# created by  ASDP Version 1.0 Copyright(C) 2010
# Fri May 10 19:01:19 2013


# Command: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign 
#		-c /data/PSVS/PSVS-v1.4-dev/results/SR478_NMR_em_bcr3/rpf_calc/input/ctrl_file 
#		-o rpf_calc 
#		-q SR478_NMR_em_bcr3.pdb.iupac 


# Summary for n.peaks
Total simulated peaks: 95 Number of peaks NOT matched in the Peak List: 21
M score = 0.22

Average shift in HX: -0.00033 Average ab-shift in HX: 0.0031(Assignment used: 47)
Average shift in X: -0.0042 Average ab-shift in X: 0.029(Assignment used: 47)
Average shift in HX2: -0.011 Average ab-shift in HX2: 0.019(Assignment used: 64)

#For peaklist n.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.316(262/830) 
Model   1 Inconsistent score: 0.307(255/830) 
Model   2 Inconsistent score: 0.322(267/830) 
Model   3 Inconsistent score: 0.316(262/830) 
Model   4 Inconsistent score: 0.306(254/830) 
Model   5 Inconsistent score: 0.308(256/830) 
Model   6 Inconsistent score: 0.313(260/830) 
Model   7 Inconsistent score: 0.308(256/830) 
Model   8 Inconsistent score: 0.3(249/830) 
Model   9 Inconsistent score: 0.317(263/830) 
Model  10 Inconsistent score: 0.298(247/830) 
Model  11 Inconsistent score: 0.314(261/830) 
Model  12 Inconsistent score: 0.322(267/830) 
Model  13 Inconsistent score: 0.308(256/830) 
Model  14 Inconsistent score: 0.308(256/830) 
Model  15 Inconsistent score: 0.312(259/830) 
Model  16 Inconsistent score: 0.308(256/830) 
Model  17 Inconsistent score: 0.313(260/830) 
Model  18 Inconsistent score: 0.301(250/830) 
Model  19 Inconsistent score: 0.314(261/830) 
Model  20 Inconsistent score: 0.306(254/830) 
Model ave  Missing interactions: 0.296 (253/855)
              weighted: 0.174 (3.11e+05/1.79e+06)
                    <3: 0.179 (17/95)
                   <3w: 0.195 (7.24e+04/3.72e+05)
Model   1  Missing interactions: 0.307 (271/883)
              weighted: 0.167 (3.57e+05/2.14e+06)
                    <3: 0.177 (17/96)
                   <3w: 0.155 (6.31e+04/4.07e+05)
Model   2  Missing interactions: 0.298 (254/852)
              weighted: 0.194 (3.93e+05/2.02e+06)
                    <3: 0.183 (17/93)
                   <3w: 0.159 (7.19e+04/4.51e+05)
Model   3  Missing interactions: 0.301 (261/867)
              weighted: 0.167 (3.55e+05/2.12e+06)
                    <3: 0.179 (17/95)
                   <3w: 0.155 (6.58e+04/4.24e+05)
Model   4  Missing interactions: 0.297 (259/872)
              weighted: 0.158 (3.22e+05/2.04e+06)
                    <3: 0.181 (17/94)
                   <3w: 0.157 (6.34e+04/4.04e+05)
Model   5  Missing interactions: 0.296 (256/864)
              weighted: 0.168 (3.38e+05/2.01e+06)
                    <3: 0.179 (17/95)
                   <3w: 0.17 (6.38e+04/3.76e+05)
Model   6  Missing interactions: 0.314 (274/873)
              weighted: 0.179 (3.8e+05/2.12e+06)
                    <3: 0.183 (17/93)
                   <3w: 0.149 (6.14e+04/4.11e+05)
Model   7  Missing interactions: 0.303 (265/874)
              weighted: 0.183 (3.86e+05/2.11e+06)
                    <3: 0.183 (17/93)
                   <3w: 0.181 (7.17e+04/3.97e+05)
Model   8  Missing interactions: 0.312 (282/905)
              weighted: 0.185 (3.94e+05/2.12e+06)
                    <3: 0.177 (17/96)
                   <3w: 0.158 (6.42e+04/4.06e+05)
Model   9  Missing interactions: 0.297 (255/860)
              weighted: 0.168 (3.45e+05/2.05e+06)
                    <3: 0.185 (17/92)
                   <3w: 0.158 (6.39e+04/4.04e+05)
Model  10  Missing interactions: 0.307 (271/883)
              weighted: 0.179 (3.94e+05/2.2e+06)
                    <3: 0.177 (17/96)
                   <3w: 0.174 (6.51e+04/3.74e+05)
Model  11  Missing interactions: 0.301 (258/858)
              weighted: 0.194 (3.76e+05/1.94e+06)
                    <3: 0.179 (17/95)
                   <3w: 0.168 (6.2e+04/3.69e+05)
Model  12  Missing interactions: 0.302 (256/848)
              weighted: 0.164 (3.42e+05/2.09e+06)
                    <3: 0.183 (17/93)
                   <3w: 0.152 (6.11e+04/4.02e+05)
Model  13  Missing interactions: 0.311 (275/883)
              weighted: 0.173 (3.85e+05/2.22e+06)
                    <3: 0.175 (17/97)
                   <3w: 0.179 (7.4e+04/4.15e+05)
Model  14  Missing interactions: 0.315 (280/889)
              weighted: 0.181 (3.84e+05/2.12e+06)
                    <3: 0.179 (17/95)
                   <3w: 0.157 (6.36e+04/4.04e+05)
Model  15  Missing interactions: 0.298 (256/860)
              weighted: 0.171 (3.52e+05/2.06e+06)
                    <3: 0.181 (17/94)
                   <3w: 0.153 (6.3e+04/4.11e+05)
Model  16  Missing interactions: 0.314 (276/879)
              weighted: 0.188 (3.87e+05/2.06e+06)
                    <3: 0.185 (17/92)
                   <3w: 0.203 (8.23e+04/4.05e+05)
Model  17  Missing interactions: 0.299 (257/860)
              weighted: 0.152 (3.14e+05/2.06e+06)
                    <3: 0.177 (17/96)
                   <3w: 0.154 (6.3e+04/4.1e+05)
Model  18  Missing interactions: 0.303 (268/884)
              weighted: 0.167 (3.64e+05/2.17e+06)
                    <3: 0.185 (17/92)
                   <3w: 0.155 (6.53e+04/4.21e+05)
Model  19  Missing interactions: 0.308 (269/872)
              weighted: 0.19 (4.06e+05/2.14e+06)
                    <3: 0.179 (17/95)
                   <3w: 0.169 (6.42e+04/3.79e+05)
Model  20  Missing interactions: 0.305 (269/881)
              weighted: 0.181 (3.71e+05/2.05e+06)
                    <3: 0.177 (17/96)
                   <3w: 0.174 (6.32e+04/3.63e+05)

