Member Site › Forums › Rosetta 3 › Rosetta 3 – General › Denovo density didn’t output a structure
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February 12, 2018 at 4:10 pm #2852Anonymous
I had a bunch of assembled fragments and I ran the below protocol on them for the fragment assignment and the genration of a consesus trajectory.
#!/bin/sh
$ROSETTA3/source/bin/denovo_density.linuxgccrelease
-mode consensus
-in::file::silent round1/assembled.*silent
-consensus_frac 1.0 -energy_cut 0.05
-mute core
# use the old model as a starting point
cp S_0001.pdb round1_model.pdbSurprisngly, the script did not output any strcutres. This is a few lines from the log in my terminal, did the script ran successfully? If so, where can I find my structure?
denovo_density: Score cut = -69153.8 (14895/297916)
denovo_density: Highest frequency = 201
denovo_density: Residue 72 stdev = 310.654 pose = 138.8251302619481 141.0146517130280 97.72079704151980 count = 201
denovo_density: Residue 73 stdev = 298.539 pose = 139.0025394963242 142.0479014400399 99.17878956951867 count = 402
denovo_density: Residue 74 stdev = 198.407 pose = 138.2260276398613 141.9612660746082 100.3133442320160 count = 402
denovo_density: Residue 75 stdev = 195.247 pose = 136.4008981329717 143.8642440583106 98.70014593941440 count = 402
denovo_density: Residue 76 stdev = 265.268 pose = 137.0841083486396 142.0427318255124 98.23466119770795 count = 402
denovo_density: Residue 77 stdev = 216.811 pose = 137.8472521508295 139.4494956040824 100.0041580324948 count = 402
denovo_density: Residue 78 stdev = 171.075 pose = 136.1212418224289 140.9915995606610 99.87954656096328 count = 402
denovo_density: Residue 79 stdev = 230.329 pose = 135.1649940119765 141.8879337852738 98.20768323378184 count = 402
denovo_density: Residue 80 stdev = 268.447 pose = 136.3753071278023 138.8567393598506 98.98710229309833 count = 402
denovo_density: Residue 81 stdev = 242.922 pose = 135.7620713546463 137.7403121387735 99.92026896253427 count = 201
denovo_density: NO RESIDUES IN CONSENSUS ASSIGNMENT.
cp: cannot stat ‘S_0001.pdb’: No such file or directory
denovo_density: Score cut = -69153.8 (14895/297916)
denovo_density: Highest frequency = 201
denovo_density: Residue 72 stdev = 310.654 pose = 138.8251302619481 141.0146517130280 97.72079704151980 count = 201
denovo_density: Residue 73 stdev = 298.539 pose = 139.0025394963242 142.0479014400399 99.17878956951867 count = 402
denovo_density: Residue 74 stdev = 198.407 pose = 138.2260276398613 141.9612660746082 100.3133442320160 count = 402
denovo_density: Residue 75 stdev = 195.247 pose = 136.4008981329717 143.8642440583106 98.70014593941440 count = 402
denovo_density: Residue 76 stdev = 265.268 pose = 137.0841083486396 142.0427318255124 98.23466119770795 count = 402
denovo_density: Residue 77 stdev = 216.811 pose = 137.8472521508295 139.4494956040824 100.0041580324948 count = 402
denovo_density: Residue 78 stdev = 171.075 pose = 136.1212418224289 140.9915995606610 99.87954656096328 count = 402
denovo_density: Residue 79 stdev = 230.329 pose = 135.1649940119765 141.8879337852738 98.20768323378184 count = 402
denovo_density: Residue 80 stdev = 268.447 pose = 136.3753071278023 138.8567393598506 98.98710229309833 count = 402
denovo_density: Residue 81 stdev = 242.922 pose = 135.7620713546463 137.7403121387735 99.92026896253427 count = 201
denovo_density: NO RESIDUES IN CONSENSUS ASSIGNMENT.
cp: cannot stat ‘S_0001.pdb’: No such file or directory
denovo_density: Score cut = -69153.8 (14895/297916)
denovo_density: Highest frequency = 201
denovo_density: Residue 72 stdev = 310.654 pose = 138.8251302619481 141.0146517130280 97.72079704151980 count = 201
denovo_density: Residue 73 stdev = 298.539 pose = 139.0025394963242 142.0479014400399 99.17878956951867 count = 402
denovo_density: Residue 74 stdev = 198.407 pose = 138.2260276398613 141.9612660746082 100.3133442320160 count = 402
denovo_density: Residue 75 stdev = 195.247 pose = 136.4008981329717 143.8642440583106 98.70014593941440 count = 402
denovo_density: Residue 76 stdev = 265.268 pose = 137.0841083486396 142.0427318255124 98.23466119770795 count = 402
denovo_density: Residue 77 stdev = 216.811 pose = 137.8472521508295 139.4494956040824 100.0041580324948 count = 402
denovo_density: Residue 78 stdev = 171.075 pose = 136.1212418224289 140.9915995606610 99.87954656096328 count = 402
denovo_density: Residue 79 stdev = 230.329 pose = 135.1649940119765 141.8879337852738 98.20768323378184 count = 402
denovo_density: Residue 80 stdev = 268.447 pose = 136.3753071278023 138.8567393598506 98.98710229309833 count = 402
denovo_density: Residue 81 stdev = 242.922 pose = 135.7620713546463 137.7403121387735 99.92026896253427 count = 201
denovo_density: NO RESIDUES IN CONSENSUS ASSIGNMENT.
