# created by  ASDP Version 1.0 Copyright(C) 2010
# Sat May 11 01:19:09 2013


# Command: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign 
#		-c /data/PSVS/PSVS-v1.4-dev/results/STR65_R3Cons_em_bcr3/rpf_calc/input/ctrl_file 
#		-o rpf_calc 
#		-q STR65_R3Cons_em_bcr3.pdb.iupac 


# Summary for n.peaks
Total simulated peaks: 153 Number of peaks NOT matched in the Peak List: 9
M score = 0.059

Average shift in HX: 0.0016 Average ab-shift in HX: 0.0056(Assignment used: 101)
Average shift in X: 0.077 Average ab-shift in X: 0.084(Assignment used: 97)
Average shift in HX2: -0.0034 Average ab-shift in HX2: 0.008(Assignment used: 120)

#For peaklist n.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.0148(13/879) 
Model   1 Inconsistent score: 0.0148(13/879) 
Model   2 Inconsistent score: 0.0171(15/879) 
Model   3 Inconsistent score: 0.0148(13/879) 
Model   4 Inconsistent score: 0.0125(11/879) 
Model   5 Inconsistent score: 0.0137(12/879) 
Model   6 Inconsistent score: 0.0148(13/879) 
Model   7 Inconsistent score: 0.0171(15/879) 
Model   8 Inconsistent score: 0.0171(15/879) 
Model   9 Inconsistent score: 0.0193(17/879) 
Model  10 Inconsistent score: 0.0159(14/879) 
Model  11 Inconsistent score: 0.0148(13/879) 
Model  12 Inconsistent score: 0.0159(14/879) 
Model  13 Inconsistent score: 0.0171(15/879) 
Model  14 Inconsistent score: 0.0148(13/879) 
Model  15 Inconsistent score: 0.0137(12/879) 
Model  16 Inconsistent score: 0.0171(15/879) 
Model  17 Inconsistent score: 0.0193(17/879) 
Model  18 Inconsistent score: 0.0159(14/879) 
Model ave  Missing interactions: 0.437 (663/1518)
              weighted: 0.096 (3.24e+05/3.37e+06)
                    <3: 0.0458 (7/153)
                   <3w: 0.0231 (2.24e+04/9.67e+05)
Model   1  Missing interactions: 0.465 (780/1676)
              weighted: 0.16 (6.87e+05/4.28e+06)
                    <3: 0.0452 (7/155)
                   <3w: 0.0169 (1.63e+04/9.65e+05)
Model   2  Missing interactions: 0.46 (754/1640)
              weighted: 0.144 (6.19e+05/4.29e+06)
                    <3: 0.0449 (7/156)
                   <3w: 0.0169 (1.65e+04/9.76e+05)
Model   3  Missing interactions: 0.451 (749/1660)
              weighted: 0.144 (6.06e+05/4.2e+06)
                    <3: 0.0455 (7/154)
                   <3w: 0.0289 (2.74e+04/9.46e+05)
Model   4  Missing interactions: 0.449 (744/1658)
              weighted: 0.114 (4.7e+05/4.11e+06)
                    <3: 0.0452 (7/155)
                   <3w: 0.0173 (1.66e+04/9.58e+05)
Model   5  Missing interactions: 0.45 (721/1604)
              weighted: 0.131 (5.38e+05/4.11e+06)
                    <3: 0.0446 (7/157)
                   <3w: 0.0295 (2.81e+04/9.52e+05)
Model   6  Missing interactions: 0.452 (740/1636)
              weighted: 0.144 (6.01e+05/4.17e+06)
                    <3: 0.0387 (6/155)
                   <3w: 0.0286 (2.79e+04/9.74e+05)
Model   7  Missing interactions: 0.452 (741/1640)
              weighted: 0.124 (5.04e+05/4.06e+06)
                    <3: 0.044 (7/159)
                   <3w: 0.0191 (1.79e+04/9.37e+05)
Model   8  Missing interactions: 0.449 (728/1623)
              weighted: 0.131 (5.49e+05/4.2e+06)
                    <3: 0.0446 (7/157)
                   <3w: 0.017 (1.64e+04/9.61e+05)
Model   9  Missing interactions: 0.47 (813/1731)
              weighted: 0.163 (7.45e+05/4.56e+06)
                    <3: 0.0382 (6/157)
                   <3w: 0.0294 (2.81e+04/9.58e+05)
Model  10  Missing interactions: 0.449 (739/1645)
              weighted: 0.123 (5.2e+05/4.21e+06)
                    <3: 0.0452 (7/155)
                   <3w: 0.0295 (2.85e+04/9.67e+05)
Model  11  Missing interactions: 0.461 (777/1684)
              weighted: 0.142 (5.92e+05/4.19e+06)
                    <3: 0.0443 (7/158)
                   <3w: 0.0288 (2.76e+04/9.58e+05)
Model  12  Missing interactions: 0.447 (726/1624)
              weighted: 0.13 (5.4e+05/4.15e+06)
                    <3: 0.0449 (7/156)
                   <3w: 0.0281 (2.71e+04/9.65e+05)
Model  13  Missing interactions: 0.453 (756/1669)
              weighted: 0.149 (6.27e+05/4.22e+06)
                    <3: 0.039 (6/154)
                   <3w: 0.0161 (1.52e+04/9.45e+05)
Model  14  Missing interactions: 0.45 (748/1661)
              weighted: 0.144 (5.97e+05/4.13e+06)
                    <3: 0.0455 (7/154)
                   <3w: 0.0176 (1.66e+04/9.45e+05)
Model  15  Missing interactions: 0.467 (782/1676)
              weighted: 0.141 (5.94e+05/4.22e+06)
                    <3: 0.0455 (7/154)
                   <3w: 0.0171 (1.6e+04/9.35e+05)
Model  16  Missing interactions: 0.455 (756/1663)
              weighted: 0.109 (4.44e+05/4.07e+06)
                    <3: 0.0452 (7/155)
                   <3w: 0.019 (1.76e+04/9.27e+05)
Model  17  Missing interactions: 0.459 (762/1661)
              weighted: 0.116 (4.74e+05/4.08e+06)
                    <3: 0.0461 (7/152)
                   <3w: 0.0281 (2.83e+04/1.01e+06)
Model  18  Missing interactions: 0.438 (694/1583)
              weighted: 0.156 (6.67e+05/4.27e+06)
                    <3: 0.0452 (7/155)
                   <3w: 0.0268 (2.8e+04/1.04e+06)