Model ave
 Recall: 0.684
 Precision: 
       all: 0.704  allw: 0.826
        <3: 0.821  <3w: 0.805

 F-measure:(Recall,Precision)  0.694
 F-measure:(Recall,PrecisionW) 0.748

 F-measure:(0,PrecisionIdeal)  0.902
 F-measure:(0,PrecisionIdealW) 0.892

Model 1
 Recall: 0.693
 Precision: 
       all: 0.693  allw: 0.833
        <3: 0.823  <3w: 0.845

 F-measure:(Recall,Precision)  0.693
 F-measure:(Recall,PrecisionW) 0.756

 F-measure:(0,PrecisionIdeal)  0.903
 F-measure:(0,PrecisionIdealW) 0.916

Model 2
 Recall: 0.678
 Precision: 
       all: 0.702  allw: 0.806
        <3: 0.817  <3w: 0.841

 F-measure:(Recall,Precision)  0.69
 F-measure:(Recall,PrecisionW) 0.736

 F-measure:(0,PrecisionIdeal)  0.899
 F-measure:(0,PrecisionIdealW) 0.913

Model 3
 Recall: 0.684
 Precision: 
       all: 0.699  allw: 0.833
        <3: 0.821  <3w: 0.845

 F-measure:(Recall,Precision)  0.692
 F-measure:(Recall,PrecisionW) 0.751

 F-measure:(0,PrecisionIdeal)  0.902
 F-measure:(0,PrecisionIdealW) 0.916

Model 4
 Recall: 0.694
 Precision: 
       all: 0.703  allw: 0.842
        <3: 0.819  <3w: 0.843

 F-measure:(Recall,Precision)  0.698
 F-measure:(Recall,PrecisionW) 0.761

 F-measure:(0,PrecisionIdeal)  0.901
 F-measure:(0,PrecisionIdealW) 0.915

Model 5
 Recall: 0.692
 Precision: 
       all: 0.704  allw: 0.832
        <3: 0.821  <3w: 0.83

