# created by  ASDP Version 1.0 Copyright(C) 2010
# Tue May 14 13:59:57 2013


# Command: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign 
#		-c /data/PSVS/PSVS-v1.4-dev/results/CTR148A_R3Cons_em_bcr3/rpf_calc/input/ctrl_file 
#		-o rpf_calc 
#		-q CTR148A_R3Cons_em_bcr3.pdb.iupac 


# Summary for n.peaks
Total simulated peaks: 136 Number of peaks NOT matched in the Peak List: 8
M score = 0.059

Average shift in HX: -0.00014 Average ab-shift in HX: 0.00024(Assignment used: 83)
Average shift in X: 0.0047 Average ab-shift in X: 0.0049(Assignment used: 81)
Average shift in HX2: -0.0046 Average ab-shift in HX2: 0.0071(Assignment used: 110)

#For peaklist n.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.106(125/1180) 
Model   1 Inconsistent score: 0.113(133/1180) 
Model   2 Inconsistent score: 0.111(131/1180) 
Model   3 Inconsistent score: 0.114(134/1180) 
Model   4 Inconsistent score: 0.114(134/1180) 
Model   5 Inconsistent score: 0.112(132/1180) 
Model   6 Inconsistent score: 0.107(126/1180) 
Model   7 Inconsistent score: 0.11(130/1180) 
Model   8 Inconsistent score: 0.113(133/1180) 
Model   9 Inconsistent score: 0.114(134/1180) 
Model  10 Inconsistent score: 0.114(135/1180) 
Model  11 Inconsistent score: 0.114(135/1180) 
Model  12 Inconsistent score: 0.111(131/1180) 
Model  13 Inconsistent score: 0.112(132/1180) 
Model  14 Inconsistent score: 0.108(127/1180) 
Model  15 Inconsistent score: 0.108(127/1180) 
Model  16 Inconsistent score: 0.117(138/1180) 
Model  17 Inconsistent score: 0.112(132/1180) 
Model  18 Inconsistent score: 0.113(133/1180) 
Model  19 Inconsistent score: 0.108(128/1180) 
Model  20 Inconsistent score: 0.107(126/1180) 
Model ave  Missing interactions: 0.231 (333/1444)
              weighted: 0.0663 (2.33e+05/3.51e+06)
                    <3: 0.0408 (6/147)
                   <3w: 0.087 (7.52e+04/8.65e+05)
Model   1  Missing interactions: 0.245 (357/1459)
              weighted: 0.0814 (3.17e+05/3.89e+06)
                    <3: 0.0408 (6/147)
                   <3w: 0.0842 (7.2e+04/8.56e+05)
Model   2  Missing interactions: 0.24 (349/1455)
              weighted: 0.0677 (2.52e+05/3.72e+06)
                    <3: 0.0403 (6/149)
                   <3w: 0.0829 (7.3e+04/8.81e+05)
Model   3  Missing interactions: 0.238 (347/1456)
              weighted: 0.0758 (2.82e+05/3.72e+06)
                    <3: 0.0411 (6/146)
                   <3w: 0.0808 (7.17e+04/8.87e+05)
Model   4  Missing interactions: 0.242 (351/1451)
              weighted: 0.0661 (2.5e+05/3.79e+06)
                    <3: 0.0403 (6/149)
                   <3w: 0.0819 (7.27e+04/8.87e+05)
Model   5  Missing interactions: 0.238 (345/1449)
              weighted: 0.0674 (2.48e+05/3.67e+06)
                    <3: 0.04 (6/150)
                   <3w: 0.0823 (7.15e+04/8.68e+05)
Model   6  Missing interactions: 0.249 (371/1489)
              weighted: 0.0747 (2.78e+05/3.73e+06)
                    <3: 0.04 (6/150)
                   <3w: 0.0828 (7.25e+04/8.76e+05)
Model   7  Missing interactions: 0.246 (357/1454)
              weighted: 0.074 (2.82e+05/3.82e+06)
                    <3: 0.0414 (6/145)
                   <3w: 0.0822 (7.24e+04/8.81e+05)
Model   8  Missing interactions: 0.243 (355/1462)
              weighted: 0.0677 (2.5e+05/3.69e+06)
                    <3: 0.0405 (6/148)
                   <3w: 0.0823 (7.24e+04/8.8e+05)
Model   9  Missing interactions: 0.246 (358/1453)
              weighted: 0.0767 (2.93e+05/3.82e+06)
                    <3: 0.0397 (6/151)
                   <3w: 0.0813 (7.3e+04/8.98e+05)
Model  10  Missing interactions: 0.249 (366/1472)
              weighted: 0.0899 (3.49e+05/3.89e+06)
                    <3: 0.0408 (6/147)
                   <3w: 0.0835 (7.27e+04/8.71e+05)
Model  11  Missing interactions: 0.239 (346/1450)
              weighted: 0.0707 (2.6e+05/3.68e+06)
                    <3: 0.0403 (6/149)
                   <3w: 0.0818 (7.24e+04/8.85e+05)
Model  12  Missing interactions: 0.244 (357/1465)
              weighted: 0.0768 (2.85e+05/3.71e+06)
                    <3: 0.0408 (6/147)
                   <3w: 0.0833 (7.19e+04/8.64e+05)
Model  13  Missing interactions: 0.239 (350/1464)
              weighted: 0.0709 (2.57e+05/3.62e+06)
                    <3: 0.0403 (6/149)
                   <3w: 0.0935 (8.37e+04/8.96e+05)
Model  14  Missing interactions: 0.249 (368/1478)
              weighted: 0.0786 (2.98e+05/3.79e+06)
                    <3: 0.04 (6/150)
                   <3w: 0.0821 (7.26e+04/8.84e+05)
Model  15  Missing interactions: 0.24 (350/1461)
              weighted: 0.0747 (2.77e+05/3.71e+06)
                    <3: 0.0405 (6/148)
                   <3w: 0.0822 (7.26e+04/8.84e+05)
Model  16  Missing interactions: 0.247 (360/1459)
              weighted: 0.0716 (2.7e+05/3.77e+06)
                    <3: 0.0403 (6/149)
                   <3w: 0.0831 (7.19e+04/8.66e+05)
Model  17  Missing interactions: 0.239 (349/1463)
              weighted: 0.0711 (2.69e+05/3.79e+06)
                    <3: 0.0403 (6/149)
                   <3w: 0.0835 (7.22e+04/8.64e+05)
Model  18  Missing interactions: 0.24 (351/1460)
              weighted: 0.0716 (2.67e+05/3.73e+06)
                    <3: 0.0408 (6/147)
                   <3w: 0.0832 (7.24e+04/8.7e+05)
Model  19  Missing interactions: 0.244 (358/1466)
              weighted: 0.0728 (2.75e+05/3.78e+06)
                    <3: 0.0405 (6/148)
                   <3w: 0.0833 (7.27e+04/8.73e+05)
Model  20  Missing interactions: 0.238 (351/1472)
              weighted: 0.0727 (2.68e+05/3.69e+06)
                    <3: 0.0405 (6/148)
                   <3w: 0.0933 (8.37e+04/8.97e+05)