cp: cannot stat ‘S_0001.pdb’: No such file or directory
denovo_density: Score cut = -69153.8 (14895/297916)
denovo_density: Highest frequency = 201
denovo_density: Residue 72 stdev = 310.654 pose = 138.8251302619481 141.0146517130280 97.72079704151980 count = 201
denovo_density: Residue 73 stdev = 298.539 pose = 139.0025394963242 142.0479014400399 99.17878956951867 count = 402
denovo_density: Residue 74 stdev = 198.407 pose = 138.2260276398613 141.9612660746082 100.3133442320160 count = 402
denovo_density: Residue 75 stdev = 195.247 pose = 136.4008981329717 143.8642440583106 98.70014593941440 count = 402
denovo_density: Residue 76 stdev = 265.268 pose = 137.0841083486396 142.0427318255124 98.23466119770795 count = 402
denovo_density: Residue 77 stdev = 216.811 pose = 137.8472521508295 139.4494956040824 100.0041580324948 count = 402
denovo_density: Residue 78 stdev = 171.075 pose = 136.1212418224289 140.9915995606610 99.87954656096328 count = 402
denovo_density: Residue 79 stdev = 230.329 pose = 135.1649940119765 141.8879337852738 98.20768323378184 count = 402
denovo_density: Residue 80 stdev = 268.447 pose = 136.3753071278023 138.8567393598506 98.98710229309833 count = 402
denovo_density: Residue 81 stdev = 242.922 pose = 135.7620713546463 137.7403121387735 99.92026896253427 count = 201
denovo_density: NO RESIDUES IN CONSENSUS ASSIGNMENT.
cp: cannot stat ‘S_0001.pdb’: No such file or directory
denovo_density: Score cut = -69153.8 (14895/297916)
denovo_density: Highest frequency = 201
denovo_density: Residue 72 stdev = 310.654 pose = 138.8251302619481 141.0146517130280 97.72079704151980 count = 201
denovo_density: Residue 73 stdev = 298.539 pose = 139.0025394963242 142.0479014400399 99.17878956951867 count = 402
denovo_density: Residue 74 stdev = 198.407 pose = 138.2260276398613 141.9612660746082 100.3133442320160 count = 402
denovo_density: Residue 75 stdev = 195.247 pose = 136.4008981329717 143.8642440583106 98.70014593941440 count = 402
denovo_density: Residue 76 stdev = 265.268 pose = 137.0841083486396 142.0427318255124 98.23466119770795 count = 402
denovo_density: Residue 77 stdev = 216.811 pose = 137.8472521508295 139.4494956040824 100.0041580324948 count = 402
denovo_density: Residue 78 stdev = 171.075 pose = 136.1212418224289 140.9915995606610 99.87954656096328 count = 402
denovo_density: Residue 79 stdev = 230.329 pose = 135.1649940119765 141.8879337852738 98.20768323378184 count = 402
denovo_density: Residue 80 stdev = 268.447 pose = 136.3753071278023 138.8567393598506 98.98710229309833 count = 402
denovo_density: Residue 81 stdev = 242.922 pose = 135.7620713546463 137.7403121387735 99.92026896253427 count = 201
denovo_density: NO RESIDUES IN CONSENSUS ASSIGNMENT.
cp: cannot stat ‘S_0001.pdb’: No such file or directory
denovo_density: Score cut = -69153.8 (14895/297916)
denovo_density: Highest frequency = 201
denovo_density: Residue 72 stdev = 310.654 pose = 138.8251302619481 141.0146517130280 97.72079704151980 count = 201
denovo_density: Residue 73 stdev = 298.539 pose = 139.0025394963242 142.0479014400399 99.17878956951867 count = 402
denovo_density: Residue 74 stdev = 198.407 pose = 138.2260276398613 141.9612660746082 100.3133442320160 count = 402
denovo_density: Residue 75 stdev = 195.247 pose = 136.4008981329717 143.8642440583106 98.70014593941440 count = 402
denovo_density: Residue 76 stdev = 265.268 pose = 137.0841083486396 142.0427318255124 98.23466119770795 count = 402
denovo_density: Residue 77 stdev = 216.811 pose = 137.8472521508295 139.4494956040824 100.0041580324948 count = 402
denovo_density: Residue 78 stdev = 171.075 pose = 136.1212418224289 140.9915995606610 99.87954656096328 count = 402
denovo_density: Residue 79 stdev = 230.329 pose = 135.1649940119765 141.8879337852738 98.20768323378184 count = 402
denovo_density: Residue 80 stdev = 268.447 pose = 136.3753071278023 138.8567393598506 98.98710229309833 count = 402
denovo_density: Residue 81 stdev = 242.922 pose = 135.7620713546463 137.7403121387735 99.92026896253427 count = 201
denovo_density: NO RESIDUES IN CONSENSUS ASSIGNMENT.
cp: cannot stat ‘S_0001.pdb’: No such file or directory
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February 12, 2018 at 6:35 pm #14039Anonymous
The script will not produce output if a consensus is not reached among the docked fragments. I could be wrong but I believe the consensus_frac variable controls how high the consensus should be in order to be accepted so you could try and lowering that. You could also try and improving sampling by modifying n_to_search in step1.
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February 16, 2018 at 5:17 pm #14044Anonymous
Thanks, lowering the value works.
