==== 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 METAL BINDING PROTEIN 09-APR-03 1OZO . COMPND 2 MOLECULE: S-100P PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.-C.LEE,D.E.VOLK,V.THIVIYANATHAN,Q.KLEEREKOPER, . 190 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 136 71.6 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 . 7 3.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 11 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 37.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.6 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 3 0 0 1 0 0 0 1 0 0 0 3 1 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 . 2 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 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 M 0 0 79 0, 0.0 136,-0.1 0, 0.0 181,-0.1 0.000 360.0 360.0 360.0 70.5 48.4 61.1 29.8 2 2 A T > - 0 0 28 134,-0.2 4,-2.3 4,-0.0 5,-0.2 -0.004 360.0 -70.6 -69.3-170.0 51.9 60.2 28.4 3 3 A E H > S+ 0 0 75 132,-0.2 4,-2.3 2,-0.2 3,-0.2 0.961 138.1 37.7 -55.0 -57.7 52.9 56.6 27.3 4 4 A L H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.955 119.2 49.7 -58.0 -47.8 53.0 55.1 30.8 5 5 A E H > S+ 0 0 15 131,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.775 110.9 50.1 -64.5 -29.4 50.0 57.3 31.9 6 6 A A H X S+ 0 0 22 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.852 106.7 53.6 -77.1 -41.6 48.0 56.1 28.7 7 7 A A H X S+ 0 0 0 -4,-2.3 4,-1.2 2,-0.2 3,-0.4 0.960 113.2 43.6 -55.3 -50.8 48.7 52.4 29.4 8 8 A M H >X S+ 0 0 2 -4,-2.4 4,-3.3 1,-0.2 3,-0.5 0.904 106.8 62.5 -59.7 -38.4 47.3 53.0 32.9 9 9 A G H 3X S+ 0 0 2 -4,-1.6 4,-1.7 1,-0.2 -2,-0.2 0.883 106.2 44.2 -45.4 -46.7 44.6 55.0 31.0 10 10 A M H 3X S+ 0 0 69 -4,-2.0 4,-3.0 -3,-0.4 -1,-0.2 0.669 112.6 51.4 -76.3 -19.9 43.7 51.6 29.3 11 11 A I H X S+ 0 0 1 -4,-3.0 4,-2.1 1,-0.2 3,-1.7 0.922 112.9 47.7 -45.6 -52.9 39.6 47.9 31.4 15 15 A F H 3X>S+ 0 0 4 -4,-3.0 4,-2.4 1,-0.3 5,-0.8 0.905 109.6 53.0 -55.3 -42.7 38.3 48.6 34.9 16 16 A S H 3<5S+ 0 0 37 -4,-2.2 -1,-0.3 3,-0.2 -2,-0.2 0.495 110.1 49.8 -71.5 -6.1 35.7 51.0 33.3 17 17 A R H <<5S+ 0 0 90 -3,-1.7 -2,-0.2 -4,-0.7 -1,-0.2 0.795 122.2 29.6 -91.3 -41.0 34.7 48.0 30.9 18 18 A Y H <5S+ 0 0 46 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.909 130.3 36.1 -97.3 -46.0 34.3 45.4 33.7 19 19 A S T <5S- 0 0 4 -4,-2.4 2,-0.3 -5,-0.3 -3,-0.2 0.731 101.5-165.4 -66.1 -20.6 33.2 47.5 36.6 20 20 A G < - 0 0 34 -5,-0.8 -4,-0.2 -6,-0.3 -1,-0.1 0.211 63.3 -51.2 73.2 -12.4 31.6 49.1 33.5 21 21 A S S S- 0 0 94 -2,-0.3 2,-0.3 -6,-0.3 -1,-0.3 -0.673 