# created by  ASDP Version 1.0 Copyright(C) 2010
# Fri May 10 16:56:36 2013


# Command: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign 
#		-c /data/PSVS/PSVS-v1.4-dev/results/SR213_R3_em_bcr3/rpf_calc/input/ctrl_file 
#		-o rpf_calc 
#		-q SR213_R3_em_bcr3.pdb.iupac 


# Summary for n.peaks
Total simulated peaks: 143 Number of peaks NOT matched in the Peak List: 3
M score = 0.021

Average shift in HX: 0.00018 Average ab-shift in HX: 0.0025(Assignment used: 104)
Average shift in X: 0.0046 Average ab-shift in X: 0.025(Assignment used: 99)
Average shift in HX2: -0.0003 Average ab-shift in HX2: 0.0025(Assignment used: 138)

#For peaklist n.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.0333(53/1593) 
Model   1 Inconsistent score: 0.0264(42/1593) 
Model   2 Inconsistent score: 0.0314(50/1593) 
Model   3 Inconsistent score: 0.0276(44/1593) 
Model   4 Inconsistent score: 0.0282(45/1593) 
Model   5 Inconsistent score: 0.0308(49/1593) 
Model   6 Inconsistent score: 0.0364(58/1593) 
Model   7 Inconsistent score: 0.0282(45/1593) 
Model   8 Inconsistent score: 0.0264(42/1593) 
Model   9 Inconsistent score: 0.0295(47/1593) 
Model  10 Inconsistent score: 0.0301(48/1593) 
Model  11 Inconsistent score: 0.0251(40/1593) 
Model  12 Inconsistent score: 0.0333(53/1593) 
Model  13 Inconsistent score: 0.0314(50/1593) 
Model  14 Inconsistent score: 0.0333(53/1593) 
Model  15 Inconsistent score: 0.0295(47/1593) 
Model  16 Inconsistent score: 0.0364(58/1593) 
Model  17 Inconsistent score: 0.0345(55/1593) 
Model  18 Inconsistent score: 0.0326(52/1593) 
Model  19 Inconsistent score: 0.0326(52/1593) 
Model  20 Inconsistent score: 0.0345(55/1593) 
Model ave  Missing interactions: 0.24 (399/1661)
              weighted: 0.0421 (1.47e+05/3.49e+06)
                    <3: 0.00671 (1/149)
                   <3w: 0.00459 (3.62e+03/7.87e+05)
Model   1  Missing interactions: 0.278 (507/1823)
              weighted: 0.0619 (2.52e+05/4.08e+06)
                    <3: 0.00637 (1/157)
                   <3w: 0.00435 (3.5e+03/8.06e+05)
Model   2  Missing interactions: 0.268 (481/1793)
              weighted: 0.0638 (2.59e+05/4.06e+06)
                    <3: 0.00633 (1/158)
                   <3w: 0.00402 (3.29e+03/8.19e+05)
Model   3  Missing interactions: 0.267 (483/1808)
              weighted: 0.0485 (1.93e+05/3.98e+06)
                    <3: 0.00641 (1/156)
                   <3w: 0.00477 (3.89e+03/8.16e+05)
Model   4  Missing interactions: 0.266 (478/1796)
              weighted: 0.0537 (2.17e+05/4.03e+06)
                    <3: 0.00633 (1/158)
                   <3w: 0.00454 (3.65e+03/8.06e+05)
Model   5  Missing interactions: 0.262 (473/1804)
              weighted: 0.0529 (2.13e+05/4.04e+06)
                    <3: 0.00645 (1/155)
                   <3w: 0.00469 (3.73e+03/7.96e+05)
Model   6  Missing interactions: 0.267 (475/1781)
              weighted: 0.049 (2e+05/4.08e+06)
                    <3: 0.00641 (1/156)
                   <3w: 0.00487 (4.06e+03/8.35e+05)
Model   7  Missing interactions: 0.262 (465/1778)
              weighted: 0.0537 (2.1e+05/3.92e+06)
                    <3: 0.00649 (1/154)
                   <3w: 0.00408 (3.29e+03/8.08e+05)
Model   8  Missing interactions: 0.262 (471/1795)
              weighted: 0.0576 (2.29e+05/3.98e+06)
                    <3: 0.00625 (1/160)
                   <3w: 0.00426 (3.58e+03/8.39e+05)
Model   9  Missing interactions: 0.273 (490/1792)
              weighted: 0.047 (1.85e+05/3.94e+06)
                    <3: 0.00637 (1/157)
                   <3w: 0.00474 (3.81e+03/8.05e+05)
Model  10  Missing interactions: 0.267 (478/1787)
              weighted: 0.0512 (2.03e+05/3.97e+06)
                    <3: 0.00633 (1/158)
                   <3w: 0.00431 (3.43e+03/7.96e+05)
Model  11  Missing interactions: 0.269 (489/1817)
              weighted: 0.0549 (2.19e+05/3.98e+06)
                    <3: 0.00633 (1/158)
                   <3w: 0.0042 (3.43e+03/8.18e+05)
Model  12  Missing interactions: 0.267 (481/1803)
              weighted: 0.0585 (2.33e+05/3.98e+06)
                    <3: 0.00625 (1/160)
                   <3w: 0.00482 (3.89e+03/8.08e+05)
Model  13  Missing interactions: 0.264 (472/1788)
              weighted: 0.0533 (2.12e+05/3.97e+06)
                    <3: 0.00649 (1/154)
                   <3w: 0.00433 (3.5e+03/8.09e+05)
Model  14  Missing interactions: 0.258 (454/1762)
              weighted: 0.0503 (2e+05/3.97e+06)
                    <3: 0.00641 (1/156)
                   <3w: 0.00398 (3.23e+03/8.11e+05)
Model  15  Missing interactions: 0.26 (464/1788)
              weighted: 0.0617 (2.44e+05/3.96e+06)
                    <3: 0.00641 (1/156)
                   <3w: 0.00474 (3.81e+03/8.04e+05)
Model  16  Missing interactions: 0.281 (509/1809)
              weighted: 0.0566 (2.25e+05/3.97e+06)
                    <3: 0.00625 (1/160)
                   <3w: 0.00402 (3.23e+03/8.03e+05)
Model  17  Missing interactions: 0.266 (476/1790)
              weighted: 0.0565 (2.25e+05/3.98e+06)
                    <3: 0.00645 (1/155)
                   <3w: 0.00455 (3.65e+03/8.04e+05)
Model  18  Missing interactions: 0.273 (494/1807)
              weighted: 0.0639 (2.61e+05/4.09e+06)
                    <3: 0.00621 (1/161)
                   <3w: 0.00442 (3.58e+03/8.1e+05)
Model  19  Missing interactions: 0.27 (486/1803)
              weighted: 0.0478 (1.94e+05/4.06e+06)
                    <3: 0.00654 (1/153)
                   <3w: 0.00474 (3.89e+03/8.21e+05)
Model  20  Missing interactions: 0.278 (502/1804)
              weighted: 0.0662 (2.66e+05/4.01e+06)
                    <3: 0.00621 (1/161)
                   <3w: 0.00431 (3.5e+03/8.13e+05)