Model ave
 Recall: 0.894
 Precision: 
       all: 0.769  allw: 0.934
        <3: 0.959  <3w: 0.913

 F-measure:(Recall,Precision)  0.827
 F-measure:(Recall,PrecisionW) 0.913

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.955

Model 1
 Recall: 0.887
 Precision: 
       all: 0.755  allw: 0.919
        <3: 0.959  <3w: 0.916

 F-measure:(Recall,Precision)  0.816
 F-measure:(Recall,PrecisionW) 0.903

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.956

Model 2
 Recall: 0.889
 Precision: 
       all: 0.76  allw: 0.932
        <3: 0.96  <3w: 0.917

 F-measure:(Recall,Precision)  0.82
 F-measure:(Recall,PrecisionW) 0.91

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 3
 Recall: 0.886
 Precision: 
       all: 0.762  allw: 0.924
        <3: 0.959  <3w: 0.919

 F-measure:(Recall,Precision)  0.819
 F-measure:(Recall,PrecisionW) 0.905

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.958

Model 4
 Recall: 0.886
 Precision: 
       all: 0.758  allw: 0.934
        <3: 0.96  <3w: 0.918

 F-measure:(Recall,Precision)  0.817
 F-measure:(Recall,PrecisionW) 0.91

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 5
 Recall: 0.888
 Precision: 
       all: 0.762  allw: 0.933
        <3: 0.96  <3w: 0.918

 F-measure:(Recall,Precision)  0.82
 F-measure:(Recall,PrecisionW) 0.91

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.957

Model 6
 Recall: 0.893
 Precision: 
       all: 0.751  allw: 0.925
        <3: 0.96  <3w: 0.917

 F-measure:(Recall,Precision)  0.816
 F-measure:(Recall,PrecisionW) 0.909

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.957

Model 7
 Recall: 0.89
 Precision: 
       all: 0.754  allw: 0.926
        <3: 0.959  <3w: 0.918

 F-measure:(Recall,Precision)  0.817
 F-measure:(Recall,PrecisionW) 0.908

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 8
 Recall: 0.887
 Precision: 
       all: 0.757  allw: 0.932
        <3: 0.959  <3w: 0.918

 F-measure:(Recall,Precision)  0.817
 F-measure:(Recall,PrecisionW) 0.909

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 9
 Recall: 0.886
 Precision: 
       all: 0.754  allw: 0.923
        <3: 0.96  <3w: 0.919

 F-measure:(Recall,Precision)  0.815
 F-measure:(Recall,PrecisionW) 0.904

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.958

Model 10
 Recall: 0.886
 Precision: 
       all: 0.751  allw: 0.91
        <3: 0.959  <3w: 0.916

 F-measure:(Recall,Precision)  0.813
 F-measure:(Recall,PrecisionW) 0.898

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.956

Model 11
 Recall: 0.886
 Precision: 
       all: 0.761  allw: 0.929
        <3: 0.96  <3w: 0.918

