==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 03-JAN-11 3Q6T . COMPND 2 MOLECULE: 43.2 KDA SALIVARY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LUTZOMYIA LONGIPALPIS; . AUTHOR J.F.ANDERSEN,X.XU,B.W.CHANG,N.COLLIN,J.G.VALENZUELA,J.M.RIBE . 762 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32820.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 465 61.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 239 31.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 74 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.2 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 1 3 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 RESIDUES PER ALPHA HELIX . 4 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 . 1 3 2 2 22 9 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 . 2 0 11 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 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 A 0 0 87 0, 0.0 2,-0.1 0, 0.0 370,-0.1 0.000 360.0 360.0 360.0 -44.5 70.4 -3.0 40.2 2 2 A D - 0 0 134 368,-0.1 364,-0.6 1,-0.0 2,-0.3 -0.464 360.0-163.6 -64.9 139.7 67.6 -0.5 41.3 3 3 A T E -A 365 0A 54 362,-0.1 2,-0.4 -2,-0.1 362,-0.2 -0.909 18.3-162.2-127.5 153.0 68.2 3.0 40.0 4 4 A Q E +A 364 0A 68 360,-1.8 360,-2.3 -2,-0.3 2,-0.3 -0.977 39.3 101.6-123.9 141.3 66.9 6.5 40.7 5 5 A G E -A 363 0A 15 59,-0.4 2,-0.3 -2,-0.4 358,-0.2 -0.999 55.6 -60.2 175.6-167.1 67.3 9.3 38.2 6 6 A Y E -A 362 0A 0 356,-1.4 356,-2.1 -2,-0.3 2,-0.4 -0.740 24.8-167.4-105.9 152.2 66.3 11.8 35.5 7 7 A K E -A 361 0A 82 63,-2.5 2,-0.5 -2,-0.3 354,-0.2 -0.999 8.8-168.7-132.0 129.0 65.1 11.4 31.9 8 8 A W E -A 360 0A 4 352,-2.9 352,-2.3 -2,-0.4 351,-0.3 -0.954 24.1-175.5-126.9 122.2 64.9 14.2 29.4 9 9 A K S S- 0 0 132 -2,-0.5 2,-0.3 1,-0.3 350,-0.3 0.926 92.9 -1.0 -66.2 -47.5 63.1 14.4 26.0 10 10 A Q S S- 0 0 77 -3,-0.1 2,-1.2 349,-0.1 -1,-0.3 -0.984 78.2-114.9-136.3 157.2 64.7 17.8 25.7 11 11 A L - 0 0 1 12,-0.7 2,-0.3 15,-0.5 15,-0.1 -0.777 40.0-173.4 -91.9 96.7 66.8 19.9 28.0 12 12 A L - 0 0 67 -2,-1.2 62,-2.9 60,-0.2 2,-0.4 -0.681 13.5-137.2 -87.4 143.0 64.6 22.8 28.8 13 13 A Y B > -d 74 0B 10 -2,-0.3 3,-0.5 60,-0.2 2,-0.2 -0.818 10.3-127.0-100.2 142.4 65.9 25.8 30.9 14 14 A N T 3 S+ 0 0 62 60,-3.3 62,-0.2 -2,-0.4 3,-0.1 -0.566 89.0 15.3 -75.1 145.5 64.2 27.6 33.7 15 15 A N T 3 S+ 0 0 142 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.846 93.6 115.2 61.5 37.9 64.0 31.4 33.4 16 16 A V S < S- 0 0 34 -3,-0.5 -1,-0.2 5,-0.0 5,-0.1 -0.979 77.2 -93.9-134.5 141.9 64.8 31.8 29.8 17 17 A T > - 0 0 102 -2,-0.4 3,-2.6 1,-0.1 4,-0.2 -0.372 41.2-113.8 -61.1 120.3 62.2 33.1 27.3 18 18 A P T 3 S+ 0 0 123 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.333 103.9 23.4 -52.0 128.4 60.3 30.3 25.5 19 19 A G T 3 S+ 0 0 75 2,-0.4 -2,-0.1 -3,-0.1 3,-0.0 0.207 90.9 105.4 100.1 -12.9 61.2 30.4 21.8 20 20 A S S < S+ 0 0 51 -3,-2.6 2,-0.3 1,-0.0 -3,-0.1 0.532 90.4 15.9 -77.5 -6.3 64.6 32.1 22.4 21 21 A Y S S- 0 0 23 -4,-0.2 -2,-0.4 -5,-0.1 29,-0.1 -0.956 82.9-107.5-157.6 158.9 66.4 28.8 21.8 22 22 A N > - 0 0 69 27,-0.4 3,-3.0 -2,-0.3 4,-0.4 -0.882 20.6-151.0 -99.4 113.7 65.6 25.4 20.3 23 23 A P G > S+ 0 0 31 0, 0.0 3,-1.2 0, 0.0 -12,-0.7 0.786 95.1 64.3 -55.5 -29.3 65.4 22.8 23.0 24 24 A D G 3 S+ 0 0 93 1,-0.2 -12,-0.0 -14,-0.1 -2,-0.0 0.604 96.8 56.6 -71.1 -12.9 66.5 20.1 20.5 25 25 A N G < S+ 0 0 25 -3,-3.0 2,-1.0 24,-0.1 23,-0.3 0.451 79.7 99.6 -93.6 -4.5 69.9 21.9 20.2 26 26 A M < + 0 0 0 -3,-1.2 -15,-0.5 -4,-0.4 2,-0.5 -0.749 53.6 170.6 -84.6 104.9 70.6 21.6 23.9 27 27 A I - 0 0 3 -2,-1.0 2,-0.4 18,-0.4 20,-0.2 -0.981 18.6-156.9-125.2 119.8 72.8 18.6 24.0 28 28 A S + 0 0 2 -2,-0.5 16,-0.2 16,-0.2 3,-0.1 -0.798 13.2 179.9-107.6 143.8 74.6 17.6 27.2 29 29 A T + 0 0 12 14,-1.5 2,-0.3 -2,-0.4 15,-0.1 0.527 63.3 6.4-120.9 -14.3 77.8 15.6 27.1 30 30 A A E -E 43 0C 0 13,-0.8 13,-2.3 298,-0.1 2,-0.3 -0.979 54.9-164.5-166.4 166.9 78.7 15.2 30.7 31 31 A F E -E 42 0C 1 -2,-0.3 2,-0.2 11,-0.2 11,-0.2 -0.858 8.4-152.9-147.6-179.5 77.7 15.8 34.3 32 32 A A E -E 41 0C 4 9,-1.4 9,-2.5 -2,-0.3 2,-0.5 -0.796 11.3-151.5-163.6 123.9 79.0 15.9 37.9 33 33 A Y E -E 40 0C 18 -2,-0.2 2,-0.9 7,-0.2 300,-0.3 -0.881 3.4-155.1-100.1 125.5 77.0 15.3 41.1 34 34 A D E >> -E 39 0C 2 5,-2.6 4,-1.7 -2,-0.5 5,-1.3 -0.864 10.5-166.8 -95.7 101.3 78.0 17.0 44.3 35 35 A A T 45S+ 0 0 8 -2,-0.9 -1,-0.2 1,-0.2 297,-0.0 0.838 82.2 48.6 -63.5 -37.0 76.5 14.6 46.9 36 36 A E T 45S+ 0 0 105 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.913 119.2 37.7 -67.9 -46.4 76.9 16.9 49.9 37 37 A G T 45S- 0 0 27 2,-0.1 -2,-0.2 24,-0.0 -1,-0.2 0.598 100.8-134.4 -82.2 -14.8 75.4 20.0 48.2 38 38 A E T <5 + 0 0 67 -4,-1.7 22,-2.3 1,-0.2 23,-0.6 0.859 58.1 137.4 58.8 39.5 72.7 17.9 46.4 39 39 A K E < -EF 34 59C 37 -5,-1.3 -5,-2.6 20,-0.2 2,-0.4 -0.915 43.9-151.0-114.5 144.0 73.4 19.7 43.1 40 40 A L E -EF 33 58C 0 18,-2.3 18,-2.0 -2,-0.4 2,-0.5 -0.942 11.1-157.4-110.5 133.0 73.7 18.2 39.7 41 41 A F E -EF 32 57C 0 -9,-2.5 -9,-1.4 -2,-0.4 2,-0.4 -0.965 7.5-167.9-117.4 131.2 76.0 20.0 37.1 42 42 A L E -EF 31 56C 1 14,-2.5 14,-2.2 -2,-0.5 2,-0.5 -0.929 15.8-142.0-117.9 133.3 75.5 19.5 33.4 43 43 A A E +EF 30 55C 0 -13,-2.3 -14,-1.5 -2,-0.4 -13,-0.8 -0.844 19.6 177.0 -89.5 127.7 77.8 20.5 30.6 44 44 A V - 0 0 0 10,-2.2 45,-0.2 -2,-0.5 -16,-0.2 -0.864 24.3-145.5-125.7 90.0 75.8 21.7 27.6 45 45 A P - 0 0 2 0, 0.0 2,-2.5 0, 0.0 3,-0.4 -0.258 20.9-113.5 -61.1 144.7 78.5 22.7 25.1 46 46 A R S S+ 0 0 0 1,-0.2 63,-2.1 61,-0.1 64,-0.2 -0.442 71.4 133.6 -75.8 67.4 77.8 25.7 22.8 47 47 A K + 0 0 34 -2,-2.5 -1,-0.2 -22,-0.2 -21,-0.1 0.678 66.8 31.8 -95.1 -25.1 77.8 23.4 19.9 48 48 A L S > S- 0 0 41 -3,-0.4 3,-0.6 -23,-0.3 -1,-0.1 -0.938 103.3 -71.1-135.1 154.7 74.7 24.8 18.3 49 49 A P T 3 S+ 0 0 10 0, 0.0 -27,-0.4 0, 0.0 65,-0.1 -0.070 102.8 13.4 -50.5 139.4 73.1 28.3 18.3 50 50 A R T 3 + 0 0 105 1,-0.2 -25,-0.1 63,-0.2 -24,-0.1 0.735 62.4 165.7 75.8 33.2 71.5 29.9 21.4 51 51 A V < - 0 0 0 -3,-0.6 -1,-0.2 1,-0.2 3,-0.2 -0.730 22.8-158.3 -75.3 112.7 72.6 27.7 24.3 52 52 A P S S+ 0 0 18 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.921 74.1 14.1 -66.1 -49.0 71.7 30.0 27.3 53 53 A Y - 0 0 39 1,-0.1 3,-0.1 23,-0.0 31,-0.1 -0.995 56.0-166.3-130.8 129.6 74.0 28.4 29.9 54 54 A T S S+ 0 0 3 -2,-0.4 -10,-2.2 29,-0.3 2,-0.5 0.635 90.6 45.5 -89.1 -17.1 76.8 26.1 29.1 55 55 A L E S+F 43 0C 1 -12,-0.2 22,-0.8 31,-0.1 2,-0.3 -0.967 82.2 179.3-121.2 110.4 77.2 25.0 32.7 56 56 A A E -FG 42 76C 0 -14,-2.2 -14,-2.5 -2,-0.5 2,-0.3 -0.846 