Model ave
 Recall: 0.967
 Precision: 
       all: 0.76  allw: 0.958
        <3: 0.993  <3w: 0.995

 F-measure:(Recall,Precision)  0.851
 F-measure:(Recall,PrecisionW) 0.962

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 1
 Recall: 0.974
 Precision: 
       all: 0.722  allw: 0.938
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.829
 F-measure:(Recall,PrecisionW) 0.956

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 2
 Recall: 0.969
 Precision: 
       all: 0.732  allw: 0.936
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.834
 F-measure:(Recall,PrecisionW) 0.952

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 3
 Recall: 0.972
 Precision: 
       all: 0.733  allw: 0.952
        <3: 0.994  <3w: 0.995

 F-measure:(Recall,Precision)  0.836
 F-measure:(Recall,PrecisionW) 0.962

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 4
 Recall: 0.972
 Precision: 
       all: 0.734  allw: 0.946
        <3: 0.994  <3w: 0.995

 F-measure:(Recall,Precision)  0.836
 F-measure:(Recall,PrecisionW) 0.959

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 5
 Recall: 0.969
 Precision: 
       all: 0.738  allw: 0.947
        <3: 0.994  <3w: 0.995

 F-measure:(Recall,Precision)  0.838
 F-measure:(Recall,PrecisionW) 0.958

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 6
 Recall: 0.964
 Precision: 
       all: 0.733  allw: 0.951
        <3: 0.994  <3w: 0.995

 F-measure:(Recall,Precision)  0.833
 F-measure:(Recall,PrecisionW) 0.957

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 7
 Recall: 0.972
 Precision: 
       all: 0.738  allw: 0.946
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.839
 F-measure:(Recall,PrecisionW) 0.959

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 8
 Recall: 0.974
 Precision: 
       all: 0.738  allw: 0.942
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.839
 F-measure:(Recall,PrecisionW) 0.958

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 9
 Recall: 0.97
 Precision: 
       all: 0.727  allw: 0.953
        <3: 0.994  <3w: 0.995

 F-measure:(Recall,Precision)  0.831
 F-measure:(Recall,PrecisionW) 0.962

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 10
 Recall: 0.97
 Precision: 
       all: 0.733  allw: 0.949
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.835
 F-measure:(Recall,PrecisionW) 0.959

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 11
 Recall: 0.975
 Precision: 
       all: 0.731  allw: 0.945
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.835
 F-measure:(Recall,PrecisionW) 0.96

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 12
 Recall: 0.967
 Precision: 
       all: 0.733  allw: 0.941
        <3: 0.994  <3w: 0.995

 F-measure:(Recall,Precision)  0.834
 F-measure:(Recall,PrecisionW) 0.954

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 13
 Recall: 0.969
 Precision: 
       all: 0.736  allw: 0.947
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.836
 F-measure:(Recall,PrecisionW) 0.958

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 14
 Recall: 0.967
 Precision: 
       all: 0.742  allw: 0.95
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.84
 F-measure:(Recall,PrecisionW) 0.958

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 15
 Recall: 0.97
 Precision: 
       all: 0.74  allw: 0.938
        <3: 0.994  <3w: 0.995