 F-measure:(Recall,Precision)  0.819
 F-measure:(Recall,PrecisionW) 0.907

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 12
 Recall: 0.889
 Precision: 
       all: 0.756  allw: 0.923
        <3: 0.959  <3w: 0.917

 F-measure:(Recall,Precision)  0.817
 F-measure:(Recall,PrecisionW) 0.906

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 13
 Recall: 0.888
 Precision: 
       all: 0.761  allw: 0.929
        <3: 0.96  <3w: 0.907

 F-measure:(Recall,Precision)  0.82
 F-measure:(Recall,PrecisionW) 0.908

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.951

Model 14
 Recall: 0.892
 Precision: 
       all: 0.751  allw: 0.921
        <3: 0.96  <3w: 0.918

 F-measure:(Recall,Precision)  0.816
 F-measure:(Recall,PrecisionW) 0.907

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.957

Model 15
 Recall: 0.892
 Precision: 
       all: 0.76  allw: 0.925
        <3: 0.959  <3w: 0.918

 F-measure:(Recall,Precision)  0.821
 F-measure:(Recall,PrecisionW) 0.909

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 16
 Recall: 0.883
 Precision: 
       all: 0.753  allw: 0.928
        <3: 0.96  <3w: 0.917

 F-measure:(Recall,Precision)  0.813
 F-measure:(Recall,PrecisionW) 0.905

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 17
 Recall: 0.888
 Precision: 
       all: 0.761  allw: 0.929
        <3: 0.96  <3w: 0.917

 F-measure:(Recall,Precision)  0.82
 F-measure:(Recall,PrecisionW) 0.908

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.956

Model 18
 Recall: 0.887
 Precision: 
       all: 0.76  allw: 0.928
        <3: 0.959  <3w: 0.917

 F-measure:(Recall,Precision)  0.818
 F-measure:(Recall,PrecisionW) 0.907

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 19
 Recall: 0.892
 Precision: 
       all: 0.756  allw: 0.927
        <3: 0.959  <3w: 0.917

 F-measure:(Recall,Precision)  0.818
 F-measure:(Recall,PrecisionW) 0.909

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.957

Model 20
 Recall: 0.893
 Precision: 
       all: 0.762  allw: 0.927
        <3: 0.959  <3w: 0.907

 F-measure:(Recall,Precision)  0.822
 F-measure:(Recall,PrecisionW) 0.91

 F-measure:(0,PrecisionIdeal)  0.979
 F-measure:(0,PrecisionIdealW) 0.951

For freely-rotating-chain model:
Model ave Inconsistent score: 0.422(498/1180) 
Model ave  Missing interactions: 0.146 (104/714)
              weighted: 0.0858 (3.45e+04/4.03e+05)
                    <3: 0.0432 (6/139)
                   <3w: 0.0745 (1.67e+04/2.24e+05)

 Recall: 0.578
 Precision: 
       all: 0.854  allw: 0.914

 F-measure:(RecallFree,PrecisionFree)  0.689
 F-measure:(ReallFree,PrecisionFreeW) 0.708

# Summary for c_aro.peaks
Total simulated peaks: 9 Number of peaks NOT matched in the Peak List: 1
M score = 0.11

Average shift in HX: 0 Average ab-shift in HX: 0(Assignment used: 4)
Average shift in X: 0 Average ab-shift in X: 0(Assignment used: 4)
Average shift in HX2: -0.0026 Average ab-shift in HX2: 0.0044(Assignment used: 8)

