make -k T0116-1-300-blast.rdb T0116-1-300-double-blast.rdb make[1]: Entering directory `/export/projects/compbio/experiments/casp4/t116/t116-1-300' /projects/compbio/experiments/casp4/scripts/single-blast -q T0116-1-300.seq -interdb /projects/compbio/data/nrp/nr -db /projects/compbio/data/pdb/all-protein > T0116-1-300-blast.rdb starting T0116-1-300 with E=10 /projects/compbio/experiments/casp4/scripts/double-blast -q T0116-1-300.seq -interdb /projects/compbio/data/nrp/nr -db /projects/compbio/data/pdb/all-protein > T0116-1-300-double-blast.rdb starting T0116-1-300 with E=0.000050 T0116-1-300 T0116-1-300 blasting: T0116-1-300 gi|135075|sp|P26359|SWI4_SCHPO_105:217 blasting: T0116-1-300 gi|135075|sp|P26359|SWI4_SCHPO_394:454 blasting: T0116-1-300 gi|79102|pir||A28668_14:188 blasting: T0116-1-300 gi|79102|pir||A28668_238:317 blasting: T0116-1-300 gi|123080|sp|P10564|HEXA_STRPN_6:302 blasting: T0116-1-300 gi|118951|sp|P20585|MSH3_HUMAN_231:346 blasting: T0116-1-300 gi|118951|sp|P20585|MSH3_HUMAN_534:585 blasting: T0116-1-300 gi|110917|pir||A32495_189:304 blasting: T0116-1-300 gi|110917|pir||A32495_492:543 blasting: T0116-1-300 gi|127555|sp|P27345|MUTS_AZOVI_9:191 blasting: T0116-1-300 gi|127555|sp|P27345|MUTS_AZOVI_222:315 blasting: T0116-1-300 gi|127556|sp|P23909|MUTS_ECOLI_12:186 blasting: T0116-1-300 gi|127556|sp|P23909|MUTS_ECOLI_236:317 blasting: T0116-1-300 gi|172000|gb|AAA34801.1|_79:267 blasting: T0116-1-300 gi|172000|gb|AAA34801.1|_361:414 blasting: T0116-1-300 gi|400971|sp|P13705|MSH3_MOUSE_189:304 blasting: T0116-1-300 gi|400971|sp|P13705|MSH3_MOUSE_492:543 blasting: T0116-1-300 gi|387849|gb|AAB60711.1|_189:304 blasting: T0116-1-300 gi|387849|gb|AAB60711.1|_492:543 blasting: T0116-1-300 gi|417330|sp|P10339|MUTS_SALTY_14:188 blasting: T0116-1-300 gi|417330|sp|P10339|MUTS_SALTY_238:317 blasting: T0116-1-300 gi|448278|prf||1916402A_437:494 blasting: T0116-1-300 gi|448278|prf||1916402A_161:256 blasting: T0116-1-300 gi|1002520|gb|AAB19235.1|_1:294 blasting: T0116-1-300 gi|1171081|sp|P44834|MUTS_HAEIN_12:189 blasting: T0116-1-300 gi|1171081|sp|P44834|MUTS_HAEIN_229:317 blasting: T0116-1-300 gi|1076927|pir||S22569_13:125 blasting: T0116-1-300 gi|1076927|pir||S22569_302:362 blasting: T0116-1-300 gi|1082386|pir||A56742_340:453 blasting: T0116-1-300 gi|1082386|pir||A56742_665:714 blasting: T0116-1-300 gi|1082386|pir||A56742_440:500 blasting: T0116-1-300 gi|1083296|pir||JC4019_203:318 blasting: T0116-1-300 gi|1083296|pir||JC4019_527:578 blasting: T0116-1-300 gi|2497995|sp|Q56215|MUTS_THEAQ_1:300 blasting: T0116-1-300 gi|1588283|prf||2208298A_313:457 blasting: T0116-1-300 gi|1588283|prf||2208298A_579:664 blasting: T0116-1-300 gi|1592569|gb|AAB97931.1|_12:186 blasting: T0116-1-300 gi|1592569|gb|AAB97931.1|_236:315 blasting: T0116-1-300 gi|3024198|sp|P70755|MUTS_AQUPY_2:305 blasting: T0116-1-300 gi|1619909|gb|AAB16999.1|_5:298 blasting: T0116-1-300 gi|7448108|pir||S74860_59:341 blasting: T0116-1-300 gi|7448108|pir||S74860_273:385 blasting: T0116-1-300 gi|1709123|sp|P52701|MSH6_HUMAN_408:521 blasting: T0116-1-300 gi|1709123|sp|P52701|MSH6_HUMAN_733:782 blasting: T0116-1-300 gi|1709123|sp|P52701|MSH6_HUMAN_508:568 blasting: T0116-1-300 gi|2506881|sp|P54276|MSH6_MOUSE_407:520 blasting: T0116-1-300 gi|2506881|sp|P54276|MSH6_MOUSE_730:779 blasting: T0116-1-300 gi|2506881|sp|P54276|MSH6_MOUSE_507:567 blasting: T0116-1-300 gi|1871501|dbj|BAA09880.1|_9:308 blasting: T0116-1-300 gi|2072992|gb|AAC46142.1|_1:119 blasting: T0116-1-300 gi|2104549|gb|AAB57798.1|_396:526 blasting: T0116-1-300 gi|2104549|gb|AAB57798.1|_639:758 blasting: T0116-1-300 gi|2145507|pir||S62790_9:307 blasting: T0116-1-300 gi|2209102|gb|AAB96581.1|_12:58 blasting: T0116-1-300 gi|7490460|pir||T37626_60:189 blasting: T0116-1-300 gi|2497996|sp|Q56239|MUTS_THETH_9:308 blasting: T0116-1-300 gi|7404403|sp|P49849|MUTS_BACSU_6:300 blasting: T0116-1-300 gi|7512473|pir||JC5840_408:521 blasting: T0116-1-300 gi|7512473|pir||JC5840_733:782 blasting: T0116-1-300 gi|7512473|pir||JC5840_508:568 blasting: T0116-1-300 gi|3914075|sp|O51737|MUTS_BORBU_7:172 blasting: T0116-1-300 gi|3914075|sp|O51737|MUTS_BORBU_259:312 blasting: T0116-1-300 gi|7512474|pir||JC5839_408:521 blasting: T0116-1-300 gi|7512474|pir||JC5839_733:782 blasting: T0116-1-300 gi|7512474|pir||JC5839_508:568 blasting: T0116-1-300 gi|3914062|sp|O65607|MSH3_ARATH_106:147 blasting: T0116-1-300 gi|3914062|sp|O65607|MSH3_ARATH_394:455 blasting: T0116-1-300 gi|3914079|sp|O66652|MUTS_AQUAE_8:309 blasting: T0116-1-300 gi|3093751|gb|AAC29005.1|_7:56 blasting: T0116-1-300 gi|3319876|emb|CAA07684.1|_106:214 blasting: T0116-1-300 gi|3319876|emb|CAA07684.1|_411:472 blasting: T0116-1-300 gi|6093453|sp|O83348|MUTS_TREPA_9:208 blasting: T0116-1-300 gi|6093453|sp|O83348|MUTS_TREPA_190:317 blasting: T0116-1-300 gi|7387913|sp|O84797|MUTS_CHLTR_5:195 blasting: T0116-1-300 gi|7387913|sp|O84797|MUTS_CHLTR_225:315 blasting: T0116-1-300 gi|7492209|pir||T41262_376:506 blasting: T0116-1-300 gi|7492209|pir||T41262_624:715 blasting: T0116-1-300 gi|7492209|pir||T41262_789:812 blasting: T0116-1-300 gi|6647605|sp|Q9ZDM9|MUTS_RICPR_23:214 blasting: T0116-1-300 gi|6647605|sp|Q9ZDM9|MUTS_RICPR_257:336 blasting: T0116-1-300 gi|6226648|sp|O04716|MSH6_ARATH_384:513 blasting: T0116-1-300 gi|6226648|sp|O04716|MSH6_ARATH_626:745 blasting: T0116-1-300 gi|7387928|sp|Q9ZIX6|MUTS_THECA_9:305 blasting: T0116-1-300 gi|7387924|sp|Q9Z6W5|MUTS_CHLPN_8:175 blasting: T0116-1-300 gi|7387924|sp|Q9Z6W5|MUTS_CHLPN_280:318 blasting: T0116-1-300 gi|4775578|emb|CAB42555.1|_370:542 blasting: T0116-1-300 gi|4775578|emb|CAB42555.1|_640:699 blasting: T0116-1-300 gi|4775580|emb|CAB42556.1|_63:235 blasting: T0116-1-300 gi|4775580|emb|CAB42556.1|_333:392 blasting: T0116-1-300 gi|4887554|emb|CAB43497.1|_12:186 blasting: T0116-1-300 gi|4887554|emb|CAB43497.1|_236:317 blasting: T0116-1-300 gi|6226653|sp|P74926|MUTS_THEMA_5:298 blasting: T0116-1-300 gi|6166561|sp|O13921|MSH1_SCHPO_60:189 blasting: T0116-1-300 gi|6166561|sp|O13921|MSH1_SCHPO_218:257 blasting: T0116-1-300 gi|6166561|sp|O13921|MSH1_SCHPO_316:391 blasting: T0116-1-300 gi|6224917|gb|AAF06013.1|AF193018_1_272:446 blasting: T0116-1-300 gi|6224917|gb|AAF06013.1|AF193018_1_545:604 blasting: T0116-1-300 gi|7108493|gb|AAF36440.1|AF126491_1_9:177 blasting: T0116-1-300 gi|7108493|gb|AAF36440.1|AF126491_1_233:315 blasting: T0116-1-300 gi|7189834|gb|AAF38705.1|_8:175 blasting: T0116-1-300 gi|7189834|gb|AAF38705.1|_280:318 blasting: T0116-1-300 gi|7190210|gb|AAF39048.1|_5:195 blasting: T0116-1-300 gi|7190210|gb|AAF39048.1|_225:315 blasting: T0116-1-300 gi|7227419|gb|AAF42468.1|_8:175 blasting: T0116-1-300 gi|7227419|gb|AAF42468.1|_232:314 blasting: T0116-1-300 gi|7229490|gb|AAF42850.1|_9:177 blasting: T0116-1-300 gi|7229490|gb|AAF42850.1|_233:315 blasting: T0116-1-300 gi|7269404|emb|CAB81364.1|_106:147 blasting: T0116-1-300 gi|7269404|emb|CAB81364.1|_394:455 blasting: T0116-1-300 gi|7294307|gb|AAF49656.1|_255:419 blasting: T0116-1-300 gi|7294307|gb|AAF49656.1|_579:624 blasting: T0116-1-300 gi|7328284|emb|CAB82466.1|_6:300 blasting: T0116-1-300 gi|7331984|gb|AAF60672.1|_857:964 blasting: T0116-1-300 gi|7331984|gb|AAF60672.1|_1196:1223 blasting: T0116-1-300 gi|7379009|emb|CAB83555.1|_8:175 blasting: T0116-1-300 gi|7379009|emb|CAB83555.1|_232:314 blasting: T0116-1-300 gi|7404405|sp|P73769|MUTS_SYNY3_25:307 blasting: T0116-1-300 gi|7404405|sp|P73769|MUTS_SYNY3_239:351 blasting: T0116-1-300 gi|7547005|gb|AAF63754.1|AF242852_1_68:176 blasting: T0116-1-300 gi|8473172|sp|P56883|MUTS_RHIME_31:207 blasting: T0116-1-300 gi|8473172|sp|P56883|MUTS_RHIME_267:348 blasting: T0116-1-300 gi|9106782|gb|AAF84525.1|AE003995_7_43:222 blasting: T0116-1-300 gi|9106782|gb|AAF84525.1|AE003995_7_275:354 blasting: T0116-1-300 gi|9294039|dbj|BAB01996.1|_272:446 blasting: T0116-1-300 gi|9294039|dbj|BAB01996.1|_545:604 blasting: T0116-1-300 gi|9654962|gb|AAF93703.1|_17:187 blasting: T0116-1-300 gi|9654962|gb|AAF93703.1|_241:322 blasting: make[1]: Leaving directory `/export/projects/compbio/experiments/casp4/t116/t116-1-300' make -k T0116-1-300.t2k.a2m.gz \ T0116-1-300.t2k.pa \ T0116-1-300.t2k.pa.html \ T0116-1-300.t2k.2d \ T0116-1-300.t2k.tree \ T0116-1-300.t2k_sorted.pa \ T0116-1-300.t2k.tree.ps \ T0116-1-300.t2k.tree-unroot.ps make[1]: Entering directory `/export/projects/compbio/experiments/casp4/t116/t116-1-300' /projects/compbio/experiments/models.97/scripts2k/target2k -out T0116-1-300.t2k \ -seed T0116-1-300.seq \ -all @@@@ chgrp protein /projects/compbio/tmp/target2k-beta-6542 @@@@ cp /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.seq m0.a2m @@@@ checkseq foo -alphabet protein -db m0.a2m > init.check SAM: checkseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:52 # About to count sequences in /projects/compbio/data/nrp/nr /projects/compbio/experiments/models.97/scripts2k/target2k: E-value thresholds used are prefilter: 0.01, actual: 0.0001 prefilter: 1, actual: 0.0002 prefilter: 10, actual: 0.001 prefilter: 400, actual: 0.005 /projects/compbio/experiments/models.97/scripts2k/target2k: aweight_bits are 0.8, 0.7, 0.6, 0.5 /projects/compbio/experiments/models.97/scripts2k/target2k: db_size= 541007 reverse_diff= 4 /projects/compbio/experiments/models.97/scripts2k/target2k: blast_max_report= 20000 /projects/compbio/experiments/models.97/scripts2k/target2k: db=/projects/compbio/data/nrp/nr /projects/compbio/experiments/models.97/scripts2k/target2k: aweight_method=1 aweight_exponent=10 /projects/compbio/experiments/models.97/scripts2k/target2k: force_seed=1 constraints=1 /projects/compbio/experiments/models.97/scripts2k/target2k: jump_in=0.2 jump_out=1 fimstrength=1 fimtrans=-1 @@@@ blast-prefilter -out prefilter -seed m0.a2m -prefilter_thresholds 0.01,1,10,400 -db /projects/compbio/data/nrp/nr -blast_max_report 20000 @@@@ chgrp protein /projects/compbio/tmp/blast-prefilter-beta-32362 /projects/compbio/experiments/models.97/scripts2k/blast-prefilter: E-value thresholds used are For /export/projects/compbio/tmp/target2k-beta-6542/prefilter_1.fa, 0.01 For /export/projects/compbio/tmp/target2k-beta-6542/prefilter_2.fa, 1 For /export/projects/compbio/tmp/target2k-beta-6542/prefilter_3.fa, 10 For /export/projects/compbio/tmp/target2k-beta-6542/prefilter_4.fa, 400 /projects/compbio/experiments/models.97/scripts2k/blast-prefilter: db=/projects/compbio/data/nrp/nr @@@@ uniqueseq init -alignfile /export/projects/compbio/tmp/target2k-beta-6542/m0.a2m -a protein -a2mdots 0 SAM: uniqueseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:59 Reading alignment file /export/projects/compbio/tmp/target2k-beta-6542/m0.a2m (1 sequences, 300 columns) as A2M alignment. Writing sequence output to init.a2m. No sequences have been dropped. @@@@ /projects/compbio/bin/wu-blastp /projects/compbio/data/nrp/nr 1.fasta E=400 V=20000 B=0 -gi > 1.fasta-blast.out Searched 541007 sequences # parsing wu-blastp output @@@@ rm -f 1.fasta < /dev/null @@@@ rm -f 1.fasta-blast.out < /dev/null # Extracting hits in FASTA format from /projects/compbio/data/nrp/nr @@@@ rm -rf /projects/compbio/tmp/blast-prefilter-beta-32362 < /dev/null @@@@ modelfromalign unused -alignfile m0.a2m \ -constraints_from_align 1 -constraints_out m0.cst SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file m0.a2m (1 sequences, 300 columns) as A2M alignment. # About to count sequences in m0.a2m # About to count sequences in prefilter_1.fa @@@@ modelfromalign tmp_1-a -alignfile m0.a2m \ -insert /projects/compbio/lib/gap1.5.regularizer \ -aweight_bits 0.8\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 -constraints m0.cst -constraints_out tmp_1-a.cst Reading parameter file /projects/compbio/lib/gap1.5.regularizer /projects/compbio/lib/gap1.5.regularizer(1): Reading REGULARIZER: gap1.5. Weak regularizer, gaps average 1.5, matches average 10 SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file m0.a2m (1 sequences, 300 columns) as A2M alignment. @@@@ hmmscore tmp_1-a -i tmp_1-a.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -simple_threshold -26.4115278685381 -Emax 0.0001 \ -adpstyle 1 \ -align_short 0 -mdEmax 0.0001\ -select_score 4 \ -select_seq 4 \ -select_mdalign 4 -select_md 4 -Motifcutoff 0.0666666666666667 -db prefilter_1.fa -constraints tmp_1-a.cst -constraints_out tmp_1-a-md.cst Reading parameter file tmp_1-a.mod tmp_1-a.mod(21): Reading MODEL -- Model from alignment file m0.a2m SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -87.880569 Database has 90 sequences with 81173 residues. @@@@ sortseq tmp_1-a-sort -alignfile tmp_1-a.mult \ -NLLfile tmp_1-a.mstat -a2mdots 0 SAM: sortseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:48 Reading alignment file tmp_1-a.mult (61 sequences, 300 columns) as A2M alignment. Reading scores from file tmp_1-a.mstat Writing sequence output to tmp_1-a-sort.a2m. @@@@ cat m0.a2m tmp_1-a-sort.a2m > tmp_1-a.train.seq @@@@ cat m0.cst tmp_1-a-md.cst > tmp_1-a.train.cst # About to count sequences in tmp_1-a.train.seq # num_seqs=62 nll_thresh=-22.4115278685381 frac_id=0.979026034994993 @@@@ uniqueseq thinned_tmp -alignfile tmp_1-a.train.seq -a protein \ -percent_id 0.979026034994993 -a2mdots 0 SAM: uniqueseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:59 Reading alignment file tmp_1-a.train.seq (62 sequences, 300 columns) as A2M alignment. Writing sequence output to thinned_tmp.a2m. Dropping 17 (of 62) duplicate sequences with differing IDs Dropping 7 (of 62) sequences with > 97.9% id 38 sequences left after dropping 24 of 62 sequences. @@@@ modelfromalign junk_for_weights \ -alignfile tmp_1-a.train.seq \ -aweight_bits 0.8\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file tmp_1-a.train.seq (38 sequences, 300 columns) as A2M alignment. @@@@ buildmodel tmp_1-b -insert tmp_1-a.mod\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -modellength 0 \ -internal_weight 0 \ -anneal_length 2 \ -many_files 1 \ -Nseq 20000\ -nsurgery 0 \ -fracinsert 0.2 \ -cutinsert 0.25 -cutmatch 0.2 -initial_noise 0.0001 -anneal_noise 0.000001 \ -internal_weight 0 \ -train tmp_1-a.train.seq \ -nmodels 1\ -insert /projects/compbio/lib/gap1.5.regularizer -sequence_weights tmp_1-a.w -constraints tmp_1-a.train.cst Reading parameter file tmp_1-a.mod tmp_1-a.mod(21): Reading MODEL -- Model from alignment file m0.a2m Command line option(48): internal_weight has already been set. Using 0. Reading parameter file /projects/compbio/lib/gap1.5.regularizer /projects/compbio/lib/gap1.5.regularizer(1): Reading REGULARIZER: gap1.5. Weak regularizer, gaps average 1.5, matches average 10 SAM: buildmodel v3.2 (July 31, 2000) compiled 07/31/00_14:08:12 -841.59 87.74 -200.37 178.05 22 0 301 @@@@ hmmscore tmp_1-b -i tmp_1-b.