Model ave
 Recall: 0.985
 Precision: 
       all: 0.563  allw: 0.904
        <3: 0.954  <3w: 0.977

 F-measure:(Recall,Precision)  0.717
 F-measure:(Recall,PrecisionW) 0.943

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.988

Model 1
 Recall: 0.985
 Precision: 
       all: 0.535  allw: 0.84
        <3: 0.955  <3w: 0.983

 F-measure:(Recall,Precision)  0.693
 F-measure:(Recall,PrecisionW) 0.907

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.991

Model 2
 Recall: 0.983
 Precision: 
       all: 0.54  allw: 0.856
        <3: 0.955  <3w: 0.983

 F-measure:(Recall,Precision)  0.697
 F-measure:(Recall,PrecisionW) 0.915

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.991

Model 3
 Recall: 0.985
 Precision: 
       all: 0.549  allw: 0.856
        <3: 0.955  <3w: 0.971

 F-measure:(Recall,Precision)  0.705
 F-measure:(Recall,PrecisionW) 0.916

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.985

Model 4
 Recall: 0.987
 Precision: 
       all: 0.551  allw: 0.886
        <3: 0.955  <3w: 0.983

 F-measure:(Recall,Precision)  0.708
 F-measure:(Recall,PrecisionW) 0.934

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.991

Model 5
 Recall: 0.986
 Precision: 
       all: 0.55  allw: 0.869
        <3: 0.955  <3w: 0.97

 F-measure:(Recall,Precision)  0.707
 F-measure:(Recall,PrecisionW) 0.924

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.985

Model 6
 Recall: 0.985
 Precision: 
       all: 0.548  allw: 0.856
        <3: 0.961  <3w: 0.971

