Provided by: hhsuite_3.3.0+ds-8_amd64
NAME
hhalign - align a query alignment/HMM to a template alignment/HMM
SYNOPSIS
hhalign -i query -t template [options]
DESCRIPTION
HHalign 3.3.0 Align a query alignment/HMM to a template alignment/HMM by HMM-HMM alignment If only one alignment/HMM is given it is compared to itself and the best off-diagonal alignment plus all further non-overlapping alignments above significance threshold are shown. Steinegger M, Meier M, Mirdita M, V??hringer H, Haunsberger S J, and S??ding J (2019) HH-suite3 for fast remote homology detection and deep protein annotation. BMC Bioinformatics, doi:10.1186/s12859-019-3019-7 (c) The HH-suite development team -i <file> input/query: single sequence or multiple sequence alignment (MSA) in a3m, a2m, or FASTA format, or HMM in hhm format -t <file> input/template: single sequence or multiple sequence alignment (MSA) in a3m, a2m, or FASTA format, or HMM in hhm format <file> may be 'stdin' or 'stdout' throughout. Input alignment format: -M a2m use A2M/A3M (default): upper case = Match; lower case = Insert; '-' = Delete; '.' = gaps aligned to inserts (may be omitted) -M first use FASTA: columns with residue in 1st sequence are match states -M [0,100] use FASTA: columns with fewer than X% gaps are match states -tags/-notags do NOT / do neutralize His-, C-myc-, FLAG-tags, and trypsin recognition sequence to background distribution (def=-notags) Output options: -o <file> write results in standard format to file (default=<infile.hhr>) -oa3m <file> write query alignment in a3m or PSI-BLAST format (-opsi) to file (default=none) -aa3m <file> append query alignment in a3m (-aa3m) or PSI-BLAST format (-apsi )to file (default=none) -Ofas <file> write pairwise alignments in FASTA xor A2M (-Oa2m) xor A3M (-Oa3m) format -add_cons generate consensus sequence as master sequence of query MSA (default=don't) -hide_cons don't show consensus sequence in alignments (default=show) -hide_pred don't show predicted 2ndary structure in alignments (default=show) -hide_dssp don't show DSSP 2ndary structure in alignments (default=show) -show_ssconf show confidences for predicted 2ndary structure in alignments -seq <int> max. number of query/template sequences displayed (default=1) -aliw <int> number of columns per line in alignment list (default=80) -p [0,100] minimum probability in summary and alignment list (default=0) -E [0,inf[ maximum E-value in summary and alignment list (default=1E+06) -Z <int> maximum number of lines in summary hit list (default=100) -z <int> minimum number of lines in summary hit list (default=1) -B <int> maximum number of alignments in alignment list (default=100) -b <int> minimum number of alignments in alignment list (default=1) Filter options applied to query MSA, template MSA, and result MSA -id [0,100] maximum pairwise sequence identity (def=90) -diff [0,inf[ filter MSAs by selecting most diverse set of sequences, keeping at least this many seqs in each MSA block of length 50 Zero and non-numerical values turn off the filtering. (def=100) -cov [0,100] minimum coverage with master sequence (%) (def=0) -qid [0,100] minimum sequence identity with master sequence (%) (def=0) -qsc [0,100] minimum score per column with master sequence (default=-20.0) -mark do not filter out sequences marked by ">@"in their name line HMM-HMM alignment options: -norealign do NOT realign displayed hits with MAC algorithm (def=realign) -mact [0,1[ posterior prob threshold for MAC realignment controlling greediness at alignment ends: 0:global >0.1:local (default=0.35) -glob/-loc use global/local alignment mode for searching/ranking (def=local) -realign realign displayed hits with max. accuracy (MAC) algorithm -excl <range> exclude query positions from the