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -db m0.a2m -db tmp_1-a.sel \ -select_score 4 \ -select_seq 4 \ -simple_threshold -26.4115278685381 -Emax 0.0001 \ -select_mdalign 4 -select_md 4 \ -adpstyle 1 \ -Motifcutoff 0.0666666666666667 \ -align_short 5 -mdEmax 0.0001 -constraints tmp_1-a.train.cst -constraints_out /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_1.cst Reading parameter file tmp_1-b.mod tmp_1-b.mod(18): Reading MODEL -- Final model for run tmp_1-b SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -229.503403 Database has 78 sequences with 70523 residues. @@@@ cp -f tmp_1-b.mult /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_1.a2m # About to count sequences in prefilter_2.fa @@@@ modelfromalign tmp_2-a -alignfile /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_1.a2m \ -insert /projects/compbio/lib/stiff-gap5.regularizer \ -aweight_bits 0.7\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 -constraints /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_1.cst -constraints_out tmp_2-a.cst Reading parameter file /projects/compbio/lib/stiff-gap5.regularizer /projects/compbio/lib/stiff-gap5.regularizer(1): Reading REGULARIZER: gap5. stiff regularizer, gaps averge 5, matches average 10 SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_1.a2m (78 sequences, 300 columns) as A2M alignment. @@@@ hmmscore tmp_2-a -i tmp_2-a.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -simple_threshold -25.7183806877933 -Emax 0.0002 \ -adpstyle 1 \ -align_short 0 -mdEmax 0.0002\ -select_score 4 \ -select_seq 4 \ -select_mdalign 4 -select_md 4 -Motifcutoff 0.0666666666666667 -db prefilter_2.fa -constraints tmp_2-a.cst -constraints_out tmp_2-a-md.cst Reading parameter file tmp_2-a.mod tmp_2-a.mod(21): Reading MODEL -- Model from alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_1.a2m SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -209.401474 Database has 96 sequences with 85370 residues. @@@@ sortseq tmp_2-a-sort -alignfile tmp_2-a.mult \ -NLLfile tmp_2-a.mstat -a2mdots 0 SAM: sortseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:48 Reading alignment file tmp_2-a.mult (95 sequences, 300 columns) as A2M alignment. Reading scores from file tmp_2-a.mstat Writing sequence output to tmp_2-a-sort.a2m. @@@@ cat m0.a2m tmp_2-a-sort.a2m > tmp_2-a.train.seq @@@@ cat m0.cst tmp_2-a-md.cst > tmp_2-a.train.cst # About to count sequences in tmp_2-a.train.seq # num_seqs=96 nll_thresh=-21.7183806877933 frac_id=0.924567131970047 @@@@ uniqueseq thinned_tmp -alignfile tmp_2-a.train.seq -a protein \ -percent_id 0.924567131970047 -a2mdots 0 SAM: uniqueseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:59 Reading alignment file tmp_2-a.train.seq (96 sequences, 300 columns) as A2M alignment. Writing sequence output to thinned_tmp.a2m. Dropping 24 (of 96) duplicate sequences with differing IDs Dropping 22 (of 96) sequences with > 92.5% id 50 sequences left after dropping 46 of 96 sequences. @@@@ modelfromalign junk_for_weights \ -alignfile tmp_2-a.train.seq \ -aweight_bits 0.7\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file tmp_2-a.train.seq (50 sequences, 300 columns) as A2M alignment. @@@@ buildmodel tmp_2-b -insert tmp_2-a.mod\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -modellength 0 \ -internal_weight 0 \ -anneal_length 2 \ -many_files 1 \ -Nseq 20000\ -nsurgery 0 \ -fracinsert 0.2 \ -cutinsert 0.25 -cutmatch 0.2 -initial_noise 0.0001 -anneal_noise 0.000001 \ -internal_weight 0 \ -train tmp_2-a.train.seq \ -nmodels 1\ -insert /projects/compbio/lib/stiff-gap5.regularizer -sequence_weights tmp_2-a.w -constraints tmp_2-a.train.cst Reading parameter file tmp_2-a.mod tmp_2-a.mod(21): Reading MODEL -- Model from alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_1.a2m Command line option(48): internal_weight has already been set. Using 0. Reading parameter file /projects/compbio/lib/stiff-gap5.regularizer /projects/compbio/lib/stiff-gap5.regularizer(1): Reading REGULARIZER: gap5. stiff regularizer, gaps averge 5, matches average 10 SAM: buildmodel v3.2 (July 31, 2000) compiled 07/31/00_14:08:12 -842.63 4.93 -216.82 112.91 6 0 301 @@@@ hmmscore tmp_2-b -i tmp_2-b.