 F-measure:(Recall,Precision)  0.698
 F-measure:(Recall,PrecisionW) 0.755

 F-measure:(0,PrecisionIdeal)  0.902
 F-measure:(0,PrecisionIdealW) 0.907

Model 6
 Recall: 0.687
 Precision: 
       all: 0.686  allw: 0.821
        <3: 0.817  <3w: 0.851

 F-measure:(Recall,Precision)  0.686
 F-measure:(Recall,PrecisionW) 0.748

 F-measure:(0,PrecisionIdeal)  0.899
 F-measure:(0,PrecisionIdealW) 0.919

Model 7
 Recall: 0.692
 Precision: 
       all: 0.697  allw: 0.817
        <3: 0.817  <3w: 0.819

 F-measure:(Recall,Precision)  0.694
 F-measure:(Recall,PrecisionW) 0.749

 F-measure:(0,PrecisionIdeal)  0.899
 F-measure:(0,PrecisionIdealW) 0.901

Model 8
 Recall: 0.7
 Precision: 
       all: 0.688  allw: 0.815
        <3: 0.823  <3w: 0.842

 F-measure:(Recall,Precision)  0.694
 F-measure:(Recall,PrecisionW) 0.753

 F-measure:(0,PrecisionIdeal)  0.903
 F-measure:(0,PrecisionIdealW) 0.914

Model 9
 Recall: 0.683
 Precision: 
       all: 0.703  allw: 0.832
        <3: 0.815  <3w: 0.842

 F-measure:(Recall,Precision)  0.693
 F-measure:(Recall,PrecisionW) 0.75

 F-measure:(0,PrecisionIdeal)  0.898
 F-measure:(0,PrecisionIdealW) 0.914

Model 10
 Recall: 0.702
 Precision: 
       all: 0.693  allw: 0.821
        <3: 0.823  <3w: 0.826

 F-measure:(Recall,Precision)  0.698
 F-measure:(Recall,PrecisionW) 0.757

 F-measure:(0,PrecisionIdeal)  0.903
 F-measure:(0,PrecisionIdealW) 0.905

Model 11
 Recall: 0.686
 Precision: 
       all: 0.699  allw: 0.806
        <3: 0.821  <3w: 0.832

 F-measure:(Recall,Precision)  0.692
 F-measure:(Recall,PrecisionW) 0.741

 F-measure:(0,PrecisionIdeal)  0.902
 F-measure:(0,PrecisionIdealW) 0.908

Model 12
 Recall: 0.678
 Precision: 
       all: 0.698  allw: 0.836
        <3: 0.817  <3w: 0.848

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.749

 F-measure:(0,PrecisionIdeal)  0.899
 F-measure:(0,PrecisionIdealW) 0.918

Model 13
 Recall: 0.692
 Precision: 
       all: 0.689  allw: 0.827
        <3: 0.825  <3w: 0.821

 F-measure:(Recall,Precision)  0.69
 F-measure:(Recall,PrecisionW) 0.753

 F-measure:(0,PrecisionIdeal)  0.904
 F-measure:(0,PrecisionIdealW) 0.902

Model 14
 Recall: 0.692
 Precision: 
       all: 0.685  allw: 0.819
        <3: 0.821  <3w: 0.843

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.75

 F-measure:(0,PrecisionIdeal)  0.902
 F-measure:(0,PrecisionIdealW) 0.915

Model 15
 Recall: 0.688
 Precision: 
       all: 0.702  allw: 0.829
        <3: 0.819  <3w: 0.847

 F-measure:(Recall,Precision)  0.695
 F-measure:(Recall,PrecisionW) 0.752

 F-measure:(0,PrecisionIdeal)  0.901
 F-measure:(0,PrecisionIdealW) 0.917

Model 16
 Recall: 0.692
 Precision: 
       all: 0.686  allw: 0.812
        <3: 0.815  <3w: 0.797

 F-measure:(Recall,Precision)  0.689
 F-measure:(Recall,PrecisionW) 0.747

 F-measure:(0,PrecisionIdeal)  0.898
 F-measure:(0,PrecisionIdealW) 0.887

Model 17
 Recall: 0.687
 Precision: 
       all: 0.701  allw: 0.848
        <3: 0.823  <3w: 0.846