10.7-155.4-113.2 147.7 73.7 24.4 34.1 57 57 A E E -FG 41 75C 13 18,-2.7 18,-1.9 -2,-0.3 2,-0.4 -0.906 6.9-168.1-121.8 154.2 72.7 23.3 37.6 58 58 A V E -F 40 0C 3 -18,-2.0 -18,-2.3 -2,-0.3 2,-0.7 -0.987 24.0-128.3-137.6 133.5 69.7 21.5 39.1 59 59 A D E -F 39 0C 79 -2,-0.4 -20,-0.2 -20,-0.2 3,-0.2 -0.706 20.8-170.7 -80.4 114.9 68.8 21.0 42.8 60 60 A T >> + 0 0 0 -22,-2.3 4,-2.1 -2,-0.7 3,-2.0 0.591 56.7 98.3 -82.4 -14.8 68.2 17.3 43.3 61 61 A K T 34 S+ 0 0 139 -23,-0.6 -1,-0.2 1,-0.3 3,-0.1 0.890 95.2 22.9 -48.4 -66.4 66.8 17.6 46.9 62 62 A N T 34 S+ 0 0 101 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.050 127.0 56.7 -90.8 33.1 63.0 17.4 46.3 63 63 A S T X4 S+ 0 0 10 -3,-2.0 3,-0.5 7,-0.0 6,-0.2 0.734 75.3 83.6-123.4 -45.1 63.6 15.6 42.9 64 64 A L T 3< S+ 0 0 16 -4,-2.1 -59,-0.4 1,-0.3 -3,-0.1 0.789 105.8 10.5 -55.0 -60.8 65.6 12.5 43.0 65 65 A G T 3 S+ 0 0 49 -61,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.474 98.5 119.0 -98.3 -2.0 63.4 9.5 43.9 66 66 A V X - 0 0 70 -3,-0.5 3,-0.9 3,-0.1 2,-0.1 -0.426 67.1-118.0 -78.3 133.6 60.1 11.3 43.6 67 67 A K T 3 S+ 0 0 199 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 -0.426 97.9 18.3 -64.9 138.4 57.4 10.2 41.1 68 68 A G T 3 S+ 0 0 72 -2,-0.1 3,-0.3 1,-0.1 -1,-0.2 0.071 101.3 90.6 88.3 -23.2 56.6 12.9 38.5 69 69 A K < + 0 0 106 -3,-0.9 -3,-0.1 -6,-0.2 -2,-0.1 -0.205 48.2 120.5 -94.6 40.0 59.8 14.9 39.1 70 70 A H + 0 0 70 1,-0.2 -63,-2.5 -64,-0.1 -1,-0.2 0.642 69.9 46.3 -79.4 -15.9 61.8 13.0 36.4 71 71 A S S S- 0 0 73 -3,-0.3 -1,-0.2 -65,-0.2 2,-0.1 -0.665 72.1-173.2-129.6 77.9 62.6 16.0 34.1 72 72 A P - 0 0 20 0, 0.0 2,-0.2 0, 0.0 -60,-0.2 -0.374 27.8-112.9 -73.3 150.3 64.0 19.0 36.0 73 73 A L - 0 0 74 -62,-0.1 -60,-0.2 1,-0.1 2,-0.2 -0.566 32.4-113.5 -77.9 142.8 64.5 22.3 34.2 74 74 A L B -d 13 0B 0 -62,-2.9 -60,-3.3 -2,-0.2 2,-0.3 -0.507 32.4-160.5 -76.4 141.7 68.1 23.5 33.9 75 75 A N E -G 57 0C 53 -18,-1.9 -18,-2.7 -2,-0.2 3,-0.1 -0.871 28.3 -90.5-118.2 157.6 69.1 26.6 35.8 76 76 A K E -G 56 0C 67 -2,-0.3 2,-0.2 -20,-0.2 -20,-0.2 -0.286 58.6 -87.5 -56.3 147.5 72.0 29.0 35.4 77 77 A F > - 0 0 0 -22,-0.8 3,-2.4 1,-0.2 -1,-0.1 -0.460 32.8-132.9 -60.9 125.8 