 F-measure:(Recall,Precision)  0.84
 F-measure:(Recall,PrecisionW) 0.954

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 16
 Recall: 0.964
 Precision: 
       all: 0.719  allw: 0.943
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.823
 F-measure:(Recall,PrecisionW) 0.953

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 17
 Recall: 0.965
 Precision: 
       all: 0.734  allw: 0.944
        <3: 0.994  <3w: 0.995

 F-measure:(Recall,Precision)  0.834
 F-measure:(Recall,PrecisionW) 0.954

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 18
 Recall: 0.967
 Precision: 
       all: 0.727  allw: 0.936
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.83
 F-measure:(Recall,PrecisionW) 0.951

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 19
 Recall: 0.967
 Precision: 
       all: 0.73  allw: 0.952
        <3: 0.993  <3w: 0.995

 F-measure:(Recall,Precision)  0.832
 F-measure:(Recall,PrecisionW) 0.96

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

Model 20
 Recall: 0.965
 Precision: 
       all: 0.722  allw: 0.934
        <3: 0.994  <3w: 0.996

 F-measure:(Recall,Precision)  0.826
 F-measure:(Recall,PrecisionW) 0.949

 F-measure:(0,PrecisionIdeal)  0.997
 F-measure:(0,PrecisionIdealW) 0.998

For freely-rotating-chain model:
Model ave Inconsistent score: 0.325(517/1593) 
Model ave  Missing interactions: 0.0929 (72/775)
              weighted: 0.0434 (1.9e+04/4.39e+05)
                    <3: 0.0134 (2/149)
                   <3w: 0.0276 (6.49e+03/2.35e+05)

 Recall: 0.675
 Precision: 
       all: 0.907  allw: 0.957

 F-measure:(RecallFree,PrecisionFree)  0.774
 F-measure:(ReallFree,PrecisionFreeW) 0.792

# Summary for c_aro.peaks
Total simulated peaks: 26 Number of peaks NOT matched in the Peak List: 1
M score = 0.038

Average shift in HX: -0.0028 Average ab-shift in HX: 0.0036(Assignment used: 14)
Average shift in X: 0.035 Average ab-shift in X: 0.046(Assignment used: 14)
Average shift in HX2: -0.0018 Average ab-shift in HX2: 0.0037(Assignment used: 24)

#For peaklist c_aro.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.175(49/280) 
Model   1 Inconsistent score: 0.0714(20/280) 
Model   2 Inconsistent score: 0.0929(26/280) 
Model   3 Inconsistent score: 0.0786(22/280) 
Model   4 Inconsistent score: 0.129(36/280) 
Model   5 Inconsistent score: 0.125(35/280) 
Model   6 Inconsistent score: 0.146(41/280) 
Model   7 Inconsistent score: 0.0964(27/280) 
Model   8 Inconsistent score: 0.0929(26/280) 
Model   9 Inconsistent score: 0.0893(25/280) 
Model  10 Inconsistent score: 0.0893(25/280) 
Model  11 Inconsistent score: 0.075(21/280) 
Model  12 Inconsistent score: 0.0929(26/280) 
Model  13 Inconsistent score: 0.0821(23/280) 
Model  14 Inconsistent score: 0.0857(24/280) 
Model  15 Inconsistent score: 0.1(28/280) 
Model  16 Inconsistent score: 0.143(40/280) 
Model  17 Inconsistent score: 0.107(30/280) 
Model  18 Inconsistent score: 0.0964(27/280) 
Model  19 Inconsistent score: 0.0821(23/280) 
Model  20 Inconsistent score: 0.0893(25/280) 
Model ave  Missing interactions: 0.463 (177/382)
              weighted: 0.15 (6.2e+04/4.14e+05)
                    <3: 0.174 (4/23)
                   <3w: 0.00399 (465/1.17e+05)
Model   1  Missing interactions: 0.498 (250/502)
              weighted: 0.232 (1.69e+05/7.29e+05)
                    <3: 0.1 (2/20)
                   <3w: 0.0029 (339/1.17e+05)
Model   2  Missing interactions: 0.498 (236/474)
              weighted: 0.242 (1.68e+05/6.96e+05)
                    <3: 0.136 (3/22)
                   <3w: 0.00343 (404/1.18e+05)
Model   3  Missing interactions: 0.506 (256/506)
              weighted: 0.248 (1.97e+05/7.92e+05)
                    <3: 0.1 (2/20)
                   <3w: 0.0029 (339/1.17e+05)
Model   4  Missing interactions: 0.531 (252/475)
              weighted: 0.196 (1.24e+05/6.31e+05)
                    <3: 0.174 (4/23)
                   <3w: 0.004 (467/1.17e+05)
Model   5  Missing interactions: 0.501 (228/455)
              weighted: 0.221 (1.5e+05/6.78e+05)
                    <3: 0.1 (2/20)
                   <3w: 0.0029 (339/1.17e+05)
Model   6  Missing interactions: 0.526 (251/477)
              weighted: 0.284 (2.07e+05/7.31e+05)
                    <3: 0.0952 (2/21)
                   <3w: 0.0029 (339/1.17e+05)
Model   7  Missing interactions: 0.499 (241/483)
              weighted: 0.232 (1.61e+05/6.93e+05)
                    <3: 0.174 (4/23)
                   <3w: 0.00405 (467/1.15e+05)
Model   8  Missing interactions: 0.506 (253/500)
              weighted: 0.241 (1.85e+05/7.67e+05)
                    <3: 0.0952 (2/21)
                   <3w: 0.0029 (339/1.17e+05)
Model   9  Missing interactions: 0.504 (242/480)
              weighted: 0.202 (1.39e+05/6.88e+05)
                    <3: 0.0952 (2/21)
                   <3w: 0.00291 (339/1.17e+05)
Model  10  Missing interactions: 0.497 (246/495)
              weighted: 0.238 (1.71e+05/7.19e+05)
                    <3: 0.167 (4/24)
                   <3w: 0.004 (462/1.15e+05)
Model  11  Missing interactions: 0.509 (263/517)
              weighted: 0.164 (1.27e+05/7.77e+05)
                    <3: 0.0952 (2/21)
                   <3w: 0.0029 (339/1.17e+05)
Model  12  Missing interactions: 0.52 (266/512)
              weighted: 0.175 (1.24e+05/7.09e+05)
                    <3: 0.0952 (2/21)
                   <3w: 0.0029 (339/1.17e+05)
Model  13  Missing interactions: 0.505 (252/499)
              weighted: 0.24 (1.81e+05/7.55e+05)
                    <3: 0.1 (2/20)
                   <3w: 0.00292 (339/1.16e+05)
Model  14  Missing interactions: 0.512 (260/508)
              weighted: 0.232 (1.76e+05/7.58e+05)
                    <3: 0.154 (4/26)
                   <3w: 0.00398 (462/1.16e+05)
Model  15  Missing interactions: 0.519 (263/507)
              weighted: 0.233 (1.72e+05/7.4e+05)
                    <3: 0.13 (3/23)
                   <3w: 0.00345 (404/1.17e+05)
Model  16  Missing interactions: 0.514 (240/467)
              weighted: 0.245 (1.76e+05/7.17e+05)
                    <3: 0.0952 (2/21)
                   <3w: 0.0029 (339/1.17e+05)
Model  17  Missing interactions: 0.515 (254/493)
              weighted: 0.21 (1.61e+05/7.69e+05)
                    <3: 0.0952 (2/21)
                   <3w: 0.0029 (339/1.17e+05)
Model  18  Missing interactions: 0.508 (253/498)
              weighted: 0.218 (1.7e+05/7.8e+05)
                    <3: 0.0909 (2/22)
                   <3w: 0.00289 (339/1.18e+05)
Model  19  Missing interactions: 0.498 (245/492)
              weighted: 0.232 (1.72e+05/7.42e+05)
                    <3: 0.0952 (2/21)
                   <3w: 0.00291 (339/1.16e+05)
Model  20  Missing interactions: 0.505 (242/479)
              weighted: 0.175 (1.21e+05/6.92e+05)
                    <3: 0.167 (4/24)
                   <3w: 0.004 (462/1.15e+05)