 F-measure:(Recall,Precision)  0.704
 F-measure:(Recall,PrecisionW) 0.916

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.985

Model 7
 Recall: 0.983
 Precision: 
       all: 0.548  allw: 0.876
        <3: 0.956  <3w: 0.981

 F-measure:(Recall,Precision)  0.704
 F-measure:(Recall,PrecisionW) 0.926

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.99

Model 8
 Recall: 0.983
 Precision: 
       all: 0.551  allw: 0.869
        <3: 0.955  <3w: 0.983

 F-measure:(Recall,Precision)  0.707
 F-measure:(Recall,PrecisionW) 0.923

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.991

Model 9
 Recall: 0.981
 Precision: 
       all: 0.53  allw: 0.837
        <3: 0.962  <3w: 0.971

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.903

 F-measure:(0,PrecisionIdeal)  0.981
 F-measure:(0,PrecisionIdealW) 0.985

Model 10
 Recall: 0.984
 Precision: 
       all: 0.551  allw: 0.877
        <3: 0.955  <3w: 0.97

 F-measure:(Recall,Precision)  0.706
 F-measure:(Recall,PrecisionW) 0.927

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.985

Model 11
 Recall: 0.985
 Precision: 
       all: 0.539  allw: 0.858
        <3: 0.956  <3w: 0.971

 F-measure:(Recall,Precision)  0.696
 F-measure:(Recall,PrecisionW) 0.917

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.985

Model 12
 Recall: 0.984
 Precision: 
       all: 0.553  allw: 0.87
        <3: 0.955  <3w: 0.972

 F-measure:(Recall,Precision)  0.708
 F-measure:(Recall,PrecisionW) 0.924

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.986

Model 13
 Recall: 0.983
 Precision: 
       all: 0.547  allw: 0.851
        <3: 0.961  <3w: 0.984

 F-measure:(Recall,Precision)  0.703
 F-measure:(Recall,PrecisionW) 0.912

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.992

Model 14
 Recall: 0.985
 Precision: 
       all: 0.55  allw: 0.856
        <3: 0.955  <3w: 0.982

 F-measure:(Recall,Precision)  0.706
 F-measure:(Recall,PrecisionW) 0.916

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.991

Model 15
 Recall: 0.986
 Precision: 
       all: 0.533  allw: 0.859
        <3: 0.955  <3w: 0.983

 F-measure:(Recall,Precision)  0.692
 F-measure:(Recall,PrecisionW) 0.918

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.991

Model 16
 Recall: 0.983
 Precision: 
       all: 0.545  allw: 0.891
        <3: 0.955  <3w: 0.981

 F-measure:(Recall,Precision)  0.702
 F-measure:(Recall,PrecisionW) 0.935

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.99

Model 17
 Recall: 0.981
 Precision: 
       all: 0.541  allw: 0.884
        <3: 0.954  <3w: 0.972

 F-measure:(Recall,Precision)  0.698
 F-measure:(Recall,PrecisionW) 0.93

 F-measure:(0,PrecisionIdeal)  0.976
 F-measure:(0,PrecisionIdealW) 0.986

Model 18
 Recall: 0.984
 Precision: 
       all: 0.562  allw: 0.844
        <3: 0.955  <3w: 0.973

 F-measure:(Recall,Precision)  0.715
 F-measure:(Recall,PrecisionW) 0.909

 F-measure:(0,PrecisionIdeal)  0.977
 F-measure:(0,PrecisionIdealW) 0.986

For freely-rotating-chain model:
Model ave Inconsistent score: 0.221(194/879) 
Model ave  Missing interactions: 0.256 (197/771)
              weighted: 0.121 (5.5e+04/4.54e+05)
                    <3: 0.0649 (10/154)
                   <3w: 0.0569 (1.45e+04/2.55e+05)

 Recall: 0.779
 Precision: 
       all: 0.744  allw: 0.879

 F-measure:(RecallFree,PrecisionFree)  0.761
 F-measure:(ReallFree,PrecisionFreeW) 0.826