 F-measure:(Recall,Precision)  0.694
 F-measure:(Recall,PrecisionW) 0.759

 F-measure:(0,PrecisionIdeal)  0.903
 F-measure:(0,PrecisionIdealW) 0.917

Model 18
 Recall: 0.699
 Precision: 
       all: 0.697  allw: 0.833
        <3: 0.815  <3w: 0.845

 F-measure:(Recall,Precision)  0.698
 F-measure:(Recall,PrecisionW) 0.76

 F-measure:(0,PrecisionIdeal)  0.898
 F-measure:(0,PrecisionIdealW) 0.916

Model 19
 Recall: 0.686
 Precision: 
       all: 0.692  allw: 0.81
        <3: 0.821  <3w: 0.831

 F-measure:(Recall,Precision)  0.689
 F-measure:(Recall,PrecisionW) 0.743

 F-measure:(0,PrecisionIdeal)  0.902
 F-measure:(0,PrecisionIdealW) 0.908

Model 20
 Recall: 0.694
 Precision: 
       all: 0.695  allw: 0.819
        <3: 0.823  <3w: 0.826

 F-measure:(Recall,Precision)  0.694
 F-measure:(Recall,PrecisionW) 0.751

 F-measure:(0,PrecisionIdeal)  0.903
 F-measure:(0,PrecisionIdealW) 0.905

For freely-rotating-chain model:
Model ave Inconsistent score: 0.522(433/830) 
Model ave  Missing interactions: 0.244 (120/492)
              weighted: 0.234 (6.2e+04/2.65e+05)
                    <3: 0.183 (17/93)
                   <3w: 0.241 (3.16e+04/1.31e+05)

 Recall: 0.478
 Precision: 
       all: 0.756  allw: 0.766

 F-measure:(RecallFree,PrecisionFree)  0.586
 F-measure:(ReallFree,PrecisionFreeW) 0.589

# Summary for c_aro.peaks
Total simulated peaks: 7 Number of peaks NOT matched in the Peak List: 6
M score = 0.86

Average shift in HX: 0 Average ab-shift in HX: 0(Assignment used: 1)
Average shift in X: 0 Average ab-shift in X: 0(Assignment used: 1)
Average shift in HX2: 0 Average ab-shift in HX2: 0(Assignment used: 1)
Input error: M-score > 0.5

# Summary for c_ali.peaks
Total simulated peaks: 419 Number of peaks NOT matched in the Peak List: 189
M score = 0.45

Average shift in HX: -0.0055 Average ab-shift in HX: 0.013(Assignment used: 125)
Average shift in X: -0.013 Average ab-shift in X: 0.12(Assignment used: 118)
Average shift in HX2: -0.0039 Average ab-shift in HX2: 0.015(Assignment used: 147)

