==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEINASE INHIBITOR 11-OCT-95 1OMU . COMPND 2 MOLECULE: OVOMUCOID (THIRD DOMAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: MELEAGRIS GALLOPAVO; . AUTHOR C.G.HOOGSTRATEN,S.CHOE,W.M.WESTLER,J.L.MARKLEY . 56 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3878.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 31 55.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 8 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A L 0 0 219 0, 0.0 2,-0.3 0, 0.0 51,-0.1 0.000 360.0 360.0 360.0 88.2 1.4 15.6 7.3 2 2 A A - 0 0 88 49,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.924 360.0 -80.8-173.2-162.7 3.4 15.4 4.0 3 3 A A + 0 0 99 -2,-0.3 2,-1.1 2,-0.0 48,-0.1 -0.179 64.9 142.6-115.6 41.6 3.6 13.7 0.6 4 4 A V + 0 0 91 47,-0.2 2,-0.3 46,-0.0 -2,-0.1 -0.683 23.3 152.2 -84.7 101.1 5.2 10.4 1.6 5 5 A S - 0 0 74 -2,-1.1 2,-0.1 44,-0.1 -2,-0.0 -0.940 40.9-120.7-129.8 153.2 3.5 7.8 -0.5 6 6 A V - 0 0 36 -2,-0.3 2,-0.4 1,-0.0 44,-0.1 -0.416 27.1-119.9 -85.8 166.8 4.6 4.4 -1.9 7 7 A D + 0 0 110 -2,-0.1 3,-0.1 1,-0.1 31,-0.1 -0.888 28.4 173.9-110.5 138.2 4.8 3.6 -5.6 8 8 A a > + 0 0 14 -2,-0.4 3,-1.1 1,-0.1 -1,-0.1 -0.257 30.9 132.9-135.2 49.4 2.8 0.8 -7.2 9 9 A S T 3 S+ 0 0 96 1,-0.2 -1,-0.1 33,-0.0 -2,-0.0 0.382 77.5 53.5 -82.1 9.0 3.4 1.1 -11.0 10 10 A E T 3 S+ 0 0 113 -3,-0.1 -1,-0.2 3,-0.0 -2,-0.0 0.080 98.4 156.7-126.5 21.2 4.1 -2.7 -11.1 11 11 A Y < + 0 0 27 -3,-1.1 2,-0.1 27,-0.1 28,-0.1 -0.629 26.8 45.5-105.5 166.6 0.8 -3.8 -9.4 12 12 A P - 0 0 80 0, 0.0 24,-0.1 0, 0.0 27,-0.1 0.563 63.4-175.9 -90.0 160.6 -1.2 -5.7 -8.9 13 13 A K - 0 0 88 22,-0.1 -2,-0.1 -2,-0.1 26,-0.0 -0.904 32.1-133.3-117.4 146.2 0.8 -8.8 -8.1 14 14 A P S S+ 0 0 145 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.235 94.0 57.5 -78.4 14.1 -0.5 -12.3 -7.4 15 15 A A - 0 0 68 1,-0.1 -2,-0.1 20,-0.0 3,-0.0 -0.957 52.4-176.5-147.8 126.0 1.9 -12.6 -4.5 16 16 A b > - 0 0 29 -2,-0.3 2,-1.2 1,-0.1 3,-0.5 0.619 35.5-137.1 -96.7 -13.1 2.1 -10.3 -1.4 17 17 A T T 3 - 0 0 91 1,-0.2 -1,-0.1 18,-0.1 0, 0.0 -0.268 36.4-107.6 86.7 -48.1 5.2 -12.1 0.1 18 18 A L T 3 S+ 0 0 158 -2,-1.2 -1,-0.2 -3,-0.0 -2,-0.0 0.431 70.7 139.0 105.4 4.5 3.6 -11.9 3.6 19 19 A E < - 0 0 119 -3,-0.5 2,-0.2 1,-0.1 -1,-0.0 0.220 54.5-116.8 -59.7-159.9 5.8 -9.3 5.3 20 20 A Y + 0 0 144 2,-0.0 13,-0.3 13,-0.0 12,-0.1 -0.558 49.9 146.3-148.1 83.2 4.0 -6.7 7.5 21 21 A R - 0 0 144 11,-0.3 2,-1.1 -2,-0.2 16,-0.2 -0.780 33.3-156.6-119.0 85.8 4.2 -3.1 6.4 22 22 A P - 0 0 19 0, 0.0 32,-1.5 0, 0.0 2,-0.6 -0.460 13.3-174.9 -65.6 96.7 0.8 -1.6 7.5 23 23 A L E -AB 31 53A 6 8,-1.6 8,-1.3 -2,-1.1 2,-0.7 -0.829 16.5-143.2 -97.4 123.2 0.4 1.4 5.2 24 24 A c E -AB 30 52A 0 28,-1.7 27,-2.2 -2,-0.6 28,-1.1 -0.750 15.9-132.1 -89.6 116.0 -2.7 3.4 6.1 25 25 A G E > - B 0 50A 0 4,-2.2 3,-1.0 -2,-0.7 26,-0.8 0.099 34.6 -96.6 -49.5 179.7 -4.3 4.8 3.0 26 26 A S T 3 S+ 0 0 54 23,-2.0 24,-0.2 22,-0.8 -1,-0.2 0.520 128.1 57.0 -81.4 0.9 -5.2 8.5 3.1 27 27 A D T 3 S- 0 0 80 22,-0.4 -1,-0.2 2,-0.1 -2,-0.1 0.429 125.7 -98.4-107.1 -1.1 -8.7 7.3 4.1 28 28 A N S < S+ 0 0 104 -3,-1.0 2,-0.6 1,-0.2 -2,-0.1 0.855 72.4 146.1 88.1 40.4 -7.5 5.3 7.2 29 29 A K - 0 0 111 27,-0.1 -4,-2.2 26,-0.0 2,-0.4 -0.914 40.4-142.9-111.8 113.3 -7.4 1.8 5.6 30 30 A T E -A 24 0A 64 -2,-0.6 2,-0.5 -6,-0.2 -6,-0.2 -0.599 13.8-166.7 -78.0 127.9 -4.6 -0.4 7.0 31 31 A Y E -A 23 0A 59 -8,-1.3 -8,-1.6 -2,-0.4 6,-0.2 -0.951 25.9-127.7-114.6 123.1 -3.0 -2.7 4.4 32 32 A G S S- 0 0 24 -2,-0.5 -11,-0.3 -10,-0.2 2,-0.2 0.877 81.0 -19.1 -35.8 -58.0 -0.8 -5.4 5.7 33 33 A N S > S- 0 0 3 -13,-0.3 4,-2.3 -11,-0.1 5,-0.3 -0.723 85.0 -70.3-141.1-168.6 2.2 -4.5 3.5 34 34 A K H > S+ 0 0 75 -2,-0.2 4,-1.7 2,-0.2 5,-0.1 0.884 126.9 46.9 -57.1 -43.4 3.2 -2.6 0.4 35 35 A b H > S+ 0 0 4 -19,-0.3 4,-2.2 2,-0.2 5,-0.2 0.960 111.6 49.2 -69.3 -47.1 1.6 -5.0 -2.0 36 36 A N H > S+ 0 0 68 1,-0.2 4,-0.7 2,-0.2 -2,-0.2 0.910 118.3 42.4 -57.3 -37.3 -1.7 -5.2 -0.1 37 37 A F H X S+ 0 0 2 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.781 113.2 53.0 -77.4 -27.9 -1.7 -1.4 -0.1 38 38 A a H X S+ 0 0 0 -4,-1.7 4,-1.8 -5,-0.3 -2,-0.2 0.759 100.3 60.3 -80.4 -23.7 -0.5 -1.3 -3.7 39 39 A N H X S+ 0 0 46 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.809 106.5 48.7 -74.4 -24.9 -3.4 -3.6 -4.8 40 40 A A H < S+ 0 0 13 -4,-0.7 6,-0.4 -5,-0.2 7,-0.2 0.896 108.9 51.8 -79.4 -39.6 -5.8 -0.9 -3.5 41 41 A V H <>S+ 0 0 32 -4,-1.5 5,-1.3 1,-0.2 3,-0.5 0.886 114.3 44.6 -63.0 -36.3 -3.9 1.9 -5.3 42 42 A V H ><5S+ 0 0 41 -4,-1.8 3,-0.6 1,-0.2 -1,-0.2 0.890 117.6 42.3 -76.6 -39.1 -4.1 -0.2 -8.5 43 43 A E T 3<5S+ 0 0 156 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.262 116.3 51.9 -90.7 14.9 -7.8 -1.1 -8.1 44 44 A S T > 5S- 0 0 34 -3,-0.5 3,-1.6 -4,-0.2 -1,-0.2 0.320 108.2-115.7-128.6 4.1 -8.6 2.5 -7.0 45 45 A N T < 5S- 0 0 158 -3,-0.6 -3,-0.2 1,-0.3 -4,-0.1 0.681 73.4 -65.4 68.8 12.0 -7.0 4.5 -9.8 46 46 A G T 3