#For peaklist c_aro.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.0476(8/168) 
Model   1 Inconsistent score: 0.0595(10/168) 
Model   2 Inconsistent score: 0.0595(10/168) 
Model   3 Inconsistent score: 0.0595(10/168) 
Model   4 Inconsistent score: 0.0714(12/168) 
Model   5 Inconsistent score: 0.0595(10/168) 
Model   6 Inconsistent score: 0.0655(11/168) 
Model   7 Inconsistent score: 0.0655(11/168) 
Model   8 Inconsistent score: 0.0536(9/168) 
Model   9 Inconsistent score: 0.0655(11/168) 
Model  10 Inconsistent score: 0.0595(10/168) 
Model  11 Inconsistent score: 0.0536(9/168) 
Model  12 Inconsistent score: 0.0595(10/168) 
Model  13 Inconsistent score: 0.0536(9/168) 
Model  14 Inconsistent score: 0.0536(9/168) 
Model  15 Inconsistent score: 0.0595(10/168) 
Model  16 Inconsistent score: 0.0536(9/168) 
Model  17 Inconsistent score: 0.0476(8/168) 
Model  18 Inconsistent score: 0.0595(10/168) 
Model  19 Inconsistent score: 0.0595(10/168) 
Model  20 Inconsistent score: 0.0595(10/168) 
Model ave  Missing interactions: 0.357 (110/308)
              weighted: 0.195 (8.1e+04/4.15e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.464 (349/752)
Model   1  Missing interactions: 0.363 (111/306)
              weighted: 0.217 (9.85e+04/4.54e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.477 (349/733)
Model   2  Missing interactions: 0.369 (115/312)
              weighted: 0.202 (9.42e+04/4.66e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.444 (349/786)
Model   3  Missing interactions: 0.359 (112/312)
              weighted: 0.236 (1.16e+05/4.92e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.428 (349/816)
Model   4  Missing interactions: 0.372 (116/312)
              weighted: 0.232 (1.09e+05/4.7e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.481 (344/716)
Model   5  Missing interactions: 0.372 (116/312)
              weighted: 0.216 (1.04e+05/4.8e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.428 (349/816)
Model   6  Missing interactions: 0.364 (116/319)
              weighted: 0.205 (9.9e+04/4.84e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.516 (349/676)
Model   7  Missing interactions: 0.377 (118/313)
              weighted: 0.211 (9.38e+04/4.44e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.496 (354/714)
Model   8  Missing interactions: 0.368 (114/310)
              weighted: 0.219 (1.04e+05/4.73e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.444 (349/786)
Model   9  Missing interactions: 0.365 (112/307)
              weighted: 0.219 (1.02e+05/4.69e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.448 (354/791)
Model  10  Missing interactions: 0.365 (113/310)
              weighted: 0.206 (1e+05/4.86e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.468 (349/745)
Model  11  Missing interactions: 0.364 (112/308)
              weighted: 0.22 (1.12e+05/5.09e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.448 (349/779)
Model  12  Missing interactions: 0.369 (115/312)
              weighted: 0.215 (1.04e+05/4.85e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.464 (349/752)
Model  13  Missing interactions: 0.369 (115/312)
              weighted: 0.21 (1.06e+05/5.06e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.477 (349/733)
Model  14  Missing interactions: 0.371 (116/313)
              weighted: 0.222 (1.06e+05/4.78e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.411 (349/849)
Model  15  Missing interactions: 0.369 (116/314)
              weighted: 0.19 (8.52e+04/4.48e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.428 (344/804)
Model  16  Missing interactions: 0.375 (117/312)
              weighted: 0.264 (1.27e+05/4.81e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.452 (349/772)
Model  17  Missing interactions: 0.365 (116/318)
              weighted: 0.244 (1.23e+05/5.02e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.424 (349/824)
Model  18  Missing interactions: 0.37 (117/316)
              weighted: 0.22 (1.06e+05/4.81e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.419 (354/845)
Model  19  Missing interactions: 0.373 (119/319)
              weighted: 0.195 (9.22e+04/4.73e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.489 (344/704)
Model  20  Missing interactions: 0.377 (122/324)
              weighted: 0.211 (1.09e+05/5.18e+05)
                    <3: 0.667 (2/3)
                   <3w: 0.472 (354/750)

Model ave
 Recall: 0.952
 Precision: 
       all: 0.643  allw: 0.805
        <3: 0.333  <3w: 0.536

 F-measure:(Recall,Precision)  0.768
 F-measure:(Recall,PrecisionW) 0.872

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.698

Model 1
 Recall: 0.94
 Precision: 
       all: 0.637  allw: 0.783
        <3: 0.333  <3w: 0.523

 F-measure:(Recall,Precision)  0.76
 F-measure:(Recall,PrecisionW) 0.854

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.687

Model 2
 Recall: 0.94
 Precision: 
       all: 0.631  allw: 0.798
        <3: 0.333  <3w: 0.556

 F-measure:(Recall,Precision)  0.756
 F-measure:(Recall,PrecisionW) 0.863

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.715

Model 3
 Recall: 0.94
 Precision: 
       all: 0.641  allw: 0.764
        <3: 0.333  <3w: 0.572

 F-measure:(Recall,Precision)  0.762
 F-measure:(Recall,PrecisionW) 0.843

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.728

Model 4
 Recall: 0.929
 Precision: 
       all: 0.628  allw: 0.768
        <3: 0.333  <3w: 0.519

 F-measure:(Recall,Precision)  0.749
 F-measure:(Recall,PrecisionW) 0.841

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.683

Model 5
 Recall: 0.94
 Precision: 
       all: 0.628  allw: 0.784
        <3: 0.333  <3w: 0.572

 F-measure:(Recall,Precision)  0.753
 F-measure:(Recall,PrecisionW) 0.855

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.728

Model 6
 Recall: 0.935
 Precision: 
       all: 0.636  allw: 0.795
        <3: 0.333  <3w: 0.484

 F-measure:(Recall,Precision)  0.757
 F-measure:(Recall,PrecisionW) 0.859

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.652

Model 7
 Recall: 0.935
 Precision: 
       all: 0.623  allw: 0.789
        <3: 0.333  <3w: 0.504

 F-measure:(Recall,Precision)  0.748
 F-measure:(Recall,PrecisionW) 0.856

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.67

Model 8
 Recall: 0.946
 Precision: 
       all: 0.632  allw: 0.781
        <3: 0.333  <3w: 0.556