133.2 -1.7 131.3 -66.0 30.8 52.5 35.3 22 22 A E + 0 0 108 4,-0.1 4,-0.3 -6,-0.1 6,-0.1 -0.970 61.4 153.6-141.0 149.9 29.1 50.6 38.1 23 23 A G S S- 0 0 44 2,-2.7 6,-0.2 -2,-0.3 3,-0.1 0.092 95.3 -1.1-153.8 20.3 28.5 46.8 38.6 24 24 A S S S- 0 0 44 1,-0.7 2,-0.3 -5,-0.1 4,-0.1 0.255 139.8 -46.6 179.6 -20.9 28.3 46.5 42.4 25 25 A T S S- 0 0 67 -6,-0.1 -2,-2.7 2,-0.1 2,-1.6 -0.532 108.5 -47.3 95.2 173.0 28.8 50.0 43.2 26 26 A Q S S+ 0 0 102 -2,-0.3 45,-0.5 -4,-0.3 2,-0.3 -0.426 116.6 88.6 -88.5 65.2 31.9 51.2 41.1 27 27 A T E S-A 70 0A 10 -2,-1.6 2,-0.9 43,-0.2 43,-0.3 -0.970 82.8-103.5-143.1 159.5 34.1 48.2 41.9 28 28 A L E -A 69 0A 0 41,-2.8 41,-2.5 -2,-0.3 2,-0.2 -0.829 35.1-160.3 -79.3 109.4 34.9 44.6 40.8 29 29 A T E >> -A 68 0A 47 -2,-0.9 4,-2.5 39,-0.3 3,-1.8 -0.594 38.2-101.6 -65.6 156.8 33.1 42.3 43.2 30 30 A K H 3> S+ 0 0 54 37,-0.7 4,-1.0 1,-0.3 21,-0.1 0.815 126.0 56.0 -43.4 -40.1 34.7 38.8 43.1 31 31 A G H 34 S+ 0 0 41 2,-0.2 -1,-0.3 1,-0.1 4,-0.2 0.669 112.9 39.1 -76.7 -18.6 31.7 37.7 40.9 32 32 A E H X> S+ 0 0 41 -3,-1.8 3,-2.5 2,-0.1 4,-0.7 0.898 106.1 65.2 -86.5 -55.6 32.5 40.5 38.3 33 33 A L H 3X S+ 0 0 3 -4,-2.5 4,-1.3 1,-0.3 3,-0.3 0.684 92.5 65.1 -35.7 -39.8 36.3 40.2 38.4 34 34 A K H 3X S+ 0 0 79 -4,-1.0 4,-1.0 -5,-0.2 -1,-0.3 0.826 95.7 53.4 -58.5 -38.0 36.1 36.6 36.9 35 35 A V H <4 S+ 0 0 49 -3,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.824 110.3 49.2 -77.4 -28.2 34.7 37.6 33.5 36 36 A L H >X>S+ 0 0 0 -4,-0.7 4,-3.1 -3,-0.3 3,-1.3 0.792 101.5 66.7 -61.7 -42.2 37.6 40.1 33.0 37 37 A M H 3X5S+ 0 0 1 -4,-1.3 4,-2.1 1,-0.3 -2,-0.2 0.888 93.3 53.1 -62.6 -47.6 40.2 37.4 34.0 38 38 A E H 3<5S+ 0 0 89 -4,-1.0 -1,-0.3 1,-0.2 -2,-0.1 0.603 122.9 32.9 -59.7 -16.5 39.9 35.0 31.0 39 39 A K H <45S+ 0 0 97 -3,-1.3 60,-0.5 -4,-0.1 -2,-0.2 0.815 134.2 19.5-108.3 -57.9 40.4 38.0 28.7 40 40 A E H <5S+ 0 0 13 -4,-3.1 61,-0.4 1,-0.2 60,-0.3 0.536 125.1 48.0-107.0 -9.3 42.8 40.5 30.4 41 41 A L ><< + 0 0 4 -4,-2.1 3,-1.2 -5,-0.5 4,-0.3 -0.162 66.4 165.3-129.5 42.6 44.5 38.2 33.1 42 42 A P T 3 + 0 0 41 0, 0.0 2,-0.4 0, 0.0 -4,-0.1 -0.175 69.1 35.9 -39.9 144.5 45.6 34.9 31.4 43 43 A G T > S+ 0 0 39 1,-0.1 3,-0.9 -5,-0.0 5,-0.1 -0.239 101.5 74.9 88.3 -37.2 48.1 32.9 33.5 44 44 A F G X S+ 0 0 33 -3,-1.2 3,-0.6 -2,-0.4 4,-0.3 0.573 79.1 82.9 -70.6 -6.8 46.3 33.9 36.7 45 45 A L G 3 + 0 0 53 -4,-0.3 -1,-0.2 1,-0.2 9,-0.0 0.207 48.4 114.7 -80.5 10.0 43.9 31.3 35.3 46 46 A Q G < S+ 0 0 184 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.832 98.5 24.2 -53.1 -32.4 45.9 28.4 36.8 47 47 A S S < S- 0 0 65 -3,-0.6 2,-0.5 2,-0.0 3,-0.4 0.612 101.9-146.4 -95.8 -27.6 42.8 27.8 38.9 48 48 A G - 0 0 21 -4,-0.3 -10,-0.1 1,-0.2 -3,-0.1 -0.055 61.7 -52.7 86.8 -31.2 40.5 29.5 36.3 49 49 A K S >>>S+ 0 0 73 -2,-0.5 5,-1.4 -12,-0.1 3,-1.1 -0.151 71.8 152.7 179.8 -57.7 38.1 31.0 38.9 50 50 A D T 345S- 0 0 104 -3,-0.4 -2,-0.1 1,-0.3 0, 0.0 0.322 83.4 -84.9 -7.1 44.7 36.6 28.5 41.5 51 51 A K T 345S+ 0 0 133 -2,-0.4 -1,-0.3 -21,-0.1 -20,-0.0 0.615 123.1 84.6 54.9 17.6 36.2 31.2 44.2 52 52 A D T <45S+ 0 0 58 -3,-1.1 -2,-0.2 3,-0.1 -1,-0.1 0.737 100.4 14.5-116.7 -39.4 39.9 30.4 45.1 53 53 A A T >X5S+ 0 0 14 -4,-1.0 4,-2.8 2,-0.2 3,-0.8 0.673 122.2 58.1-121.6 -31.8 42.1 32.5 42.7 54 54 A V T 34 S+ 0 0 29 -6,-0.5 4,-3.2 2,-0.2 -1,-0.2 0.694 106.5 46.0 -64.8 -26.4 39.6 35.4 45.2 56 56 A K H <> S+ 0 0 97 -3,-0.8 4,-2.0 2,-0.3 5,-0.3 0.849 105.7 56.0 -93.9 -32.8 43.4 36.1 45.1 57 57 A L H < S+ 0 0 20 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.525 120.6 37.9 -68.1 -5.7 43.1 38.6 42.2 58 58 A L H >> S+ 0 0 2 -5,-0.2 4,-2.7 3,-0.1 3,-1.7 0.778 112.9 51.4 -93.5 -73.3 40.7 40.1 44.8 59 59 A K H 3X S+ 0 0 96 -4,-3.2 4,-0.6 1,-0.3 -3,-0.2 0.634 106.1 56.7 -45.6 -34.9 42.4 39.5 48.2 60 60 A D H 3< S+ 0 0 85 -4,-2.0 -1,-0.3 2,-0.1 3,-0.2 0.934 124.4 22.3 -56.3 -52.6 45.7 41.1 47.1 61 61 A L H X4 S+ 0 0 6 -3,-1.7 3,-3.0 -5,-0.3 -2,-0.2 0.888 106.1 81.1 -88.4 -44.0 44.0 44.4 46.1 62 62 A D H >< S+ 0 0 14 -4,-2.7 3,-2.1 1,-0.3 6,-0.2 0.623 74.3 79.4 -29.3 -33.7 40.9 44.0 48.4 63 63 A A T 3< S+ 0 0 90 -4,-0.6 -1,-0.3 1,-0.3 -2,-0.1 0.708 88.3 56.3 -50.9 -27.8 43.1 45.3 51.2 64 64 A N T < S+ 0 0 90 -3,-3.0 -1,-0.3 6,-0.1 -2,-0.2 0.513 131.5 1.3 -87.0 -6.9 42.5 48.8 49.8 65 65 A G S < S- 0 0 46 -3,-2.1 4,-0.1 -4,-0.2 -2,-0.1 0.294 99.0 -90.4-138.3 -92.5 38.6 48.3 50.1 66 66 A D S S- 0 0 99 2,-0.1 3,-0.1 0, 0.0 -4,-0.1 0.310 83.5 -49.2-159.6 -38.8 36.9 45.2 51.5 67 67 A A S S+ 0 0 32 -39,-0.1 -37,-0.7 -9,-0.1 2,-0.7 0.037 119.6 89.7 153.9 -8.5 36.3 42.6 48.7 68 68 A Q E S-A 29 0A 64 -39,-0.2 2,-0.6 -6,-0.2 -39,-0.3 -0.902 80.0-143.6-103.6 94.0 34.6 45.0 46.3 69 69 A V E -A 28 0A 0 -41,-2.5 -41,-2.8 -2,-0.7 -7,-0.1 -0.512 11.7-152.3 -68.9 105.0 37.8 46.2 44.5 70 70 A D E > -A 27 0A 35 -2,-0.6 4,-2.6 -43,-0.3 -43,-0.2 -0.198 34.7 -98.0 -62.7 165.7 37.7 49.9 43.5 71 71 A F H > S+ 0 0 81 -45,-0.5 4,-3.2 1,-0.2 5,-0.2 0.824 125.5 56.9 -58.4 -33.0 39.7 51.3 40.5 72 72 A S H > S+ 0 0 40 2,-0.2 4,-2.7 3,-0.2 5,-0.2 0.960 108.6 44.1 -60.8 -55.1 42.5 52.3 43.0 73 73 A E H > S+ 0 0 4 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.930 