |  8.8|  9.5|  9.3|  9.1|  9.7| 10.5| 12.5| 15.7| 14.1|          *
*  +------+-----+-----+-----+-----+-----+-----+-----+-----+-----+          *
*  |      |     |     |     |     |     |     |     |     |     |          *
*  | Qtot | 46.6| 50.6| 57.7| 62.6| 67.9| 74.2| 82.2| 88.3| 94.2|          *
*  |      |     |     |     |     |     |     |     |     |     |          *
*  +------+-----+-----+-----+-----+-----+-----+-----+-----+-----+          *
*  | H%obs| 36.8| 42.3| 49.5| 55.2| 61.7| 69.9| 78.8| 87.4| 96.4|          *
*  | E%obs| 44.7| 44.5| 52.1| 55.4| 60.9| 68.0| 75.9| 81.0| 68.1|          *
*  |      |     |     |     |     |     |     |     |     |     |          *
*  | H%prd| 49.9| 52.5| 60.3| 64.2| 69.2| 77.5| 85.4| 89.9| 95.4|          *
*  | E%prd| 41.7| 47.1| 53.6| 57.0| 64.0| 71.6| 78.8| 88.8| 93.5|          *
*  +------+-----+-----+-----+-----+-----+-----+-----+-----+-----+          *
*                                                                          *
*  For example, for residues with Relindex = 5 64% of all predicted betha- *
*  strand residues are correctly identified.                               *
*                                                                          *
*                                                                          *
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