# created by  ASDP Version 1.0 Copyright(C) 2010
# Fri May 10 17:46:11 2013


# Command: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign 
#		-c /data/PSVS/PSVS-v1.4-dev/results/SR384_R3_em_bcr3/rpf_calc/input/ctrl_file 
#		-o rpf_calc 
#		-q SR384_R3_em_bcr3.pdb.iupac 


# Summary for n.peaks
Total simulated peaks: 70 Number of peaks NOT matched in the Peak List: 70
M score = 1

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

# Summary for c_aro.peaks
Total simulated peaks: 4 Number of peaks NOT matched in the Peak List: 0
M score = 0

Average shift in HX: 0.00075 Average ab-shift in HX: 0.00075(Assignment used: 2)
Average shift in X: 0.005 Average ab-shift in X: 0.045(Assignment used: 2)
Average shift in HX2: 0.0018 Average ab-shift in HX2: 0.0022(Assignment used: 4)

#For peaklist c_aro.peaks:
 Rmax: 5
Model ave Inconsistent score: 0(0/35) 
Model   1 Inconsistent score: 0(0/35) 
Model   2 Inconsistent score: 0(0/35) 
Model   3 Inconsistent score: 0(0/35) 
Model   4 Inconsistent score: 0(0/35) 
Model   5 Inconsistent score: 0(0/35) 
Model   6 Inconsistent score: 0.0286(1/35) 
Model   7 Inconsistent score: 0(0/35) 
Model   8 Inconsistent score: 0(0/35) 
Model   9 Inconsistent score: 0.0286(1/35) 
Model  10 Inconsistent score: 0(0/35) 
Model  11 Inconsistent score: 0.0286(1/35) 
Model  12 Inconsistent score: 0(0/35) 
Model  13 Inconsistent score: 0(0/35) 
Model  14 Inconsistent score: 0(0/35) 
Model  15 Inconsistent score: 0.0286(1/35) 
Model  16 Inconsistent score: 0(0/35) 
Model  17 Inconsistent score: 0(0/35) 
Model  18 Inconsistent score: 0(0/35) 
Model  19 Inconsistent score: 0(0/35) 
Model  20 Inconsistent score: 0.0286(1/35) 
Model ave  Missing interactions: 0.375 (18/48)
              weighted: 0.0821 (3.35e+03/4.08e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   1  Missing interactions: 0.492 (32/65)
              weighted: 0.162 (1.61e+04/9.94e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   2  Missing interactions: 0.476 (30/63)
              weighted: 0.101 (1.05e+04/1.04e+05)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   3  Missing interactions: 0.377 (20/53)
              weighted: 0.0758 (5.2e+03/6.86e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   4  Missing interactions: 0.526 (41/78)
              weighted: 0.324 (4.3e+04/1.33e+05)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   5  Missing interactions: 0.45 (27/60)
              weighted: 0.108 (1.04e+04/9.55e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   6  Missing interactions: 0.4 (20/50)
              weighted: 0.0737 (6.84e+03/9.29e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   7  Missing interactions: 0.385 (20/52)
              weighted: 0.267 (1.93e+04/7.22e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   8  Missing interactions: 0.393 (22/56)
              weighted: 0.273 (2.45e+04/8.97e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model   9  Missing interactions: 0.5 (33/66)
              weighted: 0.167 (1.34e+04/8.03e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  10  Missing interactions: 0.507 (34/67)
              weighted: 0.298 (3.46e+04/1.16e+05)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  11  Missing interactions: 0.444 (24/54)
              weighted: 0.111 (9.3e+03/8.36e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  12  Missing interactions: 0.564 (44/78)
              weighted: 0.396 (4.98e+04/1.26e+05)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  13  Missing interactions: 0.426 (23/54)
              weighted: 0.148 (1.48e+04/1e+05)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  14  Missing interactions: 0.421 (24/57)
              weighted: 0.0822 (7.84e+03/9.54e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  15  Missing interactions: 0.448 (26/58)
              weighted: 0.192 (1.07e+04/5.58e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  16  Missing interactions: 0.429 (24/56)
              weighted: 0.111 (1.22e+04/1.1e+05)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  17  Missing interactions: 0.421 (24/57)
              weighted: 0.192 (2.04e+04/1.06e+05)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  18  Missing interactions: 0.431 (25/58)
              weighted: 0.205 (2.37e+04/1.16e+05)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  19  Missing interactions: 0.468 (29/62)
              weighted: 0.109 (1.05e+04/9.65e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)
Model  20  Missing interactions: 0.515 (34/66)
              weighted: 0.261 (2.52e+04/9.64e+04)
                    <3: nan (0/0)
                   <3w: nan (0/0)