Model ave
 Recall: 0.825
 Precision: 
       all: 0.537  allw: 0.85
        <3: 0.826  <3w: 0.996

 F-measure:(Recall,Precision)  0.65
 F-measure:(Recall,PrecisionW) 0.837

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.998

Model 1
 Recall: 0.929
 Precision: 
       all: 0.502  allw: 0.768
        <3: 0.9  <3w: 0.997

 F-measure:(Recall,Precision)  0.652
 F-measure:(Recall,PrecisionW) 0.841

 F-measure:(0,PrecisionIdeal)  0.947
 F-measure:(0,PrecisionIdealW) 0.999

Model 2
 Recall: 0.907
 Precision: 
       all: 0.502  allw: 0.758
        <3: 0.864  <3w: 0.997

 F-measure:(Recall,Precision)  0.646
 F-measure:(Recall,PrecisionW) 0.826

 F-measure:(0,PrecisionIdeal)  0.927
 F-measure:(0,PrecisionIdealW) 0.998

Model 3
 Recall: 0.921
 Precision: 
       all: 0.494  allw: 0.752
        <3: 0.9  <3w: 0.997

 F-measure:(Recall,Precision)  0.643
 F-measure:(Recall,PrecisionW) 0.828

 F-measure:(0,PrecisionIdeal)  0.947
 F-measure:(0,PrecisionIdealW) 0.999

Model 4
 Recall: 0.871
 Precision: 
       all: 0.469  allw: 0.804
        <3: 0.826  <3w: 0.996

 F-measure:(Recall,Precision)  0.61
 F-measure:(Recall,PrecisionW) 0.836

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.998

Model 5
 Recall: 0.875
 Precision: 
       all: 0.499  allw: 0.779
        <3: 0.9  <3w: 0.997

 F-measure:(Recall,Precision)  0.635
 F-measure:(Recall,PrecisionW) 0.824

 F-measure:(0,PrecisionIdeal)  0.947
 F-measure:(0,PrecisionIdealW) 0.999

Model 6
 Recall: 0.854
 Precision: 
       all: 0.474  allw: 0.716
        <3: 0.905  <3w: 0.997

 F-measure:(Recall,Precision)  0.609
 F-measure:(Recall,PrecisionW) 0.779

 F-measure:(0,PrecisionIdeal)  0.95
 F-measure:(0,PrecisionIdealW) 0.999

Model 7
 Recall: 0.904
 Precision: 
       all: 0.501  allw: 0.768
        <3: 0.826  <3w: 0.996