#For peaklist c_ali.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.263(289/1098) 
Model   1 Inconsistent score: 0.263(289/1098) 
Model   2 Inconsistent score: 0.266(292/1098) 
Model   3 Inconsistent score: 0.258(283/1098) 
Model   4 Inconsistent score: 0.26(285/1098) 
Model   5 Inconsistent score: 0.264(290/1098) 
Model   6 Inconsistent score: 0.257(282/1098) 
Model   7 Inconsistent score: 0.265(291/1098) 
Model   8 Inconsistent score: 0.264(290/1098) 
Model   9 Inconsistent score: 0.267(293/1098) 
Model  10 Inconsistent score: 0.258(283/1098) 
Model  11 Inconsistent score: 0.263(289/1098) 
Model  12 Inconsistent score: 0.267(293/1098) 
Model  13 Inconsistent score: 0.26(286/1098) 
Model  14 Inconsistent score: 0.266(292/1098) 
Model  15 Inconsistent score: 0.266(292/1098) 
Model  16 Inconsistent score: 0.261(287/1098) 
Model  17 Inconsistent score: 0.268(294/1098) 
Model  18 Inconsistent score: 0.259(284/1098) 
Model  19 Inconsistent score: 0.257(282/1098) 
Model  20 Inconsistent score: 0.26(286/1098) 
Model ave  Missing interactions: 0.582 (1.2e+03/2059)
              weighted: 0.414 (2e+06/4.82e+06)
                    <3: 0.354 (113/319)
                   <3w: 0.356 (9.58e+05/2.69e+06)
Model   1  Missing interactions: 0.6 (1.29e+03/2151)
              weighted: 0.441 (2.52e+06/5.72e+06)
                    <3: 0.353 (113/320)
                   <3w: 0.348 (9.93e+05/2.85e+06)
Model   2  Missing interactions: 0.585 (1.21e+03/2075)
              weighted: 0.413 (2.22e+06/5.37e+06)
                    <3: 0.356 (113/317)
                   <3w: 0.334 (9.68e+05/2.9e+06)
Model   3  Missing interactions: 0.596 (1.27e+03/2130)
              weighted: 0.425 (2.39e+06/5.62e+06)
                    <3: 0.354 (113/319)
                   <3w: 0.34 (9.67e+05/2.85e+06)
Model   4  Missing interactions: 0.598 (1.29e+03/2157)
              weighted: 0.425 (2.37e+06/5.58e+06)
                    <3: 0.355 (113/318)
                   <3w: 0.346 (9.77e+05/2.82e+06)
Model   5  Missing interactions: 0.592 (1.26e+03/2125)
              weighted: 0.427 (2.34e+06/5.48e+06)
                    <3: 0.354 (113/319)
                   <3w: 0.349 (9.7e+05/2.78e+06)
Model   6  Missing interactions: 0.591 (1.25e+03/2120)
              weighted: 0.427 (2.39e+06/5.59e+06)
                    <3: 0.356 (113/317)
                   <3w: 0.344 (9.6e+05/2.79e+06)
Model   7  Missing interactions: 0.597 (1.3e+03/2178)
              weighted: 0.444 (2.47e+06/5.57e+06)
                    <3: 0.356 (113/317)
                   <3w: 0.349 (9.7e+05/2.78e+06)
Model   8  Missing interactions: 0.6 (1.31e+03/2183)
              weighted: 0.439 (2.47e+06/5.62e+06)
                    <3: 0.353 (113/320)
                   <3w: 0.345 (9.65e+05/2.8e+06)
Model   9  Missing interactions: 0.596 (1.26e+03/2115)
              weighted: 0.43 (2.36e+06/5.5e+06)
                    <3: 0.358 (113/316)
                   <3w: 0.347 (9.78e+05/2.82e+06)
Model  10  Missing interactions: 0.598 (1.32e+03/2217)
              weighted: 0.446 (2.54e+06/5.69e+06)
                    <3: 0.353 (113/320)
                   <3w: 0.345 (9.52e+05/2.76e+06)
Model  11  Missing interactions: 0.589 (1.23e+03/2083)
              weighted: 0.424 (2.27e+06/5.35e+06)
                    <3: 0.354 (113/319)
                   <3w: 0.345 (9.67e+05/2.8e+06)
Model  12  Missing interactions: 0.589 (1.22e+03/2077)
              weighted: 0.431 (2.37e+06/5.5e+06)
                    <3: 0.356 (113/317)
                   <3w: 0.346 (9.74e+05/2.81e+06)
Model  13  Missing interactions: 0.598 (1.3e+03/2174)
              weighted: 0.419 (2.4e+06/5.72e+06)
                    <3: 0.352 (113/321)
                   <3w: 0.339 (9.74e+05/2.87e+06)
Model  14  Missing interactions: 0.595 (1.27e+03/2131)
              weighted: 0.421 (2.35e+06/5.58e+06)
                    <3: 0.354 (113/319)
                   <3w: 0.348 (9.93e+05/2.85e+06)
Model  15  Missing interactions: 0.593 (1.24e+03/2101)
              weighted: 0.422 (2.34e+06/5.54e+06)
                    <3: 0.355 (113/318)
                   <3w: 0.348 (9.84e+05/2.82e+06)
Model  16  Missing interactions: 0.592 (1.26e+03/2121)
              weighted: 0.433 (2.36e+06/5.45e+06)
                    <3: 0.358 (113/316)
                   <3w: 0.347 (9.65e+05/2.79e+06)
Model  17  Missing interactions: 0.596 (1.25e+03/2097)
              weighted: 0.43 (2.34e+06/5.44e+06)
                    <3: 0.353 (113/320)
                   <3w: 0.346 (9.74e+05/2.81e+06)
Model  18  Missing interactions: 0.596 (1.3e+03/2178)
              weighted: 0.432 (2.45e+06/5.67e+06)
                    <3: 0.358 (113/316)
                   <3w: 0.34 (9.6e+05/2.82e+06)
Model  19  Missing interactions: 0.59 (1.27e+03/2158)
              weighted: 0.425 (2.42e+06/5.69e+06)
                    <3: 0.354 (113/319)
                   <3w: 0.347 (9.69e+05/2.79e+06)
Model  20  Missing interactions: 0.594 (1.27e+03/2140)
              weighted: 0.432 (2.4e+06/5.56e+06)
                    <3: 0.353 (113/320)
                   <3w: 0.344 (9.67e+05/2.81e+06)