# Summary for c_aro.peaks
Total simulated peaks: 18 Number of peaks NOT matched in the Peak List: 0
M score = 0

Average shift in HX: 0.0042 Average ab-shift in HX: 0.0052(Assignment used: 10)
Average shift in X: -0.01 Average ab-shift in X: 0.057(Assignment used: 10)
Average shift in HX2: -0.0032 Average ab-shift in HX2: 0.0069(Assignment used: 18)

#For peaklist c_aro.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.0392(10/255) 
Model   1 Inconsistent score: 0.0275(7/255) 
Model   2 Inconsistent score: 0.0392(10/255) 
Model   3 Inconsistent score: 0.0392(10/255) 
Model   4 Inconsistent score: 0.0392(10/255) 
Model   5 Inconsistent score: 0.0275(7/255) 
Model   6 Inconsistent score: 0.0314(8/255) 
Model   7 Inconsistent score: 0.0314(8/255) 
Model   8 Inconsistent score: 0.0314(8/255) 
Model   9 Inconsistent score: 0.0431(11/255) 
Model  10 Inconsistent score: 0.0314(8/255) 
Model  11 Inconsistent score: 0.0392(10/255) 
Model  12 Inconsistent score: 0.051(13/255) 
Model  13 Inconsistent score: 0.0353(9/255) 
Model  14 Inconsistent score: 0.0431(11/255) 
Model  15 Inconsistent score: 0.0314(8/255) 
Model  16 Inconsistent score: 0.0235(6/255) 
Model  17 Inconsistent score: 0.0157(4/255) 
Model  18 Inconsistent score: 0.0392(10/255) 
Model ave  Missing interactions: 0.477 (205/430)
              weighted: 0.137 (5.42e+04/3.95e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.133 (1.04e+04/7.83e+04)
Model   1  Missing interactions: 0.535 (261/488)
              weighted: 0.191 (1.34e+05/7.03e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.136 (1.05e+04/7.7e+04)
Model   2  Missing interactions: 0.51 (244/478)
              weighted: 0.201 (1.4e+05/6.98e+05)
                    <3: 0.333 (10/30)
                   <3w: 0.135 (1.04e+04/7.76e+04)
Model   3  Missing interactions: 0.507 (231/456)
              weighted: 0.208 (1.24e+05/5.97e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.135 (1.04e+04/7.72e+04)
Model   4  Missing interactions: 0.492 (219/445)
              weighted: 0.183 (1.03e+05/5.66e+05)
                    <3: 0.333 (10/30)
                   <3w: 0.131 (1.02e+04/7.8e+04)
Model   5  Missing interactions: 0.52 (246/473)
              weighted: 0.172 (1.13e+05/6.56e+05)
                    <3: 0.333 (10/30)
                   <3w: 0.133 (1.02e+04/7.67e+04)
Model   6  Missing interactions: 0.505 (233/461)
              weighted: 0.185 (1.17e+05/6.32e+05)
                    <3: 0.308 (8/26)
                   <3w: 0.129 (1.01e+04/7.81e+04)
Model   7  Missing interactions: 0.507 (233/460)
              weighted: 0.193 (1.29e+05/6.67e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.134 (1.02e+04/7.63e+04)
Model   8  Missing interactions: 0.503 (246/489)
              weighted: 0.221 (1.62e+05/7.34e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.134 (1.04e+04/7.78e+04)
Model   9  Missing interactions: 0.543 (274/505)
              weighted: 0.247 (1.84e+05/7.43e+05)
                    <3: 0.296 (8/27)
                   <3w: 0.129 (1.01e+04/7.83e+04)
Model  10  Missing interactions: 0.507 (238/469)
              weighted: 0.184 (1.27e+05/6.92e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.133 (1.02e+04/7.67e+04)
Model  11  Missing interactions: 0.524 (266/508)
              weighted: 0.205 (1.35e+05/6.6e+05)
                    <3: 0.333 (10/30)
                   <3w: 0.135 (1.04e+04/7.72e+04)
Model  12  Missing interactions: 0.521 (248/476)
              weighted: 0.22 (1.37e+05/6.2e+05)
                    <3: 0.333 (10/30)
                   <3w: 0.135 (1.04e+04/7.72e+04)
Model  13  Missing interactions: 0.512 (236/461)
              weighted: 0.229 (1.57e+05/6.86e+05)
                    <3: 0.296 (8/27)
                   <3w: 0.129 (1.03e+04/7.98e+04)
Model  14  Missing interactions: 0.533 (277/520)
              weighted: 0.298 (2.56e+05/8.57e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.133 (1.02e+04/7.71e+04)
Model  15  Missing interactions: 0.535 (269/503)
              weighted: 0.218 (1.65e+05/7.58e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.137 (1.07e+04/7.78e+04)
Model  16  Missing interactions: 0.53 (266/502)
              weighted: 0.25 (1.82e+05/7.29e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.135 (1.04e+04/7.72e+04)
Model  17  Missing interactions: 0.518 (259/500)
              weighted: 0.278 (2e+05/7.2e+05)
                    <3: 0.345 (10/29)
                   <3w: 0.134 (1.04e+04/7.8e+04)
Model  18  Missing interactions: 0.504 (227/450)
              weighted: 0.208 (1.36e+05/6.54e+05)
                    <3: 0.333 (10/30)
                   <3w: 0.136 (1.04e+04/7.7e+04)