 F-measure:(Recall,Precision)  0.645
 F-measure:(Recall,PrecisionW) 0.831

 F-measure:(0,PrecisionIdeal)  0.905
 F-measure:(0,PrecisionIdealW) 0.998

Model 8
 Recall: 0.907
 Precision: 
       all: 0.494  allw: 0.759
        <3: 0.905  <3w: 0.997

 F-measure:(Recall,Precision)  0.64
 F-measure:(Recall,PrecisionW) 0.827

 F-measure:(0,PrecisionIdeal)  0.95
 F-measure:(0,PrecisionIdealW) 0.999

Model 9
 Recall: 0.911
 Precision: 
       all: 0.496  allw: 0.798
        <3: 0.905  <3w: 0.997

 F-measure:(Recall,Precision)  0.642
 F-measure:(Recall,PrecisionW) 0.851

 F-measure:(0,PrecisionIdeal)  0.95
 F-measure:(0,PrecisionIdealW) 0.999

Model 10
 Recall: 0.911
 Precision: 
       all: 0.503  allw: 0.762
        <3: 0.833  <3w: 0.996

 F-measure:(Recall,Precision)  0.648
 F-measure:(Recall,PrecisionW) 0.83

 F-measure:(0,PrecisionIdeal)  0.909
 F-measure:(0,PrecisionIdealW) 0.998

Model 11
 Recall: 0.925
 Precision: 
       all: 0.491  allw: 0.836
        <3: 0.905  <3w: 0.997

 F-measure:(Recall,Precision)  0.642
 F-measure:(Recall,PrecisionW) 0.878

 F-measure:(0,PrecisionIdeal)  0.95
 F-measure:(0,PrecisionIdealW) 0.999

Model 12
 Recall: 0.907
 Precision: 
       all: 0.48  allw: 0.825
        <3: 0.905  <3w: 0.997

 F-measure:(Recall,Precision)  0.628
 F-measure:(Recall,PrecisionW) 0.864

 F-measure:(0,PrecisionIdeal)  0.95
 F-measure:(0,PrecisionIdealW) 0.999

Model 13
 Recall: 0.918
 Precision: 
       all: 0.495  allw: 0.76
        <3: 0.9  <3w: 0.997

 F-measure:(Recall,Precision)  0.643
 F-measure:(Recall,PrecisionW) 0.831

 F-measure:(0,PrecisionIdeal)  0.947
 F-measure:(0,PrecisionIdealW) 0.999

Model 14
 Recall: 0.914
 Precision: 
       all: 0.488  allw: 0.768
        <3: 0.846  <3w: 0.996

 F-measure:(Recall,Precision)  0.637
 F-measure:(Recall,PrecisionW) 0.835

 F-measure:(0,PrecisionIdeal)  0.917
 F-measure:(0,PrecisionIdealW) 0.998

Model 15
 Recall: 0.9
 Precision: 
       all: 0.481  allw: 0.767
        <3: 0.87  <3w: 0.997

 F-measure:(Recall,Precision)  0.627
 F-measure:(Recall,PrecisionW) 0.828

 F-measure:(0,PrecisionIdeal)  0.93
 F-measure:(0,PrecisionIdealW) 0.998

Model 16
 Recall: 0.857
 Precision: 
       all: 0.486  allw: 0.755
        <3: 0.905  <3w: 0.997

 F-measure:(Recall,Precision)  0.62
 F-measure:(Recall,PrecisionW) 0.803

 F-measure:(0,PrecisionIdeal)  0.95
 F-measure:(0,PrecisionIdealW) 0.999

Model 17
 Recall: 0.893
 Precision: 
       all: 0.485  allw: 0.79
        <3: 0.905  <3w: 0.997

 F-measure:(Recall,Precision)  0.628
 F-measure:(Recall,PrecisionW) 0.838

 F-measure:(0,PrecisionIdeal)  0.95
 F-measure:(0,PrecisionIdealW) 0.999

Model 18
 Recall: 0.904
 Precision: 
       all: 0.492  allw: 0.782
        <3: 0.909  <3w: 0.997

 F-measure:(Recall,Precision)  0.637
 F-measure:(Recall,PrecisionW) 0.838

 F-measure:(0,PrecisionIdeal)  0.952
 F-measure:(0,PrecisionIdealW) 0.999

Model 19
 Recall: 0.918
 Precision: 
       all: 0.502  allw: 0.768
        <3: 0.905  <3w: 0.997

 F-measure:(Recall,Precision)  0.649
 F-measure:(Recall,PrecisionW) 0.836

 F-measure:(0,PrecisionIdeal)  0.95
 F-measure:(0,PrecisionIdealW) 0.999

Model 20
 Recall: 0.911
 Precision: 
       all: 0.495  allw: 0.825
        <3: 0.833  <3w: 0.996

 F-measure:(Recall,Precision)  0.641
 F-measure:(Recall,PrecisionW) 0.866

 F-measure:(0,PrecisionIdeal)  0.909
 F-measure:(0,PrecisionIdealW) 0.998

For freely-rotating-chain model:
Model ave Inconsistent score: 0.636(178/280) 
Model ave  Missing interactions: 0.348 (32/92)
              weighted: 0.297 (1.06e+04/3.56e+04)
                    <3: 0.259 (7/27)
                   <3w: 0.325 (8.37e+03/2.57e+04)