Model ave
 Recall: 0.737
 Precision: 
       all: 0.418  allw: 0.586
        <3: 0.646  <3w: 0.644

 F-measure:(Recall,Precision)  0.534
 F-measure:(Recall,PrecisionW) 0.653

 F-measure:(0,PrecisionIdeal)  0.785
 F-measure:(0,PrecisionIdealW) 0.784

Model 1
 Recall: 0.737
 Precision: 
       all: 0.4  allw: 0.559
        <3: 0.647  <3w: 0.652

 F-measure:(Recall,Precision)  0.519
 F-measure:(Recall,PrecisionW) 0.636

 F-measure:(0,PrecisionIdeal)  0.786
 F-measure:(0,PrecisionIdealW) 0.789

Model 2
 Recall: 0.734
 Precision: 
       all: 0.415  allw: 0.587
        <3: 0.644  <3w: 0.666

 F-measure:(Recall,Precision)  0.531
 F-measure:(Recall,PrecisionW) 0.652

 F-measure:(0,PrecisionIdeal)  0.783
 F-measure:(0,PrecisionIdealW) 0.799

Model 3
 Recall: 0.742
 Precision: 
       all: 0.404  allw: 0.575
        <3: 0.646  <3w: 0.66

 F-measure:(Recall,Precision)  0.523
 F-measure:(Recall,PrecisionW) 0.648

 F-measure:(0,PrecisionIdeal)  0.785
 F-measure:(0,PrecisionIdealW) 0.795

Model 4
 Recall: 0.74
 Precision: 
       all: 0.402  allw: 0.575
        <3: 0.645  <3w: 0.654

 F-measure:(Recall,Precision)  0.521
 F-measure:(Recall,PrecisionW) 0.648

 F-measure:(0,PrecisionIdeal)  0.784
 F-measure:(0,PrecisionIdealW) 0.791

Model 5
 Recall: 0.736
 Precision: 
       all: 0.408  allw: 0.573
        <3: 0.646  <3w: 0.651

 F-measure:(Recall,Precision)  0.525
 F-measure:(Recall,PrecisionW) 0.644

 F-measure:(0,PrecisionIdeal)  0.785
 F-measure:(0,PrecisionIdealW) 0.789

Model 6
 Recall: 0.743
 Precision: 
       all: 0.409  allw: 0.573
        <3: 0.644  <3w: 0.656

 F-measure:(Recall,Precision)  0.528
 F-measure:(Recall,PrecisionW) 0.647

 F-measure:(0,PrecisionIdeal)  0.783
 F-measure:(0,PrecisionIdealW) 0.792

Model 7
 Recall: 0.735
 Precision: 
       all: 0.403  allw: 0.556
        <3: 0.644  <3w: 0.651

 F-measure:(Recall,Precision)  0.521
 F-measure:(Recall,PrecisionW) 0.633

 F-measure:(0,PrecisionIdeal)  0.783
 F-measure:(0,PrecisionIdealW) 0.788

Model 8
 Recall: 0.736
 Precision: 
       all: 0.4  allw: 0.561
        <3: 0.647  <3w: 0.655

 F-measure:(Recall,Precision)  0.518
 F-measure:(Recall,PrecisionW) 0.636

 F-measure:(0,PrecisionIdeal)  0.786
 F-measure:(0,PrecisionIdealW) 0.792

Model 9
 Recall: 0.733
 Precision: 
       all: 0.404  allw: 0.57
        <3: 0.642  <3w: 0.653

 F-measure:(Recall,Precision)  0.521
 F-measure:(Recall,PrecisionW) 0.642

 F-measure:(0,PrecisionIdeal)  0.782
 F-measure:(0,PrecisionIdealW) 0.79

Model 10
 Recall: 0.742
 Precision: 
       all: 0.402  allw: 0.554
        <3: 0.647  <3w: 0.655