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November 14, 2018 at 11:03 am #14488Anonymous
hi ,i successfully run the same command above but there are not any pdb file generated ,it is said:
:~/rosetta/main/source/bin$ ./denovo_density.linuxgccrelease -mode consensus -in::file::silent 1/assembled.*silent -consensus_frac 0.1 -energy_cut 0.05 -mute core -database /home/advanced/rosetta/main/database -out::path::pdb 2
denovo_density: Score cut = -48434.5 (1664/33299)
denovo_density: Highest frequency = 33
denovo_density: Residue 1 stdev = 444.035 pose = 36.80768511812136 -9.672755317262961 -28.75481051347792 count = 5
denovo_density: Residue 2 stdev = 327.581 pose = 36.18176406147701 -8.318007242412317 -27.67295226204978 count = 10
denovo_density: Residue 3 stdev = 245.997 pose = 37.46669934554542 -3.761268353543774 -29.61737313624764 count = 13
denovo_density: Residue 4 stdev = 175.933 pose = 38.32079024213813 -3.603874298030175 -28.39649710594686 count = 13
denovo_density: Residue 5 stdev = 140.483 pose = 36.76042506116890 -1.537790758069795 -27.40058657390887 count = 13
denovo_density: Residue 6 stdev = 145.766 pose = 36.33669995462689 -4.135084400026911 -28.01225036532002 count = 13
denovo_density: Residue 7 stdev = 101.435 pose = 37.69050755777021 -6.299769841098855 -27.55199245768652 count = 13
denovo_density: Residue 8 stdev = 297.62 pose = 37.73189624240533 -7.037116020616319 -18.48579397859394 count = 16
denovo_density: Residue 9 stdev = 227.616 pose = 37.83726279846766 -7.484450249661085 -18.37417805205926 count = 16
denovo_density: Residue 10 stdev = 281.251 pose = 37.76003909823169 -9.390755922516234 -9.682152867070505 count = 16
denovo_density: Residue 11 stdev = 259.759 pose = 39.84774896330482 -11.14110850556514 0.3232098188389048 count = 14
denovo_density: Residue 12 stdev = 621.549 pose = 41.07866542476452 -9.923217890128111 -16.36143065945344 count = 31
denovo_density: Residue 13 stdev = 647.909 pose = 41.30345745152421 -10.07248353025863 -13.03562952323288 count = 36
denovo_density: Residue 14 stdev = 632.102 pose = 40.89423895931746 -5.560267231502219 -19.14711560082702 count = 54
denovo_density: Residue 15 stdev = 543.574 pose = 39.68426651831797 -5.309559150575242 -15.62258324742031 count = 60
denovo_density: Residue 16 stdev = 489.07 pose = 38.71487798051613 -4.730963965149813 -19.34387844761087 count = 79
denovo_density: Residue 17 stdev = 442.451 pose = 40.19060917826332 -5.823122444683725 -22.67814801572376 count = 95
denovo_density: Residue 18 stdev = 396.379 pose = 40.95954681252125 -5.556475933530727 -20.24060638118880 count = 98
denovo_density: Residue 19 stdev = 330.107 pose = 38.38799911219636 -4.577983836477115 -20.62068424787072 count = 96
denovo_density: Residue 20 stdev = 305.609 pose = 36.49682905924783 -5.788216095263162 -24.02130673998060 count = 108
denovo_density: Residue 21 stdev = 303.275 pose = 37.62018910332555 -6.812941060701709 -23.85021841262112 count = 88
denovo_density: Residue 22 stdev = 231.011 pose = 37.79743702093041 -5.608345875389539 -23.33578642366718 count = 83
denovo_density: Residue 23 stdev = 233.345 pose = 35.17901982275345 -7.234770113996247 -22.20706523116795 count = 65
denovo_density: Residue 24 stdev = 200.116 pose = 34.58405387161785 -7.545736928929862 -22.36637752835169 count = 59
denovo_density: Residue 25 stdev = 245.642 pose = 33.57724626680189 -8.782417421191161 -22.50980367453732 count = 40
denovo_density: Residue 26 stdev = 423.241 pose = 28.32807893823258 -10.44993085693588 -21.53864940495866 count = 21
denovo_density: Residue 27 stdev = 471.895 pose = 24.68182791625659 -10.85322313200379 -23.70316511665039 count = 18
denovo_density: Residue 28 stdev = 391.273 pose = 28.54347299904570 -9.440926092858744 -20.43181700386909 count = 15
denovo_density: Residue 32 stdev = 74.9929 pose = 34.31659680234675 -0.8025307456552935 -22.92465843179027 count = 8
denovo_density: Residue 33 stdev = 55.6093 pose = 34.24010346439981 -1.983862063588428 -21.49198715390484 count = 16
denovo_density: Residue 34 stdev = 45.6311 pose = 36.44435543273611 0.2111611637673244 -20.90661480981592 count = 23
denovo_density: Residue 35 stdev = 39.3015 pose = 34.37602804418181 1.316729973906745 -19.72414693494770 count = 29
denovo_density: Residue 36 stdev = 30.6782 pose = 33.96523490381998 -0.4113129112722858 -17.95714786693132 count = 36
denovo_density: Residue 37 stdev = 23.6744 pose = 37.21597163342344 0.2946191209388960 -16.98346790517336 count = 43
denovo_density: Residue 38 stdev = 29.4539 pose = 36.49748230570579 2.734082169512811 -16.19924875724362 count = 43
denovo_density: Residue 39 stdev = 30.5014 pose = 33.71008666769829 1.856062395615786 -14.57542669567338 count = 50
denovo_density: Residue 40 stdev = 33.5015 pose = 35.80205201383087 0.3929503930093106 -13.28960065273823 count = 53
denovo_density: Residue 41 stdev = 22.1575 pose = 38.30366483716993 2.849460032192407 -12.32704382300293 count = 48
denovo_density: Residue 42 stdev = 6.77735 pose = 35.69920365785752 4.963095737248219 -10.50117466310191 count = 43
denovo_density: Residue 43 stdev = 11.013 pose = 34.51891218648429 2.784242550525669 -8.610312214264781 count = 36
denovo_density: Residue 44 stdev = 22.0785 pose = 37.80216322997254 2.443340185620005 -7.722966367356744 count = 30