Model ave
 Recall: 1
 Precision: 
       all: 0.625  allw: 0.918
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.769
 F-measure:(Recall,PrecisionW) 0.957

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 1
 Recall: 1
 Precision: 
       all: 0.508  allw: 0.838
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.673
 F-measure:(Recall,PrecisionW) 0.912

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 2
 Recall: 1
 Precision: 
       all: 0.524  allw: 0.899
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.947

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 3
 Recall: 1
 Precision: 
       all: 0.623  allw: 0.924
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.767
 F-measure:(Recall,PrecisionW) 0.961

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 4
 Recall: 1
 Precision: 
       all: 0.474  allw: 0.676
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.643
 F-measure:(Recall,PrecisionW) 0.807

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 5
 Recall: 1
 Precision: 
       all: 0.55  allw: 0.892
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.71
 F-measure:(Recall,PrecisionW) 0.943

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 6
 Recall: 0.971
 Precision: 
       all: 0.6  allw: 0.926
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.742
 F-measure:(Recall,PrecisionW) 0.948

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 7
 Recall: 1
 Precision: 
       all: 0.615  allw: 0.733
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.762
 F-measure:(Recall,PrecisionW) 0.846

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 8
 Recall: 1
 Precision: 
       all: 0.607  allw: 0.727
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.756
 F-measure:(Recall,PrecisionW) 0.842

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 9
 Recall: 0.971
 Precision: 
       all: 0.5  allw: 0.833
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.66
 F-measure:(Recall,PrecisionW) 0.897

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 10
 Recall: 1
 Precision: 
       all: 0.493  allw: 0.702
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.66
 F-measure:(Recall,PrecisionW) 0.825

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 11
 Recall: 0.971
 Precision: 
       all: 0.556  allw: 0.889
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.707
 F-measure:(Recall,PrecisionW) 0.928

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 12
 Recall: 1
 Precision: 
       all: 0.436  allw: 0.604
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.607
 F-measure:(Recall,PrecisionW) 0.753

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 13
 Recall: 1
 Precision: 
       all: 0.574  allw: 0.852
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.729
 F-measure:(Recall,PrecisionW) 0.92

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 14
 Recall: 1
 Precision: 
       all: 0.579  allw: 0.918
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.733
 F-measure:(Recall,PrecisionW) 0.957

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 15
 Recall: 0.971
 Precision: 
       all: 0.552  allw: 0.808
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.704
 F-measure:(Recall,PrecisionW) 0.882

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 16
 Recall: 1
 Precision: 
       all: 0.571  allw: 0.889
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.727
 F-measure:(Recall,PrecisionW) 0.941

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 17
 Recall: 1
 Precision: 
       all: 0.579  allw: 0.808
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.733
 F-measure:(Recall,PrecisionW) 0.894

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 18
 Recall: 1
 Precision: 
       all: 0.569  allw: 0.795
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.725
 F-measure:(Recall,PrecisionW) 0.886

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 19
 Recall: 1
 Precision: 
       all: 0.532  allw: 0.891
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.695
 F-measure:(Recall,PrecisionW) 0.942

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

Model 20
 Recall: 0.971
 Precision: 
       all: 0.485  allw: 0.739
        <3: nan  <3w: nan

 F-measure:(Recall,Precision)  0.647
 F-measure:(Recall,PrecisionW) 0.839

 F-measure:(0,PrecisionIdeal)  nan
 F-measure:(0,PrecisionIdealW) nan

For freely-rotating-chain model:
Model ave Inconsistent score: 0.486(17/35) 
Model ave  Missing interactions: 0.273 (3/11)
              weighted: 0.144 (227/1.58e+03)
                    <3: nan (0/0)
                   <3w: nan (0/0)

 Recall: 0.514
 Precision: 
       all: 0.727  allw: 0.856

 F-measure:(RecallFree,PrecisionFree)  0.603
 F-measure:(ReallFree,PrecisionFreeW) 0.643

# Summary for c_ali.peaks
Total simulated peaks: 377 Number of peaks NOT matched in the Peak List: 4
M score = 0.011

Average shift in HX: 0.00093 Average ab-shift in HX: 0.0013(Assignment used: 197)
Average shift in X: 0.0041 Average ab-shift in X: 0.009(Assignment used: 148)
Average shift in HX2: 8.7e-05 Average ab-shift in HX2: 0.0016(Assignment used: 238)