 F-measure:(Recall,Precision)  0.758
 F-measure:(Recall,PrecisionW) 0.856

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.715

Model 9
 Recall: 0.935
 Precision: 
       all: 0.635  allw: 0.781
        <3: 0.333  <3w: 0.552

 F-measure:(Recall,Precision)  0.756
 F-measure:(Recall,PrecisionW) 0.851

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.712

Model 10
 Recall: 0.94
 Precision: 
       all: 0.635  allw: 0.794
        <3: 0.333  <3w: 0.532

 F-measure:(Recall,Precision)  0.758
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.694

Model 11
 Recall: 0.946
 Precision: 
       all: 0.636  allw: 0.78
        <3: 0.333  <3w: 0.552

 F-measure:(Recall,Precision)  0.761
 F-measure:(Recall,PrecisionW) 0.855

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.711

Model 12
 Recall: 0.94
 Precision: 
       all: 0.631  allw: 0.785
        <3: 0.333  <3w: 0.536

 F-measure:(Recall,Precision)  0.756
 F-measure:(Recall,PrecisionW) 0.856

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.698

Model 13
 Recall: 0.946
 Precision: 
       all: 0.631  allw: 0.79
        <3: 0.333  <3w: 0.523

 F-measure:(Recall,Precision)  0.757
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.687

Model 14
 Recall: 0.946
 Precision: 
       all: 0.629  allw: 0.778
        <3: 0.333  <3w: 0.589

 F-measure:(Recall,Precision)  0.756
 F-measure:(Recall,PrecisionW) 0.854

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.741

Model 15
 Recall: 0.94
 Precision: 
       all: 0.631  allw: 0.81
        <3: 0.333  <3w: 0.572

 F-measure:(Recall,Precision)  0.755
 F-measure:(Recall,PrecisionW) 0.87

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.727

Model 16
 Recall: 0.946
 Precision: 
       all: 0.625  allw: 0.736
        <3: 0.333  <3w: 0.548

 F-measure:(Recall,Precision)  0.753
 F-measure:(Recall,PrecisionW) 0.828

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.708

Model 17
 Recall: 0.952
 Precision: 
       all: 0.635  allw: 0.756
        <3: 0.333  <3w: 0.576

 F-measure:(Recall,Precision)  0.762
 F-measure:(Recall,PrecisionW) 0.843

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.731

Model 18
 Recall: 0.94
 Precision: 
       all: 0.63  allw: 0.78
        <3: 0.333  <3w: 0.581

 F-measure:(Recall,Precision)  0.754
 F-measure:(Recall,PrecisionW) 0.853

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.735

Model 19
 Recall: 0.94
 Precision: 
       all: 0.627  allw: 0.805
        <3: 0.333  <3w: 0.511

 F-measure:(Recall,Precision)  0.752
 F-measure:(Recall,PrecisionW) 0.868

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.676

Model 20
 Recall: 0.94
 Precision: 
       all: 0.623  allw: 0.789
        <3: 0.333  <3w: 0.528

 F-measure:(Recall,Precision)  0.75
 F-measure:(Recall,PrecisionW) 0.858

 F-measure:(0,PrecisionIdeal)  0.5
 F-measure:(0,PrecisionIdealW) 0.691

For freely-rotating-chain model:
Model ave Inconsistent score: 0.821(138/168) 
Model ave  Missing interactions: 0.459 (17/37)
              weighted: 0.498 (3.37e+03/6.76e+03)
                    <3: 1 (2/2)
                   <3w: 1 (1.86e+03/1.86e+03)

 Recall: 0.179
 Precision: 
       all: 0.541  allw: 0.502

 F-measure:(RecallFree,PrecisionFree)  0.268
 F-measure:(ReallFree,PrecisionFreeW) 0.263

# Summary for c_ali.peaks
Total simulated peaks: 608 Number of peaks NOT matched in the Peak List: 125
M score = 0.21

Average shift in HX: 0.00018 Average ab-shift in HX: 0.00036(Assignment used: 247)
Average shift in X: 0.0021 Average ab-shift in X: 0.0049(Assignment used: 197)
Average shift in HX2: -0.0043 Average ab-shift in HX2: 0.0075(Assignment used: 271)