 Recall: 0.364
 Precision: 
       all: 0.652  allw: 0.703

 F-measure:(RecallFree,PrecisionFree)  0.467
 F-measure:(ReallFree,PrecisionFreeW) 0.48

# Summary for c_ali.peaks
Total simulated peaks: 756 Number of peaks NOT matched in the Peak List: 56
M score = 0.074

Average shift in HX: 0.00036 Average ab-shift in HX: 0.003(Assignment used: 381)
Average shift in X: -0.0052 Average ab-shift in X: 0.028(Assignment used: 313)
Average shift in HX2: 0.00023 Average ab-shift in HX2: 0.0027(Assignment used: 483)

#For peaklist c_ali.peaks:
 Rmax: 5
Model ave Inconsistent score: 0.0409(156/3810) 
Model   1 Inconsistent score: 0.0349(133/3810) 
Model   2 Inconsistent score: 0.0386(147/3810) 
Model   3 Inconsistent score: 0.0346(132/3810) 
Model   4 Inconsistent score: 0.0412(157/3810) 
Model   5 Inconsistent score: 0.0409(156/3810) 
Model   6 Inconsistent score: 0.0428(163/3810) 
Model   7 Inconsistent score: 0.0367(140/3810) 
Model   8 Inconsistent score: 0.0388(148/3810) 
Model   9 Inconsistent score: 0.0365(139/3810) 
Model  10 Inconsistent score: 0.0383(146/3810) 
Model  11 Inconsistent score: 0.0346(132/3810) 
Model  12 Inconsistent score: 0.0394(150/3810) 
Model  13 Inconsistent score: 0.0412(157/3810) 
Model  14 Inconsistent score: 0.0378(144/3810) 
Model  15 Inconsistent score: 0.0391(149/3810) 
Model  16 Inconsistent score: 0.0449(171/3810) 
Model  17 Inconsistent score: 0.0386(147/3810) 
Model  18 Inconsistent score: 0.0383(146/3810) 
Model  19 Inconsistent score: 0.037(141/3810) 
Model  20 Inconsistent score: 0.0362(138/3810) 
Model ave  Missing interactions: 0.44 (2.21e+03/5029)
              weighted: 0.128 (1.44e+06/1.12e+07)
                    <3: 0.0393 (23/585)
                   <3w: 0.0355 (2.08e+05/5.86e+06)
Model   1  Missing interactions: 0.472 (2.65e+03/5621)
              weighted: 0.186 (2.73e+06/1.47e+07)
                    <3: 0.0387 (23/594)
                   <3w: 0.0352 (2.08e+05/5.9e+06)
Model   2  Missing interactions: 0.464 (2.56e+03/5527)
              weighted: 0.187 (2.74e+06/1.46e+07)
                    <3: 0.0388 (23/593)
                   <3w: 0.0349 (2.09e+05/5.99e+06)
Model   3  Missing interactions: 0.466 (2.6e+03/5578)
              weighted: 0.173 (2.55e+06/1.47e+07)
                    <3: 0.0388 (23/593)
                   <3w: 0.0346 (2.07e+05/5.97e+06)
Model   4  Missing interactions: 0.463 (2.52e+03/5438)
              weighted: 0.172 (2.44e+06/1.42e+07)
                    <3: 0.0387 (23/594)
                   <3w: 0.0346 (2.07e+05/6e+06)
Model   5  Missing interactions: 0.469 (2.58e+03/5502)
              weighted: 0.171 (2.45e+06/1.43e+07)
                    <3: 0.0389 (23/592)
                   <3w: 0.0352 (2.1e+05/5.96e+06)
Model   6  Missing interactions: 0.465 (2.54e+03/5455)
              weighted: 0.189 (2.71e+06/1.44e+07)
                    <3: 0.0389 (23/592)
                   <3w: 0.0347 (2.08e+05/5.99e+06)
Model   7  Missing interactions: 0.463 (2.52e+03/5454)
              weighted: 0.189 (2.79e+06/1.47e+07)
                    <3: 0.039 (23/590)
                   <3w: 0.0351 (2.07e+05/5.89e+06)
Model   8  Missing interactions: 0.472 (2.65e+03/5615)
              weighted: 0.186 (2.76e+06/1.49e+07)
                    <3: 0.0386 (23/596)
                   <3w: 0.0342 (2.07e+05/6.04e+06)
Model   9  Missing interactions: 0.47 (2.58e+03/5488)
              weighted: 0.179 (2.59e+06/1.45e+07)
                    <3: 0.0387 (23/594)
                   <3w: 0.0347 (2.06e+05/5.95e+06)
Model  10  Missing interactions: 0.466 (2.54e+03/5454)
              weighted: 0.176 (2.53e+06/1.43e+07)
                    <3: 0.0387 (23/594)
                   <3w: 0.0352 (2.07e+05/5.89e+06)
Model  11  Missing interactions: 0.472 (2.63e+03/5576)
              weighted: 0.177 (2.6e+06/1.47e+07)
                    <3: 0.0387 (23/594)
                   <3w: 0.0346 (2.06e+05/5.97e+06)
Model  12  Missing interactions: 0.47 (2.59e+03/5518)
              weighted: 0.182 (2.64e+06/1.45e+07)
                    <3: 0.0386 (23/596)
                   <3w: 0.0343 (2.06e+05/6e+06)
Model  13  Missing interactions: 0.468 (2.54e+03/5430)
              weighted: 0.177 (2.56e+06/1.44e+07)
                    <3: 0.0389 (23/591)
                   <3w: 0.0349 (2.1e+05/6.01e+06)
Model  14  Missing interactions: 0.461 (2.53e+03/5485)
              weighted: 0.172 (2.49e+06/1.45e+07)
                    <3: 0.039 (23/589)
                   <3w: 0.0344 (2.06e+05/5.98e+06)
Model  15  Missing interactions: 0.468 (2.61e+03/5576)
              weighted: 0.175 (2.52e+06/1.44e+07)
                    <3: 0.039 (23/590)
                   <3w: 0.0347 (2.08e+05/5.98e+06)
Model  16  Missing interactions: 0.468 (2.58e+03/5511)
              weighted: 0.181 (2.6e+06/1.44e+07)
                    <3: 0.0386 (23/596)
                   <3w: 0.0347 (2.07e+05/5.98e+06)
Model  17  Missing interactions: 0.465 (2.57e+03/5533)
              weighted: 0.184 (2.68e+06/1.46e+07)
                    <3: 0.0389 (23/591)
                   <3w: 0.0343 (2.06e+05/6e+06)
Model  18  Missing interactions: 0.464 (2.54e+03/5473)
              weighted: 0.179 (2.63e+06/1.47e+07)
                    <3: 0.0386 (23/596)
                   <3w: 0.0345 (2.07e+05/5.99e+06)
Model  19  Missing interactions: 0.468 (2.58e+03/5529)
              weighted: 0.188 (2.79e+06/1.49e+07)
                    <3: 0.039 (23/589)
                   <3w: 0.0342 (2.07e+05/6.05e+06)
Model  20  Missing interactions: 0.471 (2.65e+03/5628)
              weighted: 0.176 (2.58e+06/1.47e+07)
                    <3: 0.0385 (23/597)
                   <3w: 0.0346 (2.07e+05/5.98e+06)