#For peaklist c_ali.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.00861(17/1974) 
Model   1 Inconsistent score: 0.0111(22/1974) 
Model   2 Inconsistent score: 0.0111(22/1974) 
Model   3 Inconsistent score: 0.0142(28/1974) 
Model   4 Inconsistent score: 0.0122(24/1974) 
Model   5 Inconsistent score: 0.0117(23/1974) 
Model   6 Inconsistent score: 0.00912(18/1974) 
Model   7 Inconsistent score: 0.0127(25/1974) 
Model   8 Inconsistent score: 0.0122(24/1974) 
Model   9 Inconsistent score: 0.0122(24/1974) 
Model  10 Inconsistent score: 0.00861(17/1974) 
Model  11 Inconsistent score: 0.0117(23/1974) 
Model  12 Inconsistent score: 0.0117(23/1974) 
Model  13 Inconsistent score: 0.0101(20/1974) 
Model  14 Inconsistent score: 0.0101(20/1974) 
Model  15 Inconsistent score: 0.00811(16/1974) 
Model  16 Inconsistent score: 0.00861(17/1974) 
Model  17 Inconsistent score: 0.00912(18/1974) 
Model  18 Inconsistent score: 0.0142(28/1974) 
Model  19 Inconsistent score: 0.00709(14/1974) 
Model  20 Inconsistent score: 0.0111(22/1974) 
Model ave  Missing interactions: 0.325 (660/2028)
              weighted: 0.0549 (2.93e+05/5.34e+06)
                    <3: 0.00379 (1/264)
                   <3w: 0.00402 (1.04e+04/2.59e+06)
Model   1  Missing interactions: 0.346 (755/2184)
              weighted: 0.067 (4.11e+05/6.14e+06)
                    <3: 0.00376 (1/266)
                   <3w: 0.00386 (1.01e+04/2.62e+06)
Model   2  Missing interactions: 0.346 (744/2153)
              weighted: 0.0721 (4.36e+05/6.05e+06)
                    <3: 0.00376 (1/266)
                   <3w: 0.00387 (1.01e+04/2.62e+06)
Model   3  Missing interactions: 0.342 (741/2164)
              weighted: 0.0685 (4.11e+05/5.99e+06)
                    <3: 0.00377 (1/265)
                   <3w: 0.00413 (1.07e+04/2.59e+06)
Model   4  Missing interactions: 0.357 (789/2212)
              weighted: 0.0689 (4.22e+05/6.12e+06)
                    <3: 0.00372 (1/269)
                   <3w: 0.00388 (1.01e+04/2.61e+06)
Model   5  Missing interactions: 0.349 (750/2149)
              weighted: 0.0643 (3.83e+05/5.96e+06)
                    <3: 0.00377 (1/265)
                   <3w: 0.00405 (1.04e+04/2.57e+06)
Model   6  Missing interactions: 0.355 (792/2228)
              weighted: 0.0943 (5.97e+05/6.33e+06)
                    <3: 0.00373 (1/268)
                   <3w: 0.00394 (1.04e+04/2.64e+06)
Model   7  Missing interactions: 0.343 (734/2142)
              weighted: 0.0791 (4.83e+05/6.11e+06)
                    <3: 0.00377 (1/265)
                   <3w: 0.00387 (1.01e+04/2.62e+06)
Model   8  Missing interactions: 0.341 (751/2202)
              weighted: 0.0796 (4.84e+05/6.08e+06)
                    <3: 0.00377 (1/265)
                   <3w: 0.00405 (1.07e+04/2.64e+06)
Model   9  Missing interactions: 0.351 (766/2182)
              weighted: 0.0808 (4.88e+05/6.04e+06)
                    <3: 0.00375 (1/267)
                   <3w: 0.00415 (1.07e+04/2.58e+06)
Model  10  Missing interactions: 0.35 (767/2191)
              weighted: 0.0765 (4.64e+05/6.07e+06)
                    <3: 0.00375 (1/267)
                   <3w: 0.00412 (1.07e+04/2.6e+06)
Model  11  Missing interactions: 0.349 (779/2232)
              weighted: 0.0787 (4.84e+05/6.15e+06)
                    <3: 0.00376 (1/266)
                   <3w: 0.00407 (1.07e+04/2.63e+06)
Model  12  Missing interactions: 0.36 (806/2239)
              weighted: 0.0743 (4.5e+05/6.05e+06)
                    <3: 0.00373 (1/268)
                   <3w: 0.00393 (1.01e+04/2.57e+06)
Model  13  Missing interactions: 0.352 (769/2187)
              weighted: 0.0814 (4.98e+05/6.12e+06)
                    <3: 0.00375 (1/267)
                   <3w: 0.00412 (1.07e+04/2.6e+06)
Model  14  Missing interactions: 0.355 (776/2187)
              weighted: 0.0731 (4.42e+05/6.05e+06)
                    <3: 0.00375 (1/267)
                   <3w: 0.00387 (1.01e+04/2.61e+06)
Model  15  Missing interactions: 0.351 (768/2191)
              weighted: 0.0805 (4.97e+05/6.17e+06)
                    <3: 0.00375 (1/267)
                   <3w: 0.00379 (1.01e+04/2.67e+06)
Model  16  Missing interactions: 0.355 (779/2196)
              weighted: 0.0729 (4.39e+05/6.03e+06)
                    <3: 0.00373 (1/268)
                   <3w: 0.00384 (1.01e+04/2.63e+06)
Model  17  Missing interactions: 0.352 (763/2168)
              weighted: 0.0777 (4.79e+05/6.17e+06)
                    <3: 0.00375 (1/267)
                   <3w: 0.00389 (1.01e+04/2.6e+06)
Model  18  Missing interactions: 0.344 (738/2145)
              weighted: 0.0718 (4.35e+05/6.05e+06)
                    <3: 0.00377 (1/265)
                   <3w: 0.00405 (1.04e+04/2.57e+06)
Model  19  Missing interactions: 0.351 (760/2168)
              weighted: 0.0637 (3.87e+05/6.08e+06)
                    <3: 0.00376 (1/266)
                   <3w: 0.00402 (1.04e+04/2.59e+06)
Model  20  Missing interactions: 0.353 (775/2198)
              weighted: 0.0714 (4.29e+05/6.01e+06)
                    <3: 0.00375 (1/267)
                   <3w: 0.00388 (1.01e+04/2.61e+06)