#For peaklist c_ali.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.0839(224/2670) 
Model   1 Inconsistent score: 0.0895(239/2670) 
Model   2 Inconsistent score: 0.0846(226/2670) 
Model   3 Inconsistent score: 0.085(227/2670) 
Model   4 Inconsistent score: 0.082(219/2670) 
Model   5 Inconsistent score: 0.0835(223/2670) 
Model   6 Inconsistent score: 0.0839(224/2670) 
Model   7 Inconsistent score: 0.088(235/2670) 
Model   8 Inconsistent score: 0.085(227/2670) 
Model   9 Inconsistent score: 0.0831(222/2670) 
Model  10 Inconsistent score: 0.085(227/2670) 
Model  11 Inconsistent score: 0.085(227/2670) 
Model  12 Inconsistent score: 0.0828(221/2670) 
Model  13 Inconsistent score: 0.0865(231/2670) 
Model  14 Inconsistent score: 0.0798(213/2670) 
Model  15 Inconsistent score: 0.0824(220/2670) 
Model  16 Inconsistent score: 0.0854(228/2670) 
Model  17 Inconsistent score: 0.0824(220/2670) 
Model  18 Inconsistent score: 0.0865(231/2670) 
Model  19 Inconsistent score: 0.0869(232/2670) 
Model  20 Inconsistent score: 0.0835(223/2670) 
Model ave  Missing interactions: 0.415 (1.76e+03/4238)
              weighted: 0.184 (1.96e+06/1.06e+07)
                    <3: 0.173 (85/491)
                   <3w: 0.136 (6.63e+05/4.89e+06)
Model   1  Missing interactions: 0.42 (1.79e+03/4250)
              weighted: 0.191 (2.2e+06/1.15e+07)
                    <3: 0.173 (85/491)
                   <3w: 0.136 (6.8e+05/4.99e+06)
Model   2  Missing interactions: 0.416 (1.78e+03/4280)
              weighted: 0.188 (2.13e+06/1.13e+07)
                    <3: 0.172 (85/493)
                   <3w: 0.139 (6.97e+05/5.01e+06)
Model   3  Missing interactions: 0.42 (1.81e+03/4312)
              weighted: 0.189 (2.14e+06/1.14e+07)
                    <3: 0.173 (85/490)
                   <3w: 0.139 (6.99e+05/5.03e+06)
Model   4  Missing interactions: 0.417 (1.79e+03/4300)
              weighted: 0.188 (2.11e+06/1.12e+07)
                    <3: 0.173 (85/492)
                   <3w: 0.132 (6.48e+05/4.9e+06)
Model   5  Missing interactions: 0.417 (1.79e+03/4288)
              weighted: 0.188 (2.1e+06/1.12e+07)
                    <3: 0.172 (85/494)
                   <3w: 0.138 (6.81e+05/4.93e+06)
Model   6  Missing interactions: 0.425 (1.84e+03/4328)
              weighted: 0.188 (2.12e+06/1.13e+07)
                    <3: 0.172 (85/494)
                   <3w: 0.139 (6.79e+05/4.88e+06)
Model   7  Missing interactions: 0.421 (1.8e+03/4269)
              weighted: 0.189 (2.14e+06/1.13e+07)
                    <3: 0.174 (85/489)
                   <3w: 0.141 (6.99e+05/4.97e+06)
Model   8  Missing interactions: 0.42 (1.79e+03/4272)
              weighted: 0.184 (2.11e+06/1.14e+07)
                    <3: 0.173 (85/492)
                   <3w: 0.141 (7.08e+05/5e+06)
Model   9  Missing interactions: 0.419 (1.81e+03/4316)
              weighted: 0.188 (2.14e+06/1.14e+07)
                    <3: 0.172 (85/494)
                   <3w: 0.138 (6.85e+05/4.97e+06)
Model  10  Missing interactions: 0.423 (1.82e+03/4296)
              weighted: 0.187 (2.13e+06/1.14e+07)
                    <3: 0.173 (85/491)
                   <3w: 0.139 (6.84e+05/4.93e+06)
Model  11  Missing interactions: 0.417 (1.78e+03/4265)
              weighted: 0.187 (2.13e+06/1.14e+07)
                    <3: 0.172 (85/493)
                   <3w: 0.141 (7.09e+05/5.04e+06)
Model  12  Missing interactions: 0.422 (1.8e+03/4267)
              weighted: 0.188 (2.13e+06/1.13e+07)
                    <3: 0.173 (85/490)
                   <3w: 0.141 (6.93e+05/4.93e+06)
Model  13  Missing interactions: 0.421 (1.81e+03/4300)
              weighted: 0.188 (2.13e+06/1.13e+07)
                    <3: 0.172 (85/493)
                   <3w: 0.14 (7.02e+05/5.02e+06)
Model  14  Missing interactions: 0.424 (1.85e+03/4371)
              weighted: 0.191 (2.21e+06/1.16e+07)
                    <3: 0.172 (85/493)
                   <3w: 0.142 (7.02e+05/4.96e+06)
Model  15  Missing interactions: 0.42 (1.8e+03/4290)
              weighted: 0.189 (2.12e+06/1.13e+07)
                    <3: 0.173 (85/491)
                   <3w: 0.136 (6.73e+05/4.94e+06)
Model  16  Missing interactions: 0.422 (1.81e+03/4301)
              weighted: 0.189 (2.18e+06/1.15e+07)
                    <3: 0.172 (85/493)
                   <3w: 0.14 (6.89e+05/4.93e+06)
Model  17  Missing interactions: 0.418 (1.81e+03/4316)
              weighted: 0.189 (2.19e+06/1.16e+07)
                    <3: 0.172 (85/493)
                   <3w: 0.141 (7.09e+05/5.03e+06)
Model  18  Missing interactions: 0.422 (1.82e+03/4301)
              weighted: 0.191 (2.19e+06/1.15e+07)
                    <3: 0.173 (85/491)
                   <3w: 0.141 (7.02e+05/4.96e+06)
Model  19  Missing interactions: 0.42 (1.81e+03/4307)
              weighted: 0.192 (2.18e+06/1.14e+07)
                    <3: 0.173 (85/491)
                   <3w: 0.133 (6.56e+05/4.93e+06)
Model  20  Missing interactions: 0.422 (1.82e+03/4325)
              weighted: 0.187 (2.15e+06/1.15e+07)
                    <3: 0.173 (85/492)
                   <3w: 0.143 (7.14e+05/4.99e+06)