denovo_density: Residue 45 stdev = 23.8152 pose = 38.15794592177590 5.340978780329730 -6.732898431887472 count = 23
denovo_density: Residue 46 stdev = 23.5285 pose = 34.82422028691401 5.533434338053011 -4.455611666237100 count = 16
denovo_density: Residue 47 stdev = 34.5879 pose = 35.80646075603329 2.738180923228442 -2.994833160131678 count = 16
denovo_density: Residue 48 stdev = 1.40649 pose = 38.49825340080206 4.262911809718951 0.2316301560842768 count = 9
denovo_density: Residue 49 stdev = 0.841569 pose = 36.33604083381596 6.389815001057191 2.111185444459379 count = 6
denovo_density: Residue 50 stdev = 4.54751e-13 pose = 34.60547128212541 3.246743908274810 3.794062423749053 count = 3
denovo_density: Residue 62 stdev = 346.122 pose = 34.76065738634593 -10.86834575927829 6.424717170657607 count = 5
denovo_density: Residue 63 stdev = 274.408 pose = 33.40889487277713 -10.94940881062382 8.244989095413615 count = 10
denovo_density: Residue 64 stdev = 240.709 pose = 31.91882453328899 -8.095171356780147 8.083235290853983 count = 15
denovo_density: Residue 65 stdev = 264.723 pose = 32.40909316193753 -8.717004476795482 5.971226420059321 count = 20
denovo_density: Residue 66 stdev = 222.249 pose = 31.84761527408181 -12.06401541575279 5.975379486621923 count = 25
denovo_density: Residue 67 stdev = 159.955 pose = 29.95705400985043 -11.23877568589758 7.354426115078342 count = 25
denovo_density: Residue 68 stdev = 156.5 pose = 28.96442812570277 -8.317798727076992 6.041832204578911 count = 25
denovo_density: Residue 69 stdev = 167.297 pose = 29.23583523599030 -10.33276952954848 4.193129238865165 count = 25
denovo_density: Residue 70 stdev = 115.348 pose = 28.17440220721186 -12.85038045930913 5.216663492580517 count = 25
denovo_density: Residue 71 stdev = 84.4678 pose = 26.46832549859078 -10.34814467892285 5.679047558319285 count = 20
denovo_density: Residue 72 stdev = 95.0066 pose = 25.99944965172165 -9.295160097273323 3.553646828560014 count = 15
denovo_density: Residue 73 stdev = 90.3409 pose = 26.60186109226407 -12.09389501530496 2.451361412442278 count = 10
denovo_density: Residue 74 stdev = 49.2723 pose = 24.77116122264509 -13.52794807268751 3.398844037976930 count = 5
denovo_density: Residue 75 stdev = 1.13687e-13 pose = 0.9718786748410773 -18.91211836475870 -42.78187110335905 count = 14
denovo_density: Residue 76 stdev = 22.4275 pose = 0.6812344193890936 -16.64725551719397 -38.92427535505281 count = 31
denovo_density: Residue 77 stdev = 14.1645 pose = 2.842714771223234 -15.45822388512068 -36.84513248836171 count = 31
denovo_density: Residue 78 stdev = 17.5677 pose = 4.208843905363947 -17.19630653775062 -33.93298685424816 count = 31
denovo_density: Residue 79 stdev = 7.99351 pose = 4.545686493257059 -16.19733757544745 -30.70759915733769 count = 31
denovo_density: Residue 80 stdev = 1.89362 pose = 2.642159403650831 -13.57092923688997 -31.65392913269614 count = 31
denovo_density: Residue 81 stdev = 0.390308 pose = 1.602558043914240 -12.09095059778613 -29.12521648957674 count = 31
denovo_density: Residue 82 stdev = 3.62057 pose = -0.3791886261844489 -9.554875992627238 -29.40505906272461 count = 31
denovo_density: Residue 83 stdev = 11.4712 pose = 1.071272322790170 -6.985891658105610 -30.33779246939136 count = 31
denovo_density: Residue 84 stdev = 38.1022 pose = 1.450429305194017 -6.756429343797292 -28.95839397986095 count = 17
denovo_density: Residue 95 stdev = 259.303 pose = 40.60984445760401 -3.237640261200362 -33.91792288427801 count = 8
denovo_density: Residue 96 stdev = 291.417 pose = 37.53347927444303 -4.354101182373325 -25.35476324822188 count = 11
denovo_density: Residue 97 stdev = 118.834 pose = 37.17493730229874 -6.951730711249335 -24.52593267837814 count = 44
denovo_density: Residue 98 stdev = 97.1188 pose = 39.26552089464315 -8.997250755268997 -24.21694342460653 count = 77
denovo_density: Residue 99 stdev = 79.8521 pose = 40.43829030267917 -7.909261383235649 -21.77049676723853 count = 108
denovo_density: Residue 100 stdev = 59.578 pose = 37.71263480824130 -8.820527064755003 -19.71025769093961 count = 133
denovo_density: Residue 101 stdev = 48.7068 pose = 37.17292579820005 -12.44368490175619 -20.56380028199208 count = 158
denovo_density: Residue 102 stdev = 43.7884 pose = 40.02337066393183 -13.57286313951752 -18.71257447070896 count = 183
denovo_density: Residue 103 stdev = 37.608 pose = 39.01076924590660 -12.27271015152684 -15.46838764357533 count = 208
denovo_density: Residue 104 stdev = 26.3219 pose = 36.17526224290535 -14.71678880010164 -15.01931723540329 count = 225
denovo_density: Residue 105 stdev = 27.2792 pose = 38.26309576687865 -17.59399300101655 -14.36568458438436 count = 222
denovo_density: Residue 106 stdev = 22.8874 pose = 39.57500047539013 -16.45538386296323 -11.20349576075993 count = 189
denovo_density: Residue 107 stdev = 13.8117 pose = 36.61519936275693 -15.87971038431779 -9.136978406971384 count = 156
denovo_density: Residue 108 stdev = 0.410832 pose = 35.15131405481686 -19.67816345440474 -8.910822981142838 count = 125
denovo_density: Residue 109 stdev = 0.833916 pose = 37.85934178909422 -21.10032464762097 -7.223771498959459 count = 100