Model ave
 Recall: 0.991
 Precision: 
       all: 0.675  allw: 0.945
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.803
 F-measure:(Recall,PrecisionW) 0.968

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 1
 Recall: 0.989
 Precision: 
       all: 0.654  allw: 0.933
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.788
 F-measure:(Recall,PrecisionW) 0.96

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 2
 Recall: 0.989
 Precision: 
       all: 0.654  allw: 0.928
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.788
 F-measure:(Recall,PrecisionW) 0.957

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 3
 Recall: 0.986
 Precision: 
       all: 0.658  allw: 0.931
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.789
 F-measure:(Recall,PrecisionW) 0.958

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 4
 Recall: 0.988
 Precision: 
       all: 0.643  allw: 0.931
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.779
 F-measure:(Recall,PrecisionW) 0.959

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 5
 Recall: 0.988
 Precision: 
       all: 0.651  allw: 0.936
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.785
 F-measure:(Recall,PrecisionW) 0.961

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 6
 Recall: 0.991
 Precision: 
       all: 0.645  allw: 0.906
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.781
 F-measure:(Recall,PrecisionW) 0.946

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 7
 Recall: 0.987
 Precision: 
       all: 0.657  allw: 0.921
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.789
 F-measure:(Recall,PrecisionW) 0.953

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 8
 Recall: 0.988
 Precision: 
       all: 0.659  allw: 0.92
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.791
 F-measure:(Recall,PrecisionW) 0.953

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 9
 Recall: 0.988
 Precision: 
       all: 0.649  allw: 0.919
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.783
 F-measure:(Recall,PrecisionW) 0.952

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 10
 Recall: 0.991
 Precision: 
       all: 0.65  allw: 0.924
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.785
 F-measure:(Recall,PrecisionW) 0.956

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 11
 Recall: 0.988
 Precision: 
       all: 0.651  allw: 0.921
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.785
 F-measure:(Recall,PrecisionW) 0.954

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 12
 Recall: 0.988
 Precision: 
       all: 0.64  allw: 0.926
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.777
 F-measure:(Recall,PrecisionW) 0.956

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 13
 Recall: 0.99
 Precision: 
       all: 0.648  allw: 0.919
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.784
 F-measure:(Recall,PrecisionW) 0.953

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 14
 Recall: 0.99
 Precision: 
       all: 0.645  allw: 0.927
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.781
 F-measure:(Recall,PrecisionW) 0.957

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 15
 Recall: 0.992
 Precision: 
       all: 0.649  allw: 0.92
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.785
 F-measure:(Recall,PrecisionW) 0.954

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 16
 Recall: 0.991
 Precision: 
       all: 0.645  allw: 0.927
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.782
 F-measure:(Recall,PrecisionW) 0.958

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 17
 Recall: 0.991
 Precision: 
       all: 0.648  allw: 0.922
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.784
 F-measure:(Recall,PrecisionW) 0.955