118.0 46.6 -56.8 -48.8 42.9 48.8 44.3 74 74 A F H X S+ 0 0 9 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.961 113.8 44.2 -58.6 -60.2 42.8 47.4 40.7 75 75 A I H X S+ 0 0 6 -4,-3.2 4,-1.5 2,-0.2 -2,-0.2 0.896 114.3 51.7 -58.5 -41.3 45.3 50.0 39.1 76 76 A V H < S+ 0 0 48 -4,-2.7 -1,-0.2 -5,-0.2 3,-0.2 0.930 114.5 42.8 -57.6 -49.2 47.7 49.6 42.1 77 77 A F H >X S+ 0 0 53 -4,-2.4 4,-3.0 -5,-0.2 3,-0.8 0.698 100.9 66.6 -81.0 -12.0 47.6 45.8 41.7 78 78 A V H 3X S+ 0 0 2 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.922 102.9 50.8 -64.7 -36.0 47.9 45.9 37.9 79 79 A A H 3< S+ 0 0 7 -4,-1.5 4,-0.3 -3,-0.2 -1,-0.2 0.501 112.6 45.8 -74.0 -2.0 51.3 47.3 38.9 80 80 A A H <> S+ 0 0 21 -3,-0.8 4,-0.7 2,-0.1 -2,-0.2 0.769 104.0 61.1 -97.6 -36.8 51.6 44.1 41.1 81 81 A I H >X S+ 0 0 8 -4,-3.0 4,-3.1 2,-0.3 3,-0.9 0.887 101.9 53.8 -55.1 -45.9 50.3 41.7 38.4 82 82 A T H 3X S+ 0 0 2 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.947 109.9 47.1 -46.1 -54.2 53.3 42.7 36.3 83 83 A S H 34 S+ 0 0 34 -4,-0.3 -2,-0.3 2,-0.2 -1,-0.2 0.520 114.1 48.9 -73.0 -7.6 55.5 41.8 39.3 84 84 A A H X< S+ 0 0 42 -3,-0.9 3,-2.1 -4,-0.7 4,-0.5 0.867 112.6 44.7 -89.6 -57.3 53.5 38.5 39.6 85 85 A S H >< S+ 0 0 12 -4,-3.1 3,-1.4 1,-0.3 8,-0.9 0.863 105.9 62.1 -55.9 -38.6 53.8 37.5 35.9 86 86 A H T 3< S+ 0 0 20 -4,-2.7 9,-0.3 -5,-0.3 -1,-0.3 0.663 86.4 73.6 -67.5 -9.8 57.5 38.4 35.8 87 87 A K T < S- 0 0 137 -3,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.844 133.9 -29.7 -63.5 -34.9 58.1 35.6 38.5 88 88 A Y S < S+ 0 0 162 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 -0.466 75.8 154.7-178.5 109.8 57.6 33.3 35.5 89 89 A F S S- 0 0 75 -3,-0.2 -3,-0.1 -2,-0.1 -2,-0.0 0.723 93.7 -36.6 -96.3 -87.1 55.3 34.2 32.6 90 90 A E S S- 0 0 96 -4,-0.0 -4,-0.1 -5,-0.0 -5,-0.0 0.608 144.5 -12.3 -97.1 -27.4 56.6 32.1 29.6 91 91 A K S S- 0 0 108 4,-0.0 -5,-0.1 0, 0.0 3,-0.0 0.527 128.8 -50.7-134.0 -32.9 60.2 32.7 31.0 92 92 A T S > S- 0 0 44 -7,-0.1 3,-0.9 3,-0.0 -6,-0.2 0.198 70.3-124.8 128.7 71.5 60.0 35.4 33.7 93 93 A G T 3 S- 0 0 21 -8,-0.9 -7,-0.1 1,-0.3 -10,-0.1 0.542 88.9 -12.3 -22.8 -63.3 58.1 38.0 31.6 94 94 A L T 3 0 0 45 1,-0.3 -1,-0.3 -12,-0.2 -8,-0.1 0.364 360.0 360.0-113.1 -3.5 60.5 41.0 31.9 95 95 A K < 0 0 107 -3,-0.9 -1,-0.3 -9,-0.3 -9,-0.1 -0.376 360.0 360.0 39.6 360.0 62.7 39.6 34.7 96 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 97 1 B M 0 0 114 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 143.9 51.1 39.5 28.4 98 2 B T > - 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