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -db m0.a2m -db tmp_2-a.sel \ -select_score 4 \ -select_seq 4 \ -simple_threshold -25.7183806877933 -Emax 0.0002 \ -select_mdalign 4 -select_md 4 \ -adpstyle 1 \ -Motifcutoff 0.0666666666666667 \ -align_short 5 -mdEmax 0.0002 -constraints tmp_2-a.train.cst -constraints_out /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_2.cst Reading parameter file tmp_2-b.mod tmp_2-b.mod(18): Reading MODEL -- Final model for run tmp_2-b SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -224.663315 Database has 96 sequences with 85347 residues. @@@@ cp -f tmp_2-b.mult /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_2.a2m # About to count sequences in prefilter_3.fa @@@@ modelfromalign tmp_3-a -alignfile /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_2.a2m \ -insert /projects/compbio/lib/stiff-gap5.regularizer \ -aweight_bits 0.6\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 -constraints /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_2.cst -constraints_out tmp_3-a.cst Reading parameter file /projects/compbio/lib/stiff-gap5.regularizer /projects/compbio/lib/stiff-gap5.regularizer(1): Reading REGULARIZER: gap5. stiff regularizer, gaps averge 5, matches average 10 SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_2.a2m (96 sequences, 300 columns) as A2M alignment. @@@@ hmmscore tmp_3-a -i tmp_3-a.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -simple_threshold -24.1089427738805 -Emax 0.001 \ -adpstyle 1 \ -align_short 0 -mdEmax 0.001\ -select_score 4 \ -select_seq 4 \ -select_mdalign 4 -select_md 4 -Motifcutoff 0.0666666666666667 -db prefilter_3.fa -constraints tmp_3-a.cst -constraints_out tmp_3-a-md.cst Reading parameter file tmp_3-a.mod tmp_3-a.mod(21): Reading MODEL -- Model from alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_2.a2m SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -191.494308 Database has 106 sequences with 88844 residues. @@@@ sortseq tmp_3-a-sort -alignfile tmp_3-a.mult \ -NLLfile tmp_3-a.mstat -a2mdots 0 SAM: sortseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:48 Reading alignment file tmp_3-a.mult (96 sequences, 300 columns) as A2M alignment. Reading scores from file tmp_3-a.mstat Writing sequence output to tmp_3-a-sort.a2m. @@@@ cat m0.a2m tmp_3-a-sort.a2m > tmp_3-a.train.seq @@@@ cat m0.cst tmp_3-a-md.cst > tmp_3-a.train.cst # About to count sequences in tmp_3-a.train.seq # num_seqs=97 nll_thresh=-20.1089427738805 frac_id=0.910607772509715 @@@@ uniqueseq thinned_tmp -alignfile tmp_3-a.train.seq -a protein \ -percent_id 0.910607772509715 -a2mdots 0 SAM: uniqueseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:59 Reading alignment file tmp_3-a.train.seq (97 sequences, 300 columns) as A2M alignment. Writing sequence output to thinned_tmp.a2m. Dropping 24 (of 97) duplicate sequences with differing IDs Dropping 25 (of 97) sequences with > 91.1% id 48 sequences left after dropping 49 of 97 sequences. @@@@ modelfromalign junk_for_weights \ -alignfile tmp_3-a.train.seq \ -aweight_bits 0.6\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file tmp_3-a.train.seq (48 sequences, 300 columns) as A2M alignment. @@@@ buildmodel tmp_3-b -insert tmp_3-a.mod\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -modellength 0 \ -internal_weight 0 \ -anneal_length 2 \ -many_files 1 \ -Nseq 20000\ -nsurgery 0 \ -fracinsert 0.2 \ -cutinsert 0.25 -cutmatch 0.2 -initial_noise 0.0001 -anneal_noise 0.000001 \ -internal_weight 0 \ -train tmp_3-a.train.seq \ -nmodels 1\ -insert /projects/compbio/lib/stiff-gap5.regularizer -sequence_weights tmp_3-a.w -constraints tmp_3-a.train.cst Reading parameter file tmp_3-a.mod tmp_3-a.mod(21): Reading MODEL -- Model from alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_2.a2m Command line option(48): internal_weight has already been set. Using 0. Reading parameter file /projects/compbio/lib/stiff-gap5.regularizer /projects/compbio/lib/stiff-gap5.regularizer(1): Reading REGULARIZER: gap5. stiff regularizer, gaps averge 5, matches average 10 SAM: buildmodel v3.2 (July 31, 2000) compiled 07/31/00_14:08:12 -843.81 8.24 -208.42 110.46 9 0 301 @@@@ hmmscore tmp_3-b -i tmp_3-b.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -db m0.a2m -db tmp_3-a.sel \ -select_score 4 \ -select_seq 4 \ -simple_threshold -24.1089427738805 -Emax 0.001 \ -select_mdalign 4 -select_md 4 \ -adpstyle 1 \ -Motifcutoff 0.0666666666666667 \ -align_short 5 -mdEmax 0.001 -constraints tmp_3-a.train.cst -constraints_out /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_3.cst Reading parameter file tmp_3-b.mod tmp_3-b.mod(18): Reading MODEL -- Final model for run tmp_3-b SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -208.816849 Database has 98 sequences with 86575 residues. @@@@ cp -f tmp_3-b.mult /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_3.a2m # About to count sequences in prefilter_4.fa @@@@ modelfromalign tmp_4-a -alignfile /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_3.a2m \ -insert /projects/compbio/lib/fssp-trained.regularizer \ -aweight_bits 0.5\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 -constraints /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_3.cst -constraints_out tmp_4-a.cst Reading parameter file /projects/compbio/lib/fssp-trained.regularizer /projects/compbio/lib/fssp-trained.regularizer(1): Reading REGULARIZER: transitions from FSSP and pseudocounts for diverse weighted HSSP SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_3.a2m (97 sequences, 300 columns) as A2M alignment. @@@@ hmmscore tmp_4-a -i tmp_4-a.