denovo_density: Residue 110 stdev = 0.36773 pose = 37.55535834294529 -19.09182453674358 -4.580595393373492 count = 75
denovo_density: Residue 111 stdev = 0.0832464 pose = 33.96017399497765 -19.79993211132745 -4.290635702349078 count = 50
denovo_density: Residue 112 stdev = 3.64599e-13 pose = 32.58693595535723 -22.56654196674583 -6.138971741934304 count = 25
denovo_density: Residue 115 stdev = 343.658 pose = 31.42452953731755 -17.66137328363327 -19.63439688308086 count = 3
denovo_density: Residue 116 stdev = 392.706 pose = 30.80812408168673 -17.02823315912821 -20.86913829153369 count = 3
denovo_density: Residue 117 stdev = 352.167 pose = 32.55362608619757 -15.63828127224471 -22.93212748900211 count = 3
denovo_density: Residue 118 stdev = 343.989 pose = 33.95156782716864 -16.24230517045530 -24.11701721045387 count = 3
denovo_density: Residue 119 stdev = 192.313 pose = 27.49543259566611 -8.579070293469940 3.060149916565163 count = 22
denovo_density: Residue 120 stdev = 140.974 pose = 30.15716569918451 -4.955199537070248 7.089809061847812 count = 37
denovo_density: Residue 121 stdev = 112.853 pose = 30.68179024892820 -1.941301517889795 7.176082629268270 count = 57
denovo_density: Residue 122 stdev = 75.1071 pose = 33.00782536803013 -1.999109312615773 8.005645411395948 count = 77
denovo_density: Residue 123 stdev = 60.5022 pose = 33.24133273670081 -3.208100639183829 6.059402669562590 count = 97
denovo_density: Residue 124 stdev = 53.4401 pose = 33.04647720986666 -0.6194775428846250 6.005944892491951 count = 113
denovo_density: Residue 125 stdev = 50.3491 pose = 35.28185711043637 0.5125231138724964 6.308914895690374 count = 119
denovo_density: Residue 126 stdev = 45.5056 pose = 36.17725648112416 -1.066234698068468 5.377111005760556 count = 134
denovo_density: Residue 127 stdev = 56.1013 pose = 35.26005651829303 -0.8860715613627940 2.986668658795076 count = 149
denovo_density: Residue 128 stdev = 67.2223 pose = 35.76547027302712 2.448461002669979 2.185728926874967 count = 145
denovo_density: Residue 129 stdev = 72.3322 pose = 38.02965524614256 2.206284914853294 1.942249130031949 count = 130
denovo_density: Residue 130 stdev = 88.9875 pose = 37.56453327348759 0.4741335884614355 -0.2060545677494494 count = 125
denovo_density: Residue 131 stdev = 99.2939 pose = 35.78841566281018 1.927467331164249 -2.682274180658455 count = 120
denovo_density: Residue 132 stdev = 93.0092 pose = 36.30573809168015 4.368539337695918 -4.710823545462165 count = 114
denovo_density: Residue 133 stdev = 96.5165 pose = 37.69318918820406 2.492905946492304 -6.907296041583671 count = 95
denovo_density: Residue 134 stdev = 58.2694 pose = 34.63464365128128 1.678439403424332 -9.120212466759885 count = 89
denovo_density: Residue 135 stdev = 53.8756 pose = 33.50502374997876 3.859353284721116 -10.74164609772083 count = 89
denovo_density: Residue 136 stdev = 60.0605 pose = 36.09445758243618 2.884976530672025 -12.19026808793426 count = 74
denovo_density: Residue 137 stdev = 64.3982 pose = 35.07278483691424 -0.3553992581929601 -12.36772510878196 count = 75
denovo_density: Residue 138 stdev = 60.7565 pose = 31.92233693619624 0.7219409211498102 -13.74897360749132 count = 75
denovo_density: Residue 139 stdev = 73.7694 pose = 33.31483194451867 2.392972588512302 -15.14218676720841 count = 63
denovo_density: Residue 140 stdev = 115.852 pose = 34.26670873600496 -1.273869563975507 -15.71004086632903 count = 52
denovo_density: Residue 141 stdev = 145.845 pose = 30.58613051433135 -4.220980398420299 -15.67900614010735 count = 38
denovo_density: Residue 142 stdev = 142.475 pose = 29.14813672767716 -1.795549165562991 -17.01242416950791 count = 38
denovo_density: Residue 143 stdev = 158.767 pose = 31.28479075054555 -1.226325779072253 -18.94071628901962 count = 38
denovo_density: Residue 144 stdev = 210.406 pose = 28.95184964535965 -5.902399969795821 -18.64893707745954 count = 23
denovo_density: Residue 145 stdev = 202.141 pose = 26.26528618184695 -5.733228298283279 -18.81012772750058 count = 23
denovo_density: Residue 146 stdev = 326.355 pose = 20.90675286646457 -10.12565798755242 -9.484415345610126 count = 7
denovo_density: Residue 147 stdev = 295.756 pose = 19.18392196934280 -11.25232419615006 -11.56056116512917 count = 7
denovo_density: Residue 148 stdev = 297.757 pose = 15.43063546259415 -13.54106973476451 -12.72461388866210 count = 4
denovo_density: Residue 157 stdev = 287.55 pose = 18.09727395071544 -8.711013004950351 -5.718918563795453 count = 9
denovo_density: Residue 158 stdev = 272.989 pose = 20.20422265927822 -6.066769508495446 -4.811483038770837 count = 17
denovo_density: Residue 159 stdev = 431.769 pose = 24.07904820519049 -6.554869168307699 -10.43116307144317 count = 28
denovo_density: Residue 160 stdev = 411.895 pose = 25.59696434305953 -7.093291277939798 -13.47118003822336 count = 39
denovo_density: Residue 161 stdev = 367.92 pose = 26.30225460231063 -4.251559369541939 -14.98677107507616 count = 48
denovo_density: Residue 162 stdev = 382.917 pose = 25.98511839504176 -3.570591871144015 -14.00497177551155 count = 48
denovo_density: Residue 163 stdev = 392.195 pose = 25.11474512487754 -5.922496778613771 -12.85558476973458 count = 53
denovo_density: Residue 164 stdev = 324.464 pose = 26.32492835185928 -5.271035720338207 -13.00673335289678 count = 53