Model ave
 Recall: 0.959
 Precision: 
       all: 0.56  allw: 0.872
        <3: 0.961  <3w: 0.964

 F-measure:(Recall,Precision)  0.707
 F-measure:(Recall,PrecisionW) 0.913

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 1
 Recall: 0.965
 Precision: 
       all: 0.528  allw: 0.814
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.683
 F-measure:(Recall,PrecisionW) 0.883

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 2
 Recall: 0.961
 Precision: 
       all: 0.536  allw: 0.813
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.881

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 3
 Recall: 0.965
 Precision: 
       all: 0.534  allw: 0.827
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.891

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 4
 Recall: 0.959
 Precision: 
       all: 0.537  allw: 0.828
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.889

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 5
 Recall: 0.959
 Precision: 
       all: 0.531  allw: 0.829
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.683
 F-measure:(Recall,PrecisionW) 0.889

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 6
 Recall: 0.957
 Precision: 
       all: 0.535  allw: 0.811
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.686
 F-measure:(Recall,PrecisionW) 0.878

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 7
 Recall: 0.963
 Precision: 
       all: 0.537  allw: 0.811
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.69
 F-measure:(Recall,PrecisionW) 0.88

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 8
 Recall: 0.961
 Precision: 
       all: 0.528  allw: 0.814
        <3: 0.961  <3w: 0.966

 F-measure:(Recall,Precision)  0.682
 F-measure:(Recall,PrecisionW) 0.882

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.983

Model 9
 Recall: 0.964
 Precision: 
       all: 0.53  allw: 0.821
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.684
 F-measure:(Recall,PrecisionW) 0.887

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 10
 Recall: 0.962
 Precision: 
       all: 0.534  allw: 0.824
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.687
 F-measure:(Recall,PrecisionW) 0.887

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 11
 Recall: 0.965
 Precision: 
       all: 0.528  allw: 0.823
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.683
 F-measure:(Recall,PrecisionW) 0.889

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 12
 Recall: 0.961
 Precision: 
       all: 0.53  allw: 0.818
        <3: 0.961  <3w: 0.966

 F-measure:(Recall,Precision)  0.683
 F-measure:(Recall,PrecisionW) 0.883

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.983

Model 13
 Recall: 0.959
 Precision: 
       all: 0.532  allw: 0.823
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.684
 F-measure:(Recall,PrecisionW) 0.886

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 14
 Recall: 0.962
 Precision: 
       all: 0.539  allw: 0.828
        <3: 0.961  <3w: 0.966

 F-measure:(Recall,Precision)  0.691
 F-measure:(Recall,PrecisionW) 0.89

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 15
 Recall: 0.961
 Precision: 
       all: 0.532  allw: 0.825
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.685
 F-measure:(Recall,PrecisionW) 0.888

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 16
 Recall: 0.955
 Precision: 
       all: 0.532  allw: 0.819
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.684
 F-measure:(Recall,PrecisionW) 0.882