alignment, e.g. '1-33,97-168' -template_excl <range> exclude template positions from the alignment, e.g. '1-33,97-168' -ovlp <int> banded alignment: forbid <ovlp> largest diagonals |i-j| of DP matrix (def=0) -alt <int> show up to this many alternative alignments with raw score > smin(def=1) -smin <float> minimum raw score for alternative alignments (def=20.0) -shift [-1,1] profile-profile score offset (def=-0.03) -corr [0,1] weight of term for pair correlations (def=0.10) -sc <int> amino acid score (tja: template HMM at column j) (def=1) 0 = log2 Sum(tja*qia/pa) (pa: aa background frequencies) 1 = log2 Sum(tja*qia/pqa) (pqa = 1/2*(pa+ta) ) 2 = log2 Sum(tja*qia/ta) (ta: av. aa freqs in template) 3 = log2 Sum(tja*qia/qa) (qa: av. aa freqs in query) 5 local amino acid composition correction -ssm {0,..,4} secondary structure scoring [default=2] 0: = no ss scoring 1,2: = ss scoring after or during alignment 3,4: = ss scoring after or during alignment, predicted vs. predicted -ssw [0,1] weight of ss score (def=0.11) -ssa [0,1] ss confusion matrix = (1-ssa)*I + ssa*psipred-confusion-matrix [def=1.00) -wg use global sequence weighting for realignment! Gap cost options: -gapb [0,inf[ Transition pseudocount admixture (def=1.00) -gapd [0,inf[ Transition pseudocount admixture for open gap (default=0.15) -gapd [0,inf[ Transition pseudocount admixture for open gap (default=0.15) -gape [0,1.5] Transition pseudocount admixture for extend gap (def=1.00) -gapf ]0,inf] factor to increase/reduce the gap open penalty for deletes (def=0.60) -gapg ]0,inf] factor to increase/reduce the gap open penalty for inserts (def=0.60) -gaph ]0,inf] factor to increase/reduce the gap extend penalty for deletes(def=0.60) -gapi ]0,inf] factor to increase/reduce the gap extend penalty for inserts(def=0.60) -egq [0,inf[ penalty (bits) for end gaps aligned to query residues (def=0.00) -egt [0,inf[ penalty (bits) for end gaps aligned to template residues (def=0.00) Pseudocount (pc) options: Context specific hhm pseudocounts: -pc_hhm_contxt_mode {0,..,3} position dependence of pc admixture 'tau' (pc mode, default=2) 0: no pseudo counts: tau = 0 1: constant tau = a 2: diversity-dependent: tau = a/(1+((Neff[i]-1)/b)^c) 3: CSBlast admixture: tau = a(1+b)/(Neff[i]+b) (Neff[i]: number of effective seqs in local MSA around column i) -pc_hhm_contxt_a [0,1] overall pseudocount admixture (def=0.9) -pc_hhm_contxt_b [1,inf[ Neff threshold value for mode 2 (def=4.0) -pc_hhm_contxt_c [0,3] extinction exponent c for mode 2 (def=1.0) Context independent hhm pseudocounts (used for templates; used for query if contxt file is not available): -pc_hhm_nocontxt_mode {0,..,3} position dependence of pc admixture 'tau' (pc mode, default=2) 0: no pseudo counts: tau = 0 1: constant tau = a 2: diversity-dependent: tau = a/(1+((Neff[i]-1)/b)^c) (Neff[i]: number of effective seqs in local MSA around column i) -pc_hhm_nocontxt_a [0,1] overall pseudocount admixture (def=1.0) -pc_hhm_nocontxt_b [1,inf[ Neff threshold value for mode 2 (def=1.5) -pc_hhm_nocontxt_c [0,3] extinction exponent c for mode 2 (def=1.0) Context-specific pseudo-counts: -nocontxt use substitution-matrix instead of context-specific pseudocounts -contxt <file> context file for computing context-specific pseudocounts (default=) -csw [0,inf] weight of central position in cs pseudocount mode (def=1.6) -csb [0,1] weight decay parameter for positions in cs pc mode (def=0.9) Other options: -v <int> verbose mode: 0:no screen output 1:only warings 2: verbose (def=2) -atab <file> write all alignments in tabular layout to file -maxseq <int> max number of input rows (def=65535) -maxres <int> max number of HMM columns (def=20001) -maxmem [1,inf[ limit memory for realignment (in GB) (def=3.0) Example: hhalign -i T0187.a3m -t d1hz4a_.hhm -o result.hhr