Model ave
 Recall: 0.916
 Precision: 
       all: 0.585  allw: 0.816
        <3: 0.827  <3w: 0.864

 F-measure:(Recall,Precision)  0.714
 F-measure:(Recall,PrecisionW) 0.863

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.927

Model 1
 Recall: 0.91
 Precision: 
       all: 0.58  allw: 0.809
        <3: 0.827  <3w: 0.864

 F-measure:(Recall,Precision)  0.708
 F-measure:(Recall,PrecisionW) 0.857

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.927

Model 2
 Recall: 0.915
 Precision: 
       all: 0.584  allw: 0.812
        <3: 0.828  <3w: 0.861

 F-measure:(Recall,Precision)  0.713
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.925

Model 3
 Recall: 0.915
 Precision: 
       all: 0.58  allw: 0.811
        <3: 0.827  <3w: 0.861

 F-measure:(Recall,Precision)  0.71
 F-measure:(Recall,PrecisionW) 0.86

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.925

Model 4
 Recall: 0.918
 Precision: 
       all: 0.583  allw: 0.812
        <3: 0.827  <3w: 0.868

 F-measure:(Recall,Precision)  0.713
 F-measure:(Recall,PrecisionW) 0.862

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.929

Model 5
 Recall: 0.916
 Precision: 
       all: 0.583  allw: 0.812
        <3: 0.828  <3w: 0.862

 F-measure:(Recall,Precision)  0.713
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.926

Model 6
 Recall: 0.916
 Precision: 
       all: 0.575  allw: 0.812
        <3: 0.828  <3w: 0.861

 F-measure:(Recall,Precision)  0.707
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.925

Model 7
 Recall: 0.912
 Precision: 
       all: 0.579  allw: 0.811
        <3: 0.826  <3w: 0.859

 F-measure:(Recall,Precision)  0.708
 F-measure:(Recall,PrecisionW) 0.859

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.924

Model 8
 Recall: 0.915
 Precision: 
       all: 0.58  allw: 0.816
        <3: 0.827  <3w: 0.859

 F-measure:(Recall,Precision)  0.71
 F-measure:(Recall,PrecisionW) 0.862

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.924

Model 9
 Recall: 0.917
 Precision: 
       all: 0.581  allw: 0.812
        <3: 0.828  <3w: 0.862

 F-measure:(Recall,Precision)  0.711
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.926

Model 10
 Recall: 0.915
 Precision: 
       all: 0.577  allw: 0.813
        <3: 0.827  <3w: 0.861

 F-measure:(Recall,Precision)  0.708
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.926

Model 11
 Recall: 0.915
 Precision: 
       all: 0.583  allw: 0.813
        <3: 0.828  <3w: 0.859

 F-measure:(Recall,Precision)  0.712
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.924

Model 12
 Recall: 0.917
 Precision: 
       all: 0.578  allw: 0.812
        <3: 0.827  <3w: 0.859

 F-measure:(Recall,Precision)  0.709
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.924

Model 13
 Recall: 0.913
 Precision: 
       all: 0.579  allw: 0.812
        <3: 0.828  <3w: 0.86

 F-measure:(Recall,Precision)  0.709
 F-measure:(Recall,PrecisionW) 0.86

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.925

Model 14
 Recall: 0.92
 Precision: 
       all: 0.576  allw: 0.809
        <3: 0.828  <3w: 0.858

 F-measure:(Recall,Precision)  0.709
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.924

Model 15
 Recall: 0.918
 Precision: 
       all: 0.58  allw: 0.811
        <3: 0.827  <3w: 0.864

 F-measure:(Recall,Precision)  0.711
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.927

Model 16
 Recall: 0.915
 Precision: 
       all: 0.578  allw: 0.811
        <3: 0.828  <3w: 0.86

 F-measure:(Recall,Precision)  0.709
 F-measure:(Recall,PrecisionW) 0.86

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.925

Model 17
 Recall: 0.918
 Precision: 
       all: 0.582  allw: 0.811
        <3: 0.828  <3w: 0.859

 F-measure:(Recall,Precision)  0.712
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.906
 F-measure:(0,PrecisionIdealW) 0.924

Model 18
 Recall: 0.913
 Precision: 
       all: 0.578  allw: 0.809
        <3: 0.827  <3w: 0.859

 F-measure:(Recall,Precision)  0.708
 F-measure:(Recall,PrecisionW) 0.858

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.924

Model 19
 Recall: 0.913
 Precision: 
       all: 0.58  allw: 0.808
        <3: 0.827  <3w: 0.867