Model ave
 Recall: 0.961
 Precision: 
       all: 0.523  allw: 0.863
        <3: 0.655  <3w: 0.867

 F-measure:(Recall,Precision)  0.678
 F-measure:(Recall,PrecisionW) 0.909

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.929

Model 1
 Recall: 0.973
 Precision: 
       all: 0.465  allw: 0.809
        <3: 0.655  <3w: 0.864

 F-measure:(Recall,Precision)  0.629
 F-measure:(Recall,PrecisionW) 0.884

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.927

Model 2
 Recall: 0.961
 Precision: 
       all: 0.49  allw: 0.799
        <3: 0.667  <3w: 0.865

 F-measure:(Recall,Precision)  0.649
 F-measure:(Recall,PrecisionW) 0.873

 F-measure:(0,PrecisionIdeal)  0.8
 F-measure:(0,PrecisionIdealW) 0.928

Model 3
 Recall: 0.961
 Precision: 
       all: 0.493  allw: 0.792
        <3: 0.655  <3w: 0.865

 F-measure:(Recall,Precision)  0.652
 F-measure:(Recall,PrecisionW) 0.869

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.927

Model 4
 Recall: 0.961
 Precision: 
       all: 0.508  allw: 0.817
        <3: 0.667  <3w: 0.869

 F-measure:(Recall,Precision)  0.664
 F-measure:(Recall,PrecisionW) 0.883

 F-measure:(0,PrecisionIdeal)  0.8
 F-measure:(0,PrecisionIdealW) 0.93

Model 5
 Recall: 0.973
 Precision: 
       all: 0.48  allw: 0.828
        <3: 0.667  <3w: 0.867

 F-measure:(Recall,Precision)  0.643
 F-measure:(Recall,PrecisionW) 0.895

 F-measure:(0,PrecisionIdeal)  0.8
 F-measure:(0,PrecisionIdealW) 0.929

Model 6
 Recall: 0.969
 Precision: 
       all: 0.495  allw: 0.815
        <3: 0.692  <3w: 0.871

 F-measure:(Recall,Precision)  0.655
 F-measure:(Recall,PrecisionW) 0.885

 F-measure:(0,PrecisionIdeal)  0.818
 F-measure:(0,PrecisionIdealW) 0.931

Model 7
 Recall: 0.969
 Precision: 
       all: 0.493  allw: 0.807
        <3: 0.655  <3w: 0.866

 F-measure:(Recall,Precision)  0.654
 F-measure:(Recall,PrecisionW) 0.881

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.928

Model 8
 Recall: 0.969
 Precision: 
       all: 0.497  allw: 0.779
        <3: 0.655  <3w: 0.866

 F-measure:(Recall,Precision)  0.657
 F-measure:(Recall,PrecisionW) 0.863

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.928

Model 9
 Recall: 0.957
 Precision: 
       all: 0.457  allw: 0.753
        <3: 0.704  <3w: 0.871