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -simple_threshold -22.4995048540528 -Emax 0.005 \ -adpstyle 1 \ -align_short 0 -mdEmax 0.005\ -select_score 4 \ -select_seq 4 \ -select_mdalign 4 -select_md 4 -Motifcutoff 0.0666666666666667 -db prefilter_4.fa -constraints tmp_4-a.cst -constraints_out tmp_4-a-md.cst Reading parameter file tmp_4-a.mod tmp_4-a.mod(21): Reading MODEL -- Model from alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_3.a2m SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -68.889702 Database has 320 sequences with 143049 residues. @@@@ sortseq tmp_4-a-sort -alignfile tmp_4-a.mult \ -NLLfile tmp_4-a.mstat -a2mdots 0 SAM: sortseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:48 Reading alignment file tmp_4-a.mult (114 sequences, 300 columns) as A2M alignment. Reading scores from file tmp_4-a.mstat Writing sequence output to tmp_4-a-sort.a2m. @@@@ cat m0.a2m tmp_4-a-sort.a2m > tmp_4-a.train.seq @@@@ cat m0.cst tmp_4-a-md.cst > tmp_4-a.train.cst # About to count sequences in tmp_4-a.train.seq # num_seqs=115 nll_thresh=-18.4995048540528 frac_id=0.866579386442564 @@@@ uniqueseq thinned_tmp -alignfile tmp_4-a.train.seq -a protein \ -percent_id 0.866579386442564 -a2mdots 0 SAM: uniqueseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:59 Reading alignment file tmp_4-a.train.seq (115 sequences, 300 columns) as A2M alignment. Writing sequence output to thinned_tmp.a2m. Dropping 30 (of 115) duplicate sequences with differing IDs Dropping 35 (of 115) sequences with > 86.7% id 50 sequences left after dropping 65 of 115 sequences. @@@@ modelfromalign junk_for_weights \ -alignfile tmp_4-a.train.seq \ -aweight_bits 0.5\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file tmp_4-a.train.seq (50 sequences, 300 columns) as A2M alignment. @@@@ buildmodel tmp_4-b -insert tmp_4-a.mod\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -modellength 0 \ -internal_weight 0 \ -anneal_length 2 \ -many_files 1 \ -Nseq 20000\ -nsurgery 0 \ -fracinsert 0.2 \ -cutinsert 0.25 -cutmatch 0.2 -initial_noise 0.0001 -anneal_noise 0.000001 \ -internal_weight 0 \ -train tmp_4-a.train.seq \ -nmodels 1\ -insert /projects/compbio/lib/fssp-trained.regularizer -sequence_weights tmp_4-a.w -constraints tmp_4-a.train.cst Reading parameter file tmp_4-a.mod tmp_4-a.mod(21): Reading MODEL -- Model from alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_3.a2m Command line option(48): internal_weight has already been set. Using 0. Reading parameter file /projects/compbio/lib/fssp-trained.regularizer /projects/compbio/lib/fssp-trained.regularizer(1): Reading REGULARIZER: transitions from FSSP and pseudocounts for diverse weighted HSSP SAM: buildmodel v3.2 (July 31, 2000) compiled 07/31/00_14:08:12 -844.83 -3.41 -183.76 112.17 8 0 301 @@@@ hmmscore tmp_4-b -i tmp_4-b.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -db m0.a2m -db tmp_4-a.sel \ -select_score 4 \ -select_seq 4 \ -simple_threshold -22.4995048540528 -Emax 0.005 \ -select_mdalign 4 -select_md 4 \ -adpstyle 1 \ -Motifcutoff 0.0666666666666667 \ -align_short 5 -mdEmax 0.005 -constraints tmp_4-a.train.cst -constraints_out /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_4.cst Reading parameter file tmp_4-b.mod tmp_4-b.mod(18): Reading MODEL -- Final model for run tmp_4-b SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -177.563171 Database has 116 sequences with 98482 residues. @@@@ cp -f tmp_4-b.mult /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_4.a2m @@@@ modelfromalign tmp_5-a -alignfile /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_4.a2m \ -insert /projects/compbio/lib/fssp-trained.regularizer \ -aweight_bits 0.5\ -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1 \ -aweight_method 1\ -aweight_exponent 10 -constraints /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_4.cst -constraints_out tmp_5-a.cst Reading parameter file /projects/compbio/lib/fssp-trained.regularizer /projects/compbio/lib/fssp-trained.regularizer(1): Reading REGULARIZER: transitions from FSSP and pseudocounts for diverse weighted HSSP SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_4.a2m (115 sequences, 300 columns) as A2M alignment. @@@@ hmmscore tmp_5-a -i tmp_5-a.mod -fimtrans -1\ -fimstrength 1\ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -binary_output 1\ -prior_library /projects/compbio/lib/recode3.20comp \ -a2mdots 0 \ -a protein \ -sw 2 -jump_in_prob 0.2 -jump_out_prob 1\ -dpstyle 0 \ -subtract_null 4 -sort 2 \ -db_size 541007 \ -simple_threshold -22.4995048540528 -Emax 0.005 \ -adpstyle 5 \ -align_short 0 -mdEmax 0.005\ -select_score 4 \ -select_seq 4 \ -select_mdalign 4 -select_md 4 -Motifcutoff 0.0666666666666667 -db prefilter_4.fa -constraints tmp_5-a.cst -constraints_out tmp_5-a-md.cst Reading parameter file tmp_5-a.mod tmp_5-a.mod(21): Reading MODEL -- Model from alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k_4.a2m SAM: hmmscore v3.2 (July 31, 2000) compiled 08/04/00_11:31:33 Calculating Distances (. = 1000 sequences) . Average NLL-Simple NULL score: -70.662865 Database has 320 sequences with 143049 residues. @@@@ sortseq tmp_5-a-sort -alignfile tmp_5-a.mult \ -NLLfile tmp_5-a.mstat -a2mdots 0 SAM: sortseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:48 Reading alignment file tmp_5-a.mult (105 sequences, 300 columns) as A2M alignment. Reading scores from file tmp_5-a.mstat Writing sequence output to tmp_5-a-sort.a2m. @@@@ cat m0.a2m tmp_5-a-sort.a2m > tmp_5-a.train.seq @@@@ cat m0.cst tmp_5-a-md.cst > tmp_5-a.train.cst @@@@ cp tmp_5-a.train.seq /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k.a2m @@@@ cp tmp_5-a.train.cst /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k.cst @@@@ rm -rf /projects/compbio/tmp/target2k-beta-6542 < /dev/null gzip -f T0116-1-300.t2k.a2m T0116-1-300.t2k_*.a2m prettyalign T0116-1-300.t2k.a2m.gz -m8 -i -n -L3333 > T0116-1-300.t2k.pa SAM: prettyalign v3.2 (July 31, 2000) compiled 08/11/00_16:27:51 gunzip -c T0116-1-300.t2k.a2m.gz > tmp.a2m a2m2html -a2m_in tmp.a2m -retrieve > T0116-1-300.t2k.pa.html SAM: /projects/compbio/bin/alpha/prettyalign v3.2 (July 31, 2000) compiled 08/11/00_16:27:51 rm tmp.a2m echo ReadNeuralNet /projects/compbio/usr/karplus/predict-2nd/testing/networks/overrep-2500-IDaa13-5-10-7-10-5-10-11-ehl2-seeded9-stride-trained.net > tmp.script echo ReadA2M T0116-1-300.t2k.a2m.gz >> tmp.script echo PrintPrediction T0116-1-300.t2k.2d 3670-4530-6947 >> tmp.script echo PrintPredictionFasta T0116-1-300.t2k.2d.seq >> tmp.script echo PrintRDB T0116-1-300.t2k.2d.rdb >> tmp.script predict-2nd < tmp.script # command:# Neural network set to overrep-2500-IDaa13-5-10-7-10-5-10-11-ehl2-seeded9-stride-trained.net # command:# Reading A2M format from T0116-1-300.t2k.a2m.gz # Using SequenceWeight EntropyWeight(1.4, 10) # Using regularizer /projects/compbio/lib/recode3.20comp for sequence weight regularizer. # T0116-1-300.t2k.a2m with 106 sequences, total weight= 66.4928 avg weight= 0.627291 clipped 46 iterations # AdjustWeights couldn't save exactly 1.4 bits/position, saving 1.36291 bits. Regularizing alignment for T0116-1-300.t2k.a2m.gz # After reading T0116-1-300.t2k.a2m.gz, have 300 columns in 1 chains # command:# Initializing Gain for FinalLayer # Initializing Gain for ordering_layer # Initializing Gain for SecondLayer # Initializing Gain for FirstLayer # Network initialization done # Printing prediction to T0116-1-300.t2k.2d # command:# Network initialization done # Printing prediction in FASTA format to T0116-1-300.t2k.2d.seq # command:# Network initialization done # Printing prediction to T0116-1-300.t2k.2d.rdb # command:rm tmp.script gunzip -f T0116-1-300.t2k.a2m.gz /projects/compbio/usr/karplus/src/phytree/phytree -o -i -r flat T0116-1-300.t2k T0116-1-300.t2k.a2m /projects/compbio/lib/recode2.20comp Prior library /projects/compbio/lib/recode2.20comp read. Reading alignment file T0116-1-300.t2k.a2m (106 sequences) as A2M alignment. Alignment T0116-1-300.t2k.a2m read. Adding sequences:0 10 20 30 40 50 60 70 80 90 100 One dot for every 10 merges: ........... Merges done. CPU = user 0: 2:29 system 0: 0: 0 gzip -f T0116-1-300.t2k.a2m gzip -f T0116-1-300.t2k_sorted.a2m rm T0116-1-300.t2k.phytrace T0116-1-300.t2k.tree_weight prettyalign T0116-1-300.t2k_sorted.a2m.gz -m8 -i -n -L3333 > T0116-1-300.t2k_sorted.pa SAM: prettyalign v3.2 (July 31, 2000) compiled 08/11/00_16:27:51 /projects/compbio/usr/karplus/src/phytree/dg T0116-1-300.t2k.tree /projects/compbio/usr/karplus/src/phytree/dtree T0116-1-300.t2k.tree make[1]: Leaving directory `/export/projects/compbio/experiments/casp4/t116/t116-1-300' echo "WeightingRegularizer /projects/compbio/lib/recode3.20comp" > tmp.script echo "SequenceWeight EntropyWeight 0.5 10.0" >> tmp.script echo "ReadA2M T0116-1-300.t2k.a2m.gz" >> tmp.script echo "SavingsRegularizer /projects/compbio/lib/recode3.20comp" >> tmp.script echo "PrintSavings T0116-1-300.t2k.saves" >> tmp.script echo "exit" >> tmp.script estimate-dist < tmp.script # command:Weighting regularizer set to recode3.20comp # command:Sequence weighting on input set to EntropyWeight(0.5, 10) # command:Reading A2M format from T0116-1-300.t2k.a2m.gz % using regularizer recode3.20comp % T0116-1-300.t2k.a2m.gz with 106 sequences, total weight= 5.44588 avg weight= 0.0513763 After reading T0116-1-300.t2k.a2m.gz, have 300 columns, totalling 1452.48 Using