denovo_density: Residue 165 stdev = 285.966 pose = 26.16737073629278 -2.546525622040219 -12.24746013899415 count = 53
denovo_density: Residue 166 stdev = 331.76 pose = 26.41660907797685 -3.592693860952119 -12.85379063690759 count = 44
denovo_density: Residue 167 stdev = 336.634 pose = 28.02257529968781 -5.557376311378410 -14.43324429805528 count = 36
denovo_density: Residue 168 stdev = 271.285 pose = 27.56774380637908 -3.922513086749721 -13.71918111683045 count = 25
denovo_density: Residue 169 stdev = 271.691 pose = 25.25939787475463 -3.666978670774315 -10.96150452974057 count = 14
denovo_density: Residue 170 stdev = 102.915 pose = 16.32248433440141 -2.879748577456192 1.569963673704563 count = 5
denovo_density: Residue 171 stdev = 113.601 pose = 19.07255637612341 -2.995566374529249 0.5126313831910435 count = 5
denovo_density: Residue 185 stdev = 72.1731 pose = -2.843821156139759 -14.79759190959300 -21.75157515618679 count = 3
denovo_density: Residue 186 stdev = 38.375 pose = -2.066427915521105 -14.71674264122191 -21.20574746587474 count = 6
denovo_density: Residue 187 stdev = 37.8601 pose = -1.481568806988215 -12.86535006757619 -22.30733695064674 count = 9
denovo_density: Residue 188 stdev = 50.7767 pose = -3.287571741342338 -13.13650479711734 -20.28460100478404 count = 12
denovo_density: Residue 189 stdev = 22.1548 pose = -3.421783757313746 -14.61696664000995 -18.83894969025630 count = 15
denovo_density: Residue 190 stdev = 9.64071 pose = -1.167522365499670 -13.12646150252284 -20.49808485559324 count = 15
denovo_density: Residue 191 stdev = 31.263 pose = -1.052223282337487 -11.57022747832937 -20.62598654917561 count = 15
denovo_density: Residue 192 stdev = 38.0295 pose = -2.813255989787103 -13.20573745802559 -18.10326446652608 count = 15
denovo_density: Residue 193 stdev = 18.2321 pose = -1.780916657210335 -13.84574173689912 -17.85282700892843 count = 15
denovo_density: Residue 194 stdev = 27.3223 pose = 0.2763858315208133 -11.97335152458853 -19.45227009116009 count = 12
denovo_density: Residue 195 stdev = 62.1539 pose = -0.3992392565451307 -11.38295254339955 -18.56955819927413 count = 9
denovo_density: Residue 196 stdev = 64.5548 pose = -1.654310070427938 -13.05977041506451 -16.48577006383657 count = 6
denovo_density: Residue 197 stdev = 55.5649 pose = 0.4199413800426447 -12.67173915465033 -17.46838832343715 count = 3
denovo_density: Residue 206 stdev = 357.976 pose = 42.48872037068929 -7.574480106486072 2.359346773953981 count = 6
denovo_density: Residue 207 stdev = 229.973 pose = 35.34721249728276 -6.700093150444188 8.273881586722249 count = 23
denovo_density: Residue 208 stdev = 149.022 pose = 36.91826773101103 -5.720616704317122 10.74232422433899 count = 35
denovo_density: Residue 209 stdev = 98.8433 pose = 36.83523120260390 -6.003101489362687 10.69085879889369 count = 59
denovo_density: Residue 210 stdev = 119.348 pose = 35.96182771944807 -6.681493428156512 9.170782592904192 count = 80
denovo_density: Residue 211 stdev = 128.886 pose = 34.33750306140927 -5.670611088287734 7.665611174973412 count = 102
denovo_density: Residue 212 stdev = 142.507 pose = 34.05127901078064 -3.546707805711328 5.960741849397129 count = 120
denovo_density: Residue 213 stdev = 154.361 pose = 34.95065686774109 -4.159291598549489 4.741426563208555 count = 136
denovo_density: Residue 214 stdev = 156.353 pose = 34.45946465330539 -4.262411207297800 2.806037762592258 count = 151
denovo_density: Residue 215 stdev = 149.22 pose = 33.69165856863265 -1.814949456903786 1.824943865785119 count = 156
denovo_density: Residue 216 stdev = 171.245 pose = 35.33656892863025 -1.490061605284195 1.365183637385398 count = 139
denovo_density: Residue 217 stdev = 169.626 pose = 36.17656860638139 -2.010159591714512 -0.4817483850041628 count = 127
denovo_density: Residue 218 stdev = 183.641 pose = 35.29589607774958 -0.6158028009863166 -3.117569496335201 count = 106
denovo_density: Residue 219 stdev = 215.217 pose = 36.77190671768168 1.278561263503521 -3.689254217756787 count = 88
denovo_density: Residue 220 stdev = 223.163 pose = 39.53396555305972 1.321865762146618 -3.673261569421570 count = 69
denovo_density: Residue 221 stdev = 223.328 pose = 39.61716402810685 0.4546228318538991 -3.903909264711846 count = 54
denovo_density: Residue 222 stdev = 237.298 pose = 38.86318175640233 0.6352367617194696 -2.139278742205319 count = 38
denovo_density: Residue 223 stdev = 116.369 pose = 36.52185052183383 -0.6016986740634771 0.4289342188681933 count = 28
denovo_density: Residue 224 stdev = 111.911 pose = 36.21387633327272 -4.361172925990873 1.748544437464383 count = 22
denovo_density: Residue 225 stdev = 95.1511 pose = 34.85405309757628 -4.730574903033586 -0.1802903948273868 count = 22
denovo_density: Residue 226 stdev = 117.996 pose = 32.49027749688384 -4.390381889482213 -4.146947812748968 count = 27
denovo_density: Residue 227 stdev = 133.467 pose = 33.93140640189756 -3.209438511036448 -8.060326993747900 count = 24
denovo_density: Residue 228 stdev = 92.0134 pose = 35.16859362911151 -3.240237108163333 -11.22109622306105 count = 21
denovo_density: Residue 229 stdev = 57.5255 pose = 33.78777371033150 -2.733915806610596 -13.94332962991242 count = 18
denovo_density: Residue 230 stdev = 0.063296 pose = 32.60136413003200 1.759299190454982 -19.30060785043005 count = 15