 F-measure:(Recall,Precision)  0.619
 F-measure:(Recall,PrecisionW) 0.842

 F-measure:(0,PrecisionIdeal)  0.826
 F-measure:(0,PrecisionIdealW) 0.931

Model 10
 Recall: 0.969
 Precision: 
       all: 0.493  allw: 0.816
        <3: 0.655  <3w: 0.867

 F-measure:(Recall,Precision)  0.653
 F-measure:(Recall,PrecisionW) 0.886

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.929

Model 11
 Recall: 0.961
 Precision: 
       all: 0.476  allw: 0.795
        <3: 0.667  <3w: 0.865

 F-measure:(Recall,Precision)  0.637
 F-measure:(Recall,PrecisionW) 0.87

 F-measure:(0,PrecisionIdeal)  0.8
 F-measure:(0,PrecisionIdealW) 0.928

Model 12
 Recall: 0.949
 Precision: 
       all: 0.479  allw: 0.78
        <3: 0.667  <3w: 0.865

 F-measure:(Recall,Precision)  0.637
 F-measure:(Recall,PrecisionW) 0.856

 F-measure:(0,PrecisionIdeal)  0.8
 F-measure:(0,PrecisionIdealW) 0.927

Model 13
 Recall: 0.965
 Precision: 
       all: 0.488  allw: 0.771
        <3: 0.704  <3w: 0.871

 F-measure:(Recall,Precision)  0.648
 F-measure:(Recall,PrecisionW) 0.857

 F-measure:(0,PrecisionIdeal)  0.826
 F-measure:(0,PrecisionIdealW) 0.931

Model 14
 Recall: 0.957
 Precision: 
       all: 0.467  allw: 0.702
        <3: 0.655  <3w: 0.867

 F-measure:(Recall,Precision)  0.628
 F-measure:(Recall,PrecisionW) 0.81

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.929

Model 15
 Recall: 0.969
 Precision: 
       all: 0.465  allw: 0.782
        <3: 0.655  <3w: 0.863

 F-measure:(Recall,Precision)  0.629
 F-measure:(Recall,PrecisionW) 0.865

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.926

Model 16
 Recall: 0.976
 Precision: 
       all: 0.47  allw: 0.75
        <3: 0.655  <3w: 0.865

 F-measure:(Recall,Precision)  0.635
 F-measure:(Recall,PrecisionW) 0.848

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.927

Model 17
 Recall: 0.984
 Precision: 
       all: 0.482  allw: 0.722
        <3: 0.655  <3w: 0.866

 F-measure:(Recall,Precision)  0.647
 F-measure:(Recall,PrecisionW) 0.833

 F-measure:(0,PrecisionIdeal)  0.792
 F-measure:(0,PrecisionIdealW) 0.928

Model 18
 Recall: 0.961
 Precision: 
       all: 0.496  allw: 0.792
        <3: 0.667  <3w: 0.864

 F-measure:(Recall,Precision)  0.654
 F-measure:(Recall,PrecisionW) 0.868

 F-measure:(0,PrecisionIdeal)  0.8
 F-measure:(0,PrecisionIdealW) 0.927

For freely-rotating-chain model:
Model ave Inconsistent score: 0.612(156/255) 
Model ave  Missing interactions: 0.34 (32/94)
              weighted: 0.545 (3.22e+04/5.91e+04)
                    <3: 0.444 (16/36)
                   <3w: 0.609 (3.09e+04/5.07e+04)

 Recall: 0.388
 Precision: 
       all: 0.66  allw: 0.455

 F-measure:(RecallFree,PrecisionFree)  0.489
 F-measure:(ReallFree,PrecisionFreeW) 0.419

# Summary for c_ali.peaks
Total simulated peaks: 785 Number of peaks NOT matched in the Peak List: 479
M score = 0.61

Average shift in HX: -0.0039 Average ab-shift in HX: 0.0055(Assignment used: 154)
Average shift in X: 0.00026 Average ab-shift in X: 0.05(Assignment used: 98)
Average shift in HX2: -0.0023 Average ab-shift in HX2: 0.0078(Assignment used: 198)
Input error: M-score > 0.5