SequenceWeight EntropyWeight(0.5, 10) Using regularizer recode3.20compfor sequence weight regularizer. # command:Savings regularizer set to recode3.20comp # command:% Computing savings using regularizer recode3.20comp Printed 300 columns to T0116-1-300.t2k.saves # command:rm tmp.script if test -e T0116-1-300.t2k-logo.labels ;\ then makelogo -b 60 -t T0116-1-300.t2k -o T0116-1-300.t2k-logo.eps -l T0116-1-300.t2k-logo.labels T0116-1-300.t2k.saves ;\ else makelogo -b 60 -t T0116-1-300.t2k -o T0116-1-300.t2k-logo.eps -lf T0116-1-300.t2k.2d.seq T0116-1-300.t2k.saves ;\ fi /projects/compbio/experiments/models.97/scripts99/score-target -alignment T0116-1-300.t2k.a2m.gz -build w0.5 \ -db /projects/compbio/data/pdb/all-protein \ -Emax 40.0 \ -viterbi 0 -sw_score 2 \ -output T0116-1-300.t2k-w0.5-pdb.rdb PATH=.:/projects/compbio/experiments/models.97/scripts99:/projects/compbio/bin:/projects/compbio/bin/alpha:/projects/compbio/bin/hmmscripts:/projects/compbio/bin/scripts:/sbin:/usr/sbin:/bin:/usr/bin:/usr/local/gnu/bin:/usr/local/share/request/bin:/usr/local/bin @@@@ mkdir /projects/compbio/tmp/score-target-7094 @@@@ mkdir /projects/compbio/tmp/score-target-7094/for-scorescript @@@@ /projects/compbio/experiments/models.97/scripts99/score-mods-vs-seqs.pl -root_tmp /projects/compbio/tmp/score-target-7094/for-scorescript -a2msfile /projects/compbio/tmp/score-target-7094/score-target.a2m \ -buildscript /projects/compbio/bin/scripts/w0.5 -seqfile /projects/compbio/data/pdb/all-protein -Emax 40.0 -viterbi 0 \ -sw_score 2 -output /projects/compbio/tmp/score-target-7094/score-target.op @@@@ chgrp protein /projects/compbio/tmp/score-target-7094/for-scorescript/split-tmp @@@@ chgrp protein /projects/compbio/tmp/score-target-7094/for-scorescript/split-tmp @@@@ /projects/compbio/bin/scripts/w0.5 /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k.a2m.gz /projects/compbio/tmp/score-target-7094/for-scorescript/split-tmp/beta-2671/T0116-1-300.t2k.mod Reading /projects/compbio/bin/scripts/sam-t99.conf @@@@ chgrp protein /projects/compbio/tmp/tmp-build-weighted-model-beta-11539 @@@@ uniqueseq /projects/compbio/tmp/tmp-build-weighted-model-beta-11539/tmp -alignfile /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k.a2m.gz \ -a protein -percent_id 0.8 SAM: uniqueseq v3.2 (July 31, 2000) compiled 07/31/00_14:08:59 Reading alignment file /export/projects/compbio/experiments/casp4/t116/t116-1-300/T0116-1-300.t2k.a2m.gz (106 sequences, 300 columns) as A2M alignment. Writing sequence output to /projects/compbio/tmp/tmp-build-weighted-model-beta-11539/tmp.a2m. Dropping 28 (of 106) duplicate sequences with differing IDs Dropping 33 (of 106) sequences with > 80.0% id 45 sequences left after dropping 61 of 106 sequences. @@@@ modelfromalign /projects/compbio/tmp/tmp-build-weighted-model-beta-11539/tmp -alignfile /projects/compbio/tmp/tmp-build-weighted-model-beta-11539/tmp.a2m \ -insert /projects/compbio/lib/fssp-trained.regularizer \ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -prior_library /projects/compbio/lib/recode3.20comp \ -binary_output 1 -a protein -aweight_method 1 -aweight_bits 0.5 -aweight_exponent 10 Reading parameter file /projects/compbio/lib/fssp-trained.regularizer /projects/compbio/lib/fssp-trained.regularizer(1): Reading REGULARIZER: transitions from FSSP and pseudocounts for diverse weighted HSSP SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file /projects/compbio/tmp/tmp-build-weighted-model-beta-11539/tmp.a2m (45 sequences, 300 columns) as A2M alignment. @@@@ cp -f /projects/compbio/tmp/tmp-build-weighted-model-beta-11539/tmp.mod /projects/compbio/tmp/score-target-7094/for-scorescript/split-tmp/beta-2671/T0116-1-300.t2k.mod @@@@ rm -rf /projects/compbio/tmp/tmp-build-weighted-model-beta-11539 80.0% id 45 sequences left after dropping 61 of 106 sequences. @@@@ modelfromalign /projects/compbio/tmp/tmp-build-weighted-model-beta-31583/tmp -alignfile /projects/compbio/tmp/tmp-build-weighted-model-beta-31583/tmp.a2m \ -insert /projects/compbio/lib/fssp-trained.regularizer \ -ins_jump_conf 1 \ -match_jump_conf 1 \ -del_jump_conf 1 \ -prior_library /projects/compbio/lib/recode3.20comp \ -binary_output 1 -a protein -aweight_method 1 -aweight_bits 0.5 -aweight_exponent 10 Reading parameter file /projects/compbio/lib/fssp-trained.regularizer /projects/compbio/lib/fssp-trained.regularizer(1): Reading REGULARIZER: transitions from FSSP and pseudocounts for diverse weighted HSSP SAM: modelfromalign v3.2 (July 31, 2000) compiled 07/31/00_14:08:27 Reading alignment file /projects/compbio/tmp/tmp-build-weighted-model-beta-31583/tmp.a2m (45 sequences, 300 columns) as A2M alignment. @@@@ cp -f /projects/compbio/tmp/tmp-build-weighted-model-beta-31583/tmp.mod T0116-1-300.t2k-w0.5.mod @@@@ rm -rf /projects/compbio/tmp/tmp-build-weighted-model-beta-31583