 F-measure:(Recall,Precision)  0.522
 F-measure:(Recall,PrecisionW) 0.635

 F-measure:(0,PrecisionIdeal)  0.786
 F-measure:(0,PrecisionIdealW) 0.791

Model 11
 Recall: 0.737
 Precision: 
       all: 0.411  allw: 0.576
        <3: 0.646  <3w: 0.655

 F-measure:(Recall,Precision)  0.528
 F-measure:(Recall,PrecisionW) 0.646

 F-measure:(0,PrecisionIdeal)  0.785
 F-measure:(0,PrecisionIdealW) 0.791

Model 12
 Recall: 0.733
 Precision: 
       all: 0.411  allw: 0.569
        <3: 0.644  <3w: 0.654

 F-measure:(Recall,Precision)  0.527
 F-measure:(Recall,PrecisionW) 0.64

 F-measure:(0,PrecisionIdeal)  0.783
 F-measure:(0,PrecisionIdealW) 0.791

Model 13
 Recall: 0.74
 Precision: 
       all: 0.402  allw: 0.581
        <3: 0.648  <3w: 0.661

 F-measure:(Recall,Precision)  0.52
 F-measure:(Recall,PrecisionW) 0.651

 F-measure:(0,PrecisionIdeal)  0.786
 F-measure:(0,PrecisionIdealW) 0.796

Model 14
 Recall: 0.734
 Precision: 
       all: 0.405  allw: 0.579
        <3: 0.646  <3w: 0.652

 F-measure:(Recall,Precision)  0.522
 F-measure:(Recall,PrecisionW) 0.647

 F-measure:(0,PrecisionIdeal)  0.785
 F-measure:(0,PrecisionIdealW) 0.789

Model 15
 Recall: 0.734
 Precision: 
       all: 0.407  allw: 0.578
        <3: 0.645  <3w: 0.652

 F-measure:(Recall,Precision)  0.524
 F-measure:(Recall,PrecisionW) 0.647

 F-measure:(0,PrecisionIdeal)  0.784
 F-measure:(0,PrecisionIdealW) 0.789

Model 16
 Recall: 0.739
 Precision: 
       all: 0.408  allw: 0.567
        <3: 0.642  <3w: 0.653

 F-measure:(Recall,Precision)  0.525
 F-measure:(Recall,PrecisionW) 0.642

 F-measure:(0,PrecisionIdeal)  0.782
 F-measure:(0,PrecisionIdealW) 0.79

Model 17
 Recall: 0.732
 Precision: 
       all: 0.404  allw: 0.57
        <3: 0.647  <3w: 0.654

 F-measure:(Recall,Precision)  0.521
 F-measure:(Recall,PrecisionW) 0.641

 F-measure:(0,PrecisionIdeal)  0.786
 F-measure:(0,PrecisionIdealW) 0.791

Model 18
 Recall: 0.741
 Precision: 
       all: 0.404  allw: 0.568
        <3: 0.642  <3w: 0.66

 F-measure:(Recall,Precision)  0.523
 F-measure:(Recall,PrecisionW) 0.643

 F-measure:(0,PrecisionIdeal)  0.782
 F-measure:(0,PrecisionIdealW) 0.795

Model 19
 Recall: 0.743
 Precision: 
       all: 0.41  allw: 0.575
        <3: 0.646  <3w: 0.653

 F-measure:(Recall,Precision)  0.528
 F-measure:(Recall,PrecisionW) 0.648

 F-measure:(0,PrecisionIdeal)  0.785
 F-measure:(0,PrecisionIdealW) 0.79

Model 20
 Recall: 0.74
 Precision: 
       all: 0.406  allw: 0.568
        <3: 0.647  <3w: 0.656

 F-measure:(Recall,Precision)  0.524
 F-measure:(Recall,PrecisionW) 0.642

 F-measure:(0,PrecisionIdeal)  0.786
 F-measure:(0,PrecisionIdealW) 0.792

For freely-rotating-chain model:
Model ave Inconsistent score: 0.501(550/1098) 
Model ave  Missing interactions: 0.555 (592/1066)
              weighted: 0.454 (3.53e+05/7.78e+05)
                    <3: 0.356 (113/317)
                   <3w: 0.422 (2.31e+05/5.48e+05)

 Recall: 0.499
 Precision: 
       all: 0.445  allw: 0.546

 F-measure:(RecallFree,PrecisionFree)  0.47
 F-measure:(ReallFree,PrecisionFreeW) 0.521