 F-measure:(Recall,Precision)  0.709
 F-measure:(Recall,PrecisionW) 0.858

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.929

Model 20
 Recall: 0.916
 Precision: 
       all: 0.578  allw: 0.813
        <3: 0.827  <3w: 0.857

 F-measure:(Recall,Precision)  0.709
 F-measure:(Recall,PrecisionW) 0.861

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.923

For freely-rotating-chain model:
Model ave Inconsistent score: 0.506(1352/2670) 
Model ave  Missing interactions: 0.373 (598/1603)
              weighted: 0.245 (2.88e+05/1.18e+06)
                    <3: 0.176 (85/484)
                   <3w: 0.202 (1.62e+05/8e+05)

 Recall: 0.494
 Precision: 
       all: 0.627  allw: 0.755

 F-measure:(RecallFree,PrecisionFree)  0.552
 F-measure:(ReallFree,PrecisionFreeW) 0.597


 Final M-score 0.178 134/753

Model ave

 Final Recall-score for input query structures: 0.911
 Final Precision-score for input query structures: 0.844

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.872

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.876
 F-score of ideal true structures:       0.931
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.824

Model 1

 Final Recall-score for input query structures: 0.905
 Final Precision-score for input query structures: 0.835

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.871

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.869
 F-score of ideal true structures:       0.931
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.802

Model 2

 Final Recall-score for input query structures: 0.909
 Final Precision-score for input query structures: 0.84

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.869

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.873
 F-score of ideal true structures:       0.93
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.817

Model 3

 Final Recall-score for input query structures: 0.908
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.87

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.871
 F-score of ideal true structures:       0.93
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.811

Model 4

 Final Recall-score for input query structures: 0.909
 Final Precision-score for input query structures: 0.84

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.875

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.873
 F-score of ideal true structures:       0.934
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.807

Model 5

 Final Recall-score for input query structures: 0.909
 Final Precision-score for input query structures: 0.84

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.87

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.873
 F-score of ideal true structures:       0.931
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.815

Model 6

 Final Recall-score for input query structures: 0.91
 Final Precision-score for input query structures: 0.839

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.87

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.873
 F-score of ideal true structures:       0.93
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.817

Model 7

 Final Recall-score for input query structures: 0.906
 Final Precision-score for input query structures: 0.839

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.868

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.871
 F-score of ideal true structures:       0.929
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.814

Model 8

 Final Recall-score for input query structures: 0.908
 Final Precision-score for input query structures: 0.842

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.867

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.874
 F-score of ideal true structures:       0.929
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.823

Model 9

 Final Recall-score for input query structures: 0.909
 Final Precision-score for input query structures: 0.838

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.871

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.872
 F-score of ideal true structures:       0.931
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.812

Model 10

 Final Recall-score for input query structures: 0.907
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.87

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.871
 F-score of ideal true structures:       0.93
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.811

Model 11

 Final Recall-score for input query structures: 0.908
 Final Precision-score for input query structures: 0.839

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.868

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.872
 F-score of ideal true structures:       0.929
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.817

Model 12

 Final Recall-score for input query structures: 0.91
 Final Precision-score for input query structures: 0.838

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.868

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.872
 F-score of ideal true structures:       0.929
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.817

Model 13

 Final Recall-score for input query structures: 0.907
 Final Precision-score for input query structures: 0.839

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.867

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.872
 F-score of ideal true structures:       0.929
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.817

Model 14

 Final Recall-score for input query structures: 0.913
 Final Precision-score for input query structures: 0.835

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.867

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.872
 F-score of ideal true structures:       0.929
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.817

Model 15

 Final Recall-score for input query structures: 0.911
 Final Precision-score for input query structures: 0.839

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.872

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.873
 F-score of ideal true structures:       0.932
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.812

Model 16

 Final Recall-score for input query structures: 0.907
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.869

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.87
 F-score of ideal true structures:       0.93
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.808

Model 17

 Final Recall-score for input query structures: 0.91
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.867

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.872
 F-score of ideal true structures:       0.929
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.817

Model 18

 Final Recall-score for input query structures: 0.907
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.867

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.87
 F-score of ideal true structures:       0.929
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.81

Model 19

 Final Recall-score for input query structures: 0.908
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.874

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.871
 F-score of ideal true structures:       0.933
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.803

Model 20

 Final Recall-score for input query structures: 0.911
 Final Precision-score for input query structures: 0.839

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.864

 Final Recall-score for freely-rotating-chain model: 0.505
 Final Precision-score for freely-rotating-chain model: 0.795

 Summary:
 F-score of input query structures:      0.873
 F-score of ideal true structures:       0.927
 F-score of freely-rotating-chain model: 0.618

 DP-Score: 0.825

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

NOESY_Assign:
      User CPU Time:         63 sec.
      Syst CPU Time:       0.65 sec.
Other Processes:
      User CPU Time:       0.64 sec.
      Syst CPU Time:       0.06 sec.

Total Elapsed Time:       64.4 sec. 
