column Header Description filename MS/MS spectrum identifier (runName.firstScanNum.lastScanNum.parentCharge) when firstScanNum and lastScanNum are different, multiple MS/MS spectra have been merged that were acquired nearby in chromatographic time parent_charge Charge of precursor ion score Spectrum Mill identification score deltaForwardReverseScore The difference between Spectrum Mill identification score of the best target peptide (forward peptide sequence) and decoy peptide (reversed peptide sequence). A value less than or equal to zero indicates a likely false-positive identification. deltaRank1Rank2Score The difference between Spectrum Mill identification score of the rank1 and rank2 target peptides (forward peptide sequence). percent_scored_peak_intensity Percent of product ion intensity (after peak detection) that is matched to a scored ion type totalIntensity Chromatographic peak are of precursor ion and its isotopes variableSites The amino acid position in the protein sequence from accession_number of a modified amino acid indicated in lowercase. nterm Name of modification at peptide N-terminus (ex: iTRAQ, Acetyl,Hydrogen) StartAA The amino acid position in the protein sequence of the first amino acid in the peptide previous_aa Amino acid preceding the sequence in accession_number , (-) indicates N-terminus of protein sequence Peptide sequence -lower case indicates variable modification next_aa Amino acid following the sequence in accession_number , (-) indicates C-terminus of protein modifications Amino acid modified: name of modification (Ex: K:iTRAQ, K:iTRAQ-Lys-Only, C:Carbamidomethylation, c:Pyro Carbamidomethyl Cys, q:Pyroglutamic acid, m:Oxidized methionine, n:Deamidated) iTRAQ_114_117 Ratio iTRAQ_114 intensity / iTRAQ_117 intensity, not log2, not normalized, not isotope corrected iTRAQ_115_117 Ratio iTRAQ_115 intensity / iTRAQ_117 intensity, not log2, not normalized, not isotope corrected iTRAQ_116_117 Ratio iTRAQ_115 intensity / iTRAQ_117 intensity, not log2, not normalized, not isotope corrected iTRAQ_114 iTRAQ_114 intensity, not normalized, not isotope corrected iTRAQ_115 iTRAQ_115 intensity, not normalized, not isotope corrected iTRAQ_116 iTRAQ_116 intensity, not normalized, not isotope corrected iTRAQ_117 iTRAQ_117 intensity, not normalized, not isotope corrected precursorAveragineChiSquared 1-Chi2 measure of the precursor ion isotope cluster shape (combined from the 2 MS1 scans immediately before and after the MS2 scan) as compared to the theoretical isotpe cluster shape of averagine. (0.85 to 1.0 is good) precursorIsolationPurityPercent The intensity of the precursor ion and its isotopes divided by the total peak inensity in the precursor isolation window used for the MS2 scan (combined from the 2 MS1 scans immediately before and after the MS2 scan), <50% means reporter quantitation was not used because of expected contamination by co-fragmented peptides. precursorIsolationIntensity The denominator used in the precursorIsolationPurity metric ratioReporterIonToPrecursor Sum of the reporter ion intensities (iTRAQ_114+iTRAQ_115+iTRAQ_116+iTRAQ_117) divided by precursorIsolationIntensity retentionTimeMin Time from the start of the LC gradient to the chromatographic apex of the precursor ion chromatographicPeakWidthSec Width of precursor ion chromatographic peak, 0 means no more than 1 MS 1 scan had a satisfactory precursor isotope cluster shape parent_m_over_z measured precursor m/z matched_parent_mass calculated mass of peptide MH+ in database before accounting for variable modifications delta_parent_mass Difference in measured parent mass (Da) of identified peptide and calculated mass of peptide in database before accounting for variable modifications. +16 is consistent with oxidation. delta_parent_mass_ppm Difference in measured parent mass (Da) of identified peptide and calculated mass of peptide in database after accounting for variable modifications. protein_mw Calculated protein MW (Da) of the protein sequence belonging to accession_number species species parsed form FASTA file by SM (Ex: HOMO SAPIENS, MUS MUSCULUS, PIG, BOVIN, SHEEP) accession_number RefSeq protein ID, UniProt ID for appended labaoratory contaminants accession_numbers All accession numbers in the searched database containing sequence geneSymbol NCBI Entrez gene symbol entry_name Protein name from FASTA sequence database searched