 Final M-score 0.409 210/514

Model ave

 Final Recall-score for input query structures: 0.714
 Final Precision-score for input query structures: 0.651

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.664

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.681
 F-score of ideal true structures:       0.798
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.547

Model 1

 Final Recall-score for input query structures: 0.718
 Final Precision-score for input query structures: 0.634

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.676

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.673
 F-score of ideal true structures:       0.807
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.498

Model 2

 Final Recall-score for input query structures: 0.71
 Final Precision-score for input query structures: 0.647

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.689

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.677
 F-score of ideal true structures:       0.816
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.496

Model 3

 Final Recall-score for input query structures: 0.717
 Final Precision-score for input query structures: 0.646

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.684

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.68
 F-score of ideal true structures:       0.812
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.515

Model 4

 Final Recall-score for input query structures: 0.72
 Final Precision-score for input query structures: 0.647

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.677

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.682
 F-score of ideal true structures:       0.808
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.53

Model 5

 Final Recall-score for input query structures: 0.717
 Final Precision-score for input query structures: 0.643

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.673

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.678
 F-score of ideal true structures:       0.804
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.523

Model 6

 Final Recall-score for input query structures: 0.719
 Final Precision-score for input query structures: 0.641

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.681

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.678
 F-score of ideal true structures:       0.81
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.511

Model 7

 Final Recall-score for input query structures: 0.716
 Final Precision-score for input query structures: 0.628

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.672

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.669
 F-score of ideal true structures:       0.804
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.489

Model 8

 Final Recall-score for input query structures: 0.72
 Final Precision-score for input query structures: 0.63

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.679

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.672
 F-score of ideal true structures:       0.809
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.491

Model 9

 Final Recall-score for input query structures: 0.712
 Final Precision-score for input query structures: 0.641

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.677

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.675
 F-score of ideal true structures:       0.807
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.506

Model 10

 Final Recall-score for input query structures: 0.725
 Final Precision-score for input query structures: 0.628

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.675

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.673
 F-score of ideal true structures:       0.806
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.5

Model 11

 Final Recall-score for input query structures: 0.715
 Final Precision-score for input query structures: 0.637

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.675

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.674
 F-score of ideal true structures:       0.806
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.504

Model 12

 Final Recall-score for input query structures: 0.71
 Final Precision-score for input query structures: 0.642

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.678

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.674
 F-score of ideal true structures:       0.808
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.5

Model 13

 Final Recall-score for input query structures: 0.719
 Final Precision-score for input query structures: 0.65

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.681

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.683
 F-score of ideal true structures:       0.81
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.53

Model 14

 Final Recall-score for input query structures: 0.716
 Final Precision-score for input query structures: 0.645

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.675

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.678
 F-score of ideal true structures:       0.806
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.519

Model 15

 Final Recall-score for input query structures: 0.714
 Final Precision-score for input query structures: 0.646

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.676

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.678
 F-score of ideal true structures:       0.807
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.517

Model 16

 Final Recall-score for input query structures: 0.718
 Final Precision-score for input query structures: 0.634

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.672

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.674
 F-score of ideal true structures:       0.804
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.508

Model 17

 Final Recall-score for input query structures: 0.713
 Final Precision-score for input query structures: 0.646

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.678

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.678
 F-score of ideal true structures:       0.808
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.515

Model 18

 Final Recall-score for input query structures: 0.723
 Final Precision-score for input query structures: 0.641

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.684

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.68
 F-score of ideal true structures:       0.812
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.515

Model 19

 Final Recall-score for input query structures: 0.718
 Final Precision-score for input query structures: 0.639

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.674

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.677
 F-score of ideal true structures:       0.805
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.517

Model 20

 Final Recall-score for input query structures: 0.72
 Final Precision-score for input query structures: 0.635

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.676

 Final Recall-score for freely-rotating-chain model: 0.49
 Final Precision-score for freely-rotating-chain model: 0.602

 Summary:
 F-score of input query structures:      0.675
 F-score of ideal true structures:       0.806
 F-score of freely-rotating-chain model: 0.54

 DP-Score: 0.508

Statistics: 
=========== 

NOESY_Assign:
      User CPU Time:       33.4 sec.
      Syst CPU Time:       0.37 sec.
Other Processes:
      User CPU Time:       0.47 sec.
      Syst CPU Time:       0.04 sec.

Total Elapsed Time:       34.3 sec. 