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 18
 Recall: 0.986
 Precision: 
       all: 0.656  allw: 0.928
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.788
 F-measure:(Recall,PrecisionW) 0.956

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 19
 Recall: 0.993
 Precision: 
       all: 0.649  allw: 0.936
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.785
 F-measure:(Recall,PrecisionW) 0.964

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

Model 20
 Recall: 0.989
 Precision: 
       all: 0.647  allw: 0.929
        <3: 0.996  <3w: 0.996

 F-measure:(Recall,Precision)  0.783
 F-measure:(Recall,PrecisionW) 0.958

 F-measure:(0,PrecisionIdeal)  0.998
 F-measure:(0,PrecisionIdealW) 0.998

For freely-rotating-chain model:
Model ave Inconsistent score: 0.266(526/1974) 
Model ave  Missing interactions: 0.215 (192/895)
              weighted: 0.0521 (3.26e+04/6.24e+05)
                    <3: 0.00379 (1/264)
                   <3w: 0.00217 (929/4.28e+05)

 Recall: 0.734
 Precision: 
       all: 0.785  allw: 0.948

 F-measure:(RecallFree,PrecisionFree)  0.759
 F-measure:(ReallFree,PrecisionFreeW) 0.827


 Final M-score 0.0105 4/381

Model ave

 Final Recall-score for input query structures: 0.992
 Final Precision-score for input query structures: 0.945

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.968
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.827

Model 1

 Final Recall-score for input query structures: 0.989
 Final Precision-score for input query structures: 0.932

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.959
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.775

Model 2

 Final Recall-score for input query structures: 0.989
 Final Precision-score for input query structures: 0.927

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.957
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.763

Model 3

 Final Recall-score for input query structures: 0.986
 Final Precision-score for input query structures: 0.931

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.958
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.769

Model 4

 Final Recall-score for input query structures: 0.988
 Final Precision-score for input query structures: 0.926

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.956
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.757

Model 5

 Final Recall-score for input query structures: 0.989
 Final Precision-score for input query structures: 0.935

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.961
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.786

Model 6

 Final Recall-score for input query structures: 0.991
 Final Precision-score for input query structures: 0.906

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.946
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.699

Model 7

 Final Recall-score for input query structures: 0.988
 Final Precision-score for input query structures: 0.919

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.952
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.734

Model 8

 Final Recall-score for input query structures: 0.988
 Final Precision-score for input query structures: 0.918

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.952
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.734

Model 9

 Final Recall-score for input query structures: 0.988
 Final Precision-score for input query structures: 0.918

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.952
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.734

Model 10

 Final Recall-score for input query structures: 0.992
 Final Precision-score for input query structures: 0.919

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.954
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.746

Model 11

 Final Recall-score for input query structures: 0.988
 Final Precision-score for input query structures: 0.921

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.953
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.74

Model 12

 Final Recall-score for input query structures: 0.989
 Final Precision-score for input query structures: 0.919

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.953
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.74

Model 13

 Final Recall-score for input query structures: 0.99
 Final Precision-score for input query structures: 0.918

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.952
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.734

Model 14

 Final Recall-score for input query structures: 0.99
 Final Precision-score for input query structures: 0.927

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.957
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.763

Model 15

 Final Recall-score for input query structures: 0.992
 Final Precision-score for input query structures: 0.919

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.954
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.746

Model 16

 Final Recall-score for input query structures: 0.992
 Final Precision-score for input query structures: 0.926

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.958
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.769

Model 17

 Final Recall-score for input query structures: 0.991
 Final Precision-score for input query structures: 0.92

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.954
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.746

Model 18

 Final Recall-score for input query structures: 0.986
 Final Precision-score for input query structures: 0.926

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.955
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.751

Model 19

 Final Recall-score for input query structures: 0.993
 Final Precision-score for input query structures: 0.936

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.963
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.798

Model 20

 Final Recall-score for input query structures: 0.989
 Final Precision-score for input query structures: 0.926

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.996

 Final Recall-score for freely-rotating-chain model: 0.73
 Final Precision-score for freely-rotating-chain model: 0.948

 Summary:
 F-score of input query structures:      0.956
 F-score of ideal true structures:       0.998
 F-score of freely-rotating-chain model: 0.825

 DP-Score: 0.757

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

NOESY_Assign:
      User CPU Time:       20.3 sec.
      Syst CPU Time:       0.41 sec.
Other Processes:
      User CPU Time:       0.29 sec.
      Syst CPU Time:       0.03 sec.

Total Elapsed Time:       21.1 sec. 