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 17
 Recall: 0.961
 Precision: 
       all: 0.535  allw: 0.816
        <3: 0.961  <3w: 0.966

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.883

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.983

Model 18
 Recall: 0.962
 Precision: 
       all: 0.536  allw: 0.821
        <3: 0.961  <3w: 0.966

 F-measure:(Recall,Precision)  0.688
 F-measure:(Recall,PrecisionW) 0.886

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

Model 19
 Recall: 0.963
 Precision: 
       all: 0.532  allw: 0.812
        <3: 0.961  <3w: 0.966

 F-measure:(Recall,Precision)  0.686
 F-measure:(Recall,PrecisionW) 0.881

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.983

Model 20
 Recall: 0.964
 Precision: 
       all: 0.529  allw: 0.824
        <3: 0.961  <3w: 0.965

 F-measure:(Recall,Precision)  0.683
 F-measure:(Recall,PrecisionW) 0.888

 F-measure:(0,PrecisionIdeal)  0.98
 F-measure:(0,PrecisionIdealW) 0.982

For freely-rotating-chain model:
Model ave Inconsistent score: 0.341(1301/3810) 
Model ave  Missing interactions: 0.294 (561/1909)
              weighted: 0.109 (1.52e+05/1.39e+06)
                    <3: 0.0395 (23/583)
                   <3w: 0.0385 (3.74e+04/9.7e+05)

 Recall: 0.659
 Precision: 
       all: 0.706  allw: 0.891

 F-measure:(RecallFree,PrecisionFree)  0.681
 F-measure:(ReallFree,PrecisionFreeW) 0.757


 Final M-score 0.0649 60/925

Model ave

 Final Recall-score for input query structures: 0.955
 Final Precision-score for input query structures: 0.891

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.922
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.729

Model 1

 Final Recall-score for input query structures: 0.966
 Final Precision-score for input query structures: 0.838

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.898
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.624

Model 2

 Final Recall-score for input query structures: 0.961
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.894
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.607

Model 3

 Final Recall-score for input query structures: 0.965
 Final Precision-score for input query structures: 0.849

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.903
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.646

Model 4

 Final Recall-score for input query structures: 0.958
 Final Precision-score for input query structures: 0.853

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.902
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.642

Model 5

 Final Recall-score for input query structures: 0.958
 Final Precision-score for input query structures: 0.852

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.902
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.642

Model 6

 Final Recall-score for input query structures: 0.954
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.892
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.598

Model 7

 Final Recall-score for input query structures: 0.963
 Final Precision-score for input query structures: 0.837

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.895
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.611

Model 8

 Final Recall-score for input query structures: 0.962
 Final Precision-score for input query structures: 0.838

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.896
 F-score of ideal true structures:       0.985
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.613

Model 9

 Final Recall-score for input query structures: 0.963
 Final Precision-score for input query structures: 0.847

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.901
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.638

Model 10

 Final Recall-score for input query structures: 0.961
 Final Precision-score for input query structures: 0.847

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.901
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.638

Model 11

 Final Recall-score for input query structures: 0.966
 Final Precision-score for input query structures: 0.849

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.903
 F-score of ideal true structures:       0.985
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.643

Model 12

 Final Recall-score for input query structures: 0.96
 Final Precision-score for input query structures: 0.844

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.898
 F-score of ideal true structures:       0.985
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.622

Model 13

 Final Recall-score for input query structures: 0.96
 Final Precision-score for input query structures: 0.846

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.899
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.629

Model 14

 Final Recall-score for input query structures: 0.961
 Final Precision-score for input query structures: 0.851

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.903
 F-score of ideal true structures:       0.985
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.643

Model 15

 Final Recall-score for input query structures: 0.961
 Final Precision-score for input query structures: 0.846

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.9
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.633

Model 16

 Final Recall-score for input query structures: 0.953
 Final Precision-score for input query structures: 0.843

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.969

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.894
 F-score of ideal true structures:       0.984
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.607

Model 17

 Final Recall-score for input query structures: 0.959
 Final Precision-score for input query structures: 0.841

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.896
 F-score of ideal true structures:       0.985
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.613

Model 18

 Final Recall-score for input query structures: 0.96
 Final Precision-score for input query structures: 0.843

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.898
 F-score of ideal true structures:       0.985
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.622

Model 19

 Final Recall-score for input query structures: 0.962
 Final Precision-score for input query structures: 0.84

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.897
 F-score of ideal true structures:       0.985
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.617

Model 20

 Final Recall-score for input query structures: 0.962
 Final Precision-score for input query structures: 0.847

 Final Recall-score for ideal true structures: 1
 Final Precision-score for ideal true structures: 0.97

 Final Recall-score for freely-rotating-chain model: 0.649
 Final Precision-score for freely-rotating-chain model: 0.903

 Summary:
 F-score of input query structures:      0.9
 F-score of ideal true structures:       0.985
 F-score of freely-rotating-chain model: 0.755

 DP-Score: 0.63

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

NOESY_Assign:
      User CPU Time:       80.7 sec.
      Syst CPU Time:       1.46 sec.
Other Processes:
      User CPU Time:       1.05 sec.
      Syst CPU Time:       0.08 sec.

Total Elapsed Time:       83.3 sec. 