denovo_density: Residue 231 stdev = 0.128429 pose = 35.71147884029298 2.134692403906560 -21.42166856282604 count = 15
denovo_density: Residue 232 stdev = 0.0301881 pose = 35.49566281909470 -1.683342240616209 -22.25595498298713 count = 10
denovo_density: Residue 233 stdev = 2.22045e-16 pose = 31.74982421256735 -1.344452905106321 -23.56377792881884 count = 5
denovo_density: Residue 234 stdev = 0 pose = 33.10864981381032 1.018257115796482 -26.21321533985436 count = 5
denovo_density: Residue 246 stdev = 8.66646e-14 pose = 15.52846725666281 -2.304586033561200 -6.034705260230937 count = 24
denovo_density: Residue 247 stdev = 9.92855e-14 pose = 13.23132544321178 -4.871358730197754 -7.640979494050637 count = 24
denovo_density: Residue 248 stdev = 2.93309e-13 pose = 15.53347737471973 -5.691908454275575 -10.54885170216861 count = 24
denovo_density: Residue 249 stdev = 10.5551 pose = 16.00148796349822 -8.528930102795409 -7.687948477860920 count = 50
denovo_density: Residue 250 stdev = 9.4837 pose = 13.46959333717926 -10.72861991332541 -8.972583880148669 count = 75
denovo_density: Residue 251 stdev = 34.4971 pose = 12.65207310336102 -13.06107957992220 -8.440987345125521 count = 106
denovo_density: Residue 252 stdev = 64.5109 pose = 11.55896312237923 -13.44746240065320 -9.515244367063772 count = 137
denovo_density: Residue 253 stdev = 91.3675 pose = 9.398606660083471 -14.43331775508369 -9.175371998407815 count = 168
denovo_density: Residue 254 stdev = 121.576 pose = 8.368583432281506 -12.39586138182437 -10.65417776754808 count = 199
denovo_density: Residue 255 stdev = 114.813 pose = 10.35433909840983 -13.60394259212075 -13.24669974270393 count = 201
denovo_density: Residue 256 stdev = 111.825 pose = 9.731916154124933 -16.55931941191732 -12.94448618781079 count = 231
denovo_density: Residue 257 stdev = 138.6 pose = 6.722239988068385 -15.75357308026701 -12.68979991341682 count = 260
denovo_density: Residue 258 stdev = 180.486 pose = 7.866621684885674 -13.54494122234268 -14.67440314638534 count = 239
denovo_density: Residue 259 stdev = 185.748 pose = 10.48743659346422 -14.95999022117090 -15.74997217105956 count = 219
denovo_density: Residue 260 stdev = 204.245 pose = 8.513007133703548 -16.56614820543075 -15.21010036453690 count = 188
denovo_density: Residue 261 stdev = 254.002 pose = 6.764750174969675 -14.85463065989639 -16.06103259786857 count = 157
denovo_density: Residue 262 stdev = 273.002 pose = 9.296806051851357 -13.87005464386239 -18.12148404313337 count = 130
denovo_density: Residue 263 stdev = 284.604 pose = 11.24391667291078 -14.98848256350877 -17.97793453404217 count = 104
denovo_density: Residue 264 stdev = 404.367 pose = 12.16546609047970 -12.75491771338289 -15.98741478960865 count = 78
denovo_density: Residue 265 stdev = 500.904 pose = 18.94540729416632 -7.327417705634052 -12.88112373505114 count = 52
denovo_density: Residue 266 stdev = 4.40026 pose = 37.47021856003517 2.393772619317399 -2.099507050715945 count = 23
denovo_density: Residue 267 stdev = 31.0282 pose = 33.79909292613058 3.297217748351341 -4.063137658443605 count = 24
denovo_density: Residue 268 stdev = 78.516 pose = 34.56880757877087 4.227254425428226 -5.856679203119313 count = 25
denovo_density: Residue 269 stdev = 338.785 pose = 28.25200482253967 -1.243841137660536 -10.44725806083795 count = 37
denovo_density: Residue 270 stdev = 357.774 pose = 21.21489747980188 -3.389447360399801 -13.32103058042002 count = 44
denovo_density: Residue 271 stdev = 417.54 pose = 17.10339423923173 -2.986476113907116 -14.79318745198136 count = 52
denovo_density: Residue 272 stdev = 460.74 pose = 16.99030437910206 -5.137112977022918 -15.48701804822980 count = 47
denovo_density: Residue 273 stdev = 379.369 pose = 15.12121816359148 -6.704778833093286 -17.12901539706946 count = 53
denovo_density: Residue 274 stdev = 295.173 pose = 8.534401914850967 -6.183158355866668 -17.87937275237090 count = 63
denovo_density: Residue 275 stdev = 313.184 pose = 7.286159634659954 -6.753341041874487 -16.54789103696717 count = 78
denovo_density: Residue 276 stdev = 232.639 pose = 5.451365839202523 -8.205270750259468 -16.38770890639042 count = 89
denovo_density: Residue 277 stdev = 146.535 pose = 3.384034436424693 -7.334971880864890 -15.93940997238963 count = 101
denovo_density: Residue 278 stdev = 112.455 pose = 1.500327996615266 -7.485735799028724 -13.85834419833445 count = 101
denovo_density: Residue 279 stdev = 116.581 pose = 3.243149128823120 -7.960157390511722 -12.76989864423401 count = 106
denovo_density: Residue 280 stdev = 108.821 pose = 4.201028591350884 -6.579395138484826 -12.20723122539305 count = 104
denovo_density: Residue 281 stdev = 151.482 pose = 4.410099435186138 -5.789334916368933 -11.46745285495028 count = 118
denovo_density: Residue 282 stdev = 142.375 pose = 4.928164787170008 -6.486020105291940 -9.952499288746594 count = 126
denovo_density: Residue 283 stdev = 142.556 pose = 7.196754666170003 -6.149431788848222 -10.32350038571248 count = 128
denovo_density: Residue 284 stdev = 174.85 pose = 8.194184763780170 -4.384954249782373 -10.37072336319150 count = 118
denovo_density: Residue 285 stdev = 225.433 pose = 8.207017658327731 -4.441407902553674 -9.258163902147018 count = 105