75.1 28.1 37.4 78 78 A S T 3 S+ 0 0 40 1,-0.3 -1,-0.2 -2,-0.2 -2,-0.1 0.761 106.5 60.5 -55.0 -29.8 74.8 29.7 40.8 79 79 A G T 3 S+ 0 0 23 57,-0.1 2,-0.3 54,-0.0 -1,-0.3 0.263 101.6 72.9 -78.1 13.7 78.3 30.9 40.6 80 80 A H < - 0 0 9 -3,-2.4 54,-0.0 1,-0.1 -4,-0.0 -0.913 50.1-174.1-131.0 154.1 77.3 32.9 37.5 81 81 A K S S+ 0 0 182 -2,-0.3 -1,-0.1 -5,-0.0 -5,-0.1 0.780 89.4 16.5-106.7 -57.7 75.3 36.1 36.6 82 82 A T S S- 0 0 84 -6,-0.0 -2,-0.1 -29,-0.0 -6,-0.0 0.797 91.7-123.2 -89.3 -31.0 75.1 36.4 32.8 83 83 A G S S+ 0 0 4 -6,-0.1 -29,-0.3 -30,-0.1 -28,-0.0 0.746 92.0 95.7 85.2 27.7 76.1 32.9 31.7 84 84 A K + 0 0 97 -31,-0.1 -31,-0.0 -30,-0.0 -4,-0.0 0.334 49.3 94.7-122.5 -6.8 78.9 34.2 29.6 85 85 A E S S+ 0 0 62 1,-0.1 2,-0.4 2,-0.1 -1,-0.0 0.681 95.1 42.6 -59.6 -17.5 81.6 33.7 32.3 86 86 A L - 0 0 1 1,-0.2 -32,-0.3 -31,-0.0 3,-0.1 -0.999 68.3-165.1-130.6 136.5 82.0 30.4 30.4 87 87 A T S S- 0 0 5 -2,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.974 70.6 -22.6 -82.2 -60.2 82.1 30.1 26.6 88 88 A S - 0 0 0 -43,-0.1 17,-3.7 20,-0.1 18,-0.4 -0.916 60.2-174.0-159.4 124.6 81.7 26.3 26.0 89 89 A I E -H 104 0D 0 -2,-0.3 15,-0.2 15,-0.2 -3,-0.0 -0.926 15.2-172.9-126.6 149.9 82.4 23.3 28.2 90 90 A Y E S+ 0 0 28 13,-0.7 -47,-0.2 -2,-0.3 -1,-0.1 0.594 71.5 23.6-109.6 -18.5 82.2 19.6 27.6 91 91 A Q E - 0 0 24 12,-0.2 12,-0.6 -49,-0.1 2,-0.4 -0.928 53.8-155.8-159.8 123.6 82.8 18.1 31.0 92 92 A P E -H 102 0D 1 0, 0.0 2,-0.4 0, 0.0 10,-0.2 -0.858 16.1-172.2-104.0 140.8 82.5 18.9 34.7 93 93 A V E -H 101 0D 30 8,-2.5 8,-3.4 -2,-0.4 2,-0.6 -0.991 14.2-151.3-131.7 134.0 84.5 17.2 37.4 94 94 A I E -H 100 0D 39 -2,-0.4 6,-0.2 6,-0.2 65,-0.1 -0.908 20.8-150.8-104.0 120.0 84.3 17.4 41.2 95 95 A D > - 0 0 8 4,-2.0 3,-1.6 -2,-0.6 65,-0.1 -0.039 36.2 -84.7 -78.3-178.7 87.6 16.8 43.1 96 96 A D T 3 S+ 0 0 87 63,-0.3 -1,-0.1 1,-0.3 64,-0.0 0.691 128.1 46.8 -65.5 -14.8 88.4 15.3 46.6 97 97 A C T 3 S- 0 0 16 2,-0.1 -1,-0.3 71,-0.1 34,-0.2 0.021 121.0 -99.2-118.0 29.0 87.8 18.7 48.2 98 98 A R S < S+ 0 0 51 -3,-1.6 32,-1.8 1,-0.2 2,-0.5 0.776 70.9 145.9 61.1 33.4 84.5 19.8 46.4 99 99 A R E - 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