 Final M-score 0.0526316 9/171

Model ave

 Final Recall-score for input query structures: 0.979718
 Final Precision-score for input query structures: 0.899725

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.968639

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.938
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.8

Model 1

 Final Recall-score for input query structures: 0.982363
 Final Precision-score for input query structures: 0.835321

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.974335

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.903
 F-score of ideal true structures:       0.987
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.639485

Model 2

 Final Recall-score for input query structures: 0.977954
 Final Precision-score for input query structures: 0.847768

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97445

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.908
 F-score of ideal true structures:       0.987
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.660944

Model 3

 Final Recall-score for input query structures: 0.979718
 Final Precision-score for input query structures: 0.847645

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.963042

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.909
 F-score of ideal true structures:       0.981
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.682819

Model 4

 Final Recall-score for input query structures: 0.981481
 Final Precision-score for input query structures: 0.877413

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.974144

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.927
 F-score of ideal true structures:       0.987
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.742489

Model 5

 Final Recall-score for input query structures: 0.983245
 Final Precision-score for input query structures: 0.863565

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.96274

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.92
 F-score of ideal true structures:       0.981
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.731278

Model 6

 Final Recall-score for input query structures: 0.981481
 Final Precision-score for input query structures: 0.850512

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.963942

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.911
 F-score of ideal true structures:       0.982
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.688597

Model 7

 Final Recall-score for input query structures: 0.979718
 Final Precision-score for input query structures: 0.866322

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.972266

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.92
 F-score of ideal true structures:       0.986
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.715517

Model 8

 Final Recall-score for input query structures: 0.979718
 Final Precision-score for input query structures: 0.855825

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.974186

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.914
 F-score of ideal true structures:       0.987
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.686695

Model 9

 Final Recall-score for input query structures: 0.975309
 Final Precision-score for input query structures: 0.824861

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.963133

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.894
 F-score of ideal true structures:       0.981
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.61674

Model 10

 Final Recall-score for input query structures: 0.9806
 Final Precision-score for input query structures: 0.868007

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.962871

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.921
 F-score of ideal true structures:       0.981
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.735683

Model 11

 Final Recall-score for input query structures: 0.979718
 Final Precision-score for input query structures: 0.849808

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.963268

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.91
 F-score of ideal true structures:       0.981
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.687225

Model 12

 Final Recall-score for input query structures: 0.97619
 Final Precision-score for input query structures: 0.858248

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.963997

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.913
 F-score of ideal true structures:       0.982
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.697368

Model 13

 Final Recall-score for input query structures: 0.978836
 Final Precision-score for input query structures: 0.840144

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.975128

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.904
 F-score of ideal true structures:       0.987
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.643777

Model 14

 Final Recall-score for input query structures: 0.978836
 Final Precision-score for input query structures: 0.829119

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.973727

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.898
 F-score of ideal true structures:       0.987
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.618026

Model 15

 Final Recall-score for input query structures: 0.982363
 Final Precision-score for input query structures: 0.84754

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.973722

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.91
 F-score of ideal true structures:       0.987
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.669528

Model 16

 Final Recall-score for input query structures: 0.981481
 Final Precision-score for input query structures: 0.869542

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.972043

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.922
 F-score of ideal true structures:       0.986
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.724138

Model 17

 Final Recall-score for input query structures: 0.981481
 Final Precision-score for input query structures: 0.859578

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.964291

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.916
 F-score of ideal true structures:       0.982
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.710526

Model 18

 Final Recall-score for input query structures: 0.978836
 Final Precision-score for input query structures: 0.837011

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.965701

 Final Recall-score for freely-rotating-chain model: 0.691358
 Final Precision-score for freely-rotating-chain model: 0.83011

 Summary:
 F-score of input query structures:      0.902
 F-score of ideal true structures:       0.983
 F-score of freely-rotating-chain model: 0.754

 DP-Score: 0.646288

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

NOESY_Assign:
      User CPU Time:       12.6 sec.
      Syst CPU Time:       0.25 sec.
Other Processes:
      User CPU Time:        0.3 sec.
      Syst CPU Time:       0.03 sec.

Total Elapsed Time:       13.2 sec.