denovo_density: Residue 286 stdev = 206.427 pose = 9.683717550075759 -5.933314907891563 -9.705781631596468 count = 90
denovo_density: Residue 287 stdev = 197.448 pose = 11.55065794583554 -4.776483667349549 -10.66204369997307 count = 78
denovo_density: Residue 288 stdev = 241.92 pose = 11.00188470429154 -3.699832287185844 -10.01888555719169 count = 72
denovo_density: Residue 289 stdev = 214.681 pose = 9.851211415372227 -4.926562680837888 -8.084867682961747 count = 62
denovo_density: Residue 290 stdev = 162.469 pose = 10.05501621585224 -6.446126566428891 -8.973156899379688 count = 52
denovo_density: Residue 291 stdev = 195.264 pose = 10.50568409784983 -6.053390828701849 -9.720210847852686 count = 42
denovo_density: Residue 292 stdev = 153.671 pose = 5.174507345170498 -8.234801889163043 -11.23061432670035 count = 30
denovo_density: Residue 293 stdev = 45.9963 pose = 5.241879132889536 -9.477623416739039 -12.83461898401162 count = 33
denovo_density: Residue 294 stdev = 26.4402 pose = 5.385556047113492 -9.144123819365568 -12.01014383138078 count = 37
denovo_density: Residue 295 stdev = 30.5095 pose = 2.949308875948620 -10.18281266345754 -9.951640205423210 count = 42
denovo_density: Residue 296 stdev = 19.8316 pose = 3.837090257780638 -10.88667730674443 -10.34679923753766 count = 51
denovo_density: Residue 297 stdev = 33.0958 pose = 6.672838085642721 -10.54434007527862 -11.72545149879269 count = 54
denovo_density: Residue 298 stdev = 71.3197 pose = 6.026956985311462 -11.03917136794360 -10.41977320069000 count = 59
denovo_density: Residue 299 stdev = 82.7845 pose = 4.398629502099338 -12.41171843393346 -9.717755553006567 count = 60
denovo_density: Residue 300 stdev = 100.435 pose = 6.303916436007131 -11.59697862828387 -10.94074220599498 count = 56
denovo_density: Residue 301 stdev = 137.522 pose = 9.342466832970899 -12.30741170805767 -11.97546815492160 count = 55
denovo_density: Residue 302 stdev = 182.111 pose = 9.196716772427651 -13.36604815000879 -10.55474281183184 count = 50
denovo_density: Residue 303 stdev = 252.336 pose = 11.31752008822112 -13.55091645001995 -10.15167837989690 count = 46
denovo_density: Residue 304 stdev = 261.689 pose = 14.88703826514386 -14.04366221280359 -12.19405415742778 count = 41
denovo_density: Residue 305 stdev = 267.807 pose = 17.37664060283849 -14.67538569607354 -12.58251077525894 count = 35
denovo_density: Residue 306 stdev = 342.955 pose = 21.21098069994829 -15.44736111923003 -12.86831561285723 count = 29
denovo_density: Residue 307 stdev = 325.835 pose = 24.63388563117788 -16.17209512842318 -13.05729194139350 count = 24
denovo_density: Residue 308 stdev = 223.299 pose = 27.42059019689697 -15.37035550466450 -12.45929634202712 count = 19
denovo_density: Residue 309 stdev = 235.544 pose = 28.17480226082639 -12.54768075810226 -13.22539980909942 count = 19
denovo_density: Residue 310 stdev = 280.939 pose = 28.96050028047171 -14.60183384590075 -15.97384070950462 count = 16
denovo_density: Residue 311 stdev = 300.899 pose = 27.17239943984605 -15.26380590049355 -17.28616966786014 count = 13
denovo_density: Residue 312 stdev = 306.537 pose = 24.03670663144681 -14.60968976502160 -18.88841858008721 count = 9
denovo_density: Residue 313 stdev = 328.372 pose = 26.51644324707496 -13.01726710255644 -19.77081261443125 count = 6
denovo_density: Residue 314 stdev = 352.775 pose = 27.30734400904931 -14.67535933581858 -22.06674745527733 count = 3
basic.io.database: Database file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv
basic.io.database: Database file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv
basic.io.database: Database file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv
basic.io.database: Database file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv
basic.io.database: Database file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv
basic.io.database: Database file opened: scoring/score_functions/rama/fd/all.ramaProb
basic.io.database: Database file opened: scoring/score_functions/rama/fd/prepro.ramaProb
basic.io.database: Database file opened: scoring/score_functions/omega/omega_ppdep.all.txt
basic.io.database: Database file opened: scoring/score_functions/omega/omega_ppdep.gly.txt
basic.io.database: Database file opened: scoring/score_functions/omega/omega_ppdep.pro.txt
basic.io.database: Database file opened: scoring/score_functions/omega/omega_ppdep.valile.txt
basic.io.database: Database file opened: scoring/score_functions/P_AA_pp/P_AA
basic.io.database: Database file opened: scoring/score_functions/P_AA_pp/P_AA_n
basic.io.database: Database file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop
basic.io.database: Database file opened: scoring/score_functions/elec_cp_reps.dat
basic.io.database: Database file opened: scoring/score_functions/bondlength_bondangle/default-lengths.txt
basic.io.database: Database file opened: scoring/score_functions/bondlength_bondangle/default-angles.txt
basic.io.database: Database file opened: scoring/score_functions/bondlength_bondangle/default-torsions.txt
basic.io.database: Database file opened: scoring/score_functions/bondlength_bondangle/default-improper.txt
Is there anying goes wrong?Thanks
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