==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 14-MAY-05 1X4I . COMPND 2 MOLECULE: INHIBITOR OF GROWTH PROTEIN 3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.HE,Y.MUTO,M.INOUE,T.KIGAWA,M.SHIROUZU,T.TERADA,S.YOKOYAMA, . 70 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5715.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 29 41.4 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 . 3 4.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 . 6 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 15.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 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 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G 0 0 129 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 127.1 8.7 19.2 14.6 2 2 A S + 0 0 134 2,-0.0 2,-0.3 3,-0.0 3,-0.0 -0.891 360.0 160.4-106.1 112.9 10.4 16.5 12.6 3 3 A S + 0 0 128 -2,-0.7 3,-0.1 1,-0.1 0, 0.0 -0.846 33.3 73.6-127.3 163.7 11.5 17.5 9.1 4 4 A G S S+ 0 0 83 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 -0.362 77.6 76.8 133.2 -56.3 14.0 16.3 6.5 5 5 A S - 0 0 65 1,-0.1 -1,-0.3 7,-0.1 8,-0.0 -0.657 66.1-143.5 -91.2 145.3 12.5 13.2 5.0 6 6 A S - 0 0 82 -2,-0.3 -1,-0.1 -3,-0.1 7,-0.1 0.574 35.0-141.1 -80.9 -9.8 9.6 13.3 2.4 7 7 A G + 0 0 27 5,-0.2 7,-0.2 4,-0.1 6,-0.1 0.910 44.0 147.4 46.2 97.7 8.1 10.2 3.9 8 8 A Y + 0 0 100 5,-2.5 4,-0.2 22,-0.0 6,-0.2 0.652 43.3 67.9-120.5 -70.3 6.8 8.1 1.0 9 9 A C S > S- 0 0 2 4,-1.2 3,-2.6 5,-0.1 4,-0.3 0.004 97.7 -96.9 -51.5 163.0 7.0 4.3 1.7 10 10 A I T 3 S+ 0 0 73 1,-0.3 -1,-0.1 2,-0.2 22,-0.1 0.797 126.5 65.1 -54.2 -29.1 4.8 2.8 4.3 11 11 A C T 3 S- 0 0 52 2,-0.1 -1,-0.3 3,-0.1 -2,-0.1 0.356 116.0-118.1 -76.5 7.7 7.8 3.0 6.6 12 12 A N S < S+ 0 0 120 -3,-2.6 2,-0.3 1,-0.2 -5,-0.2 0.907 71.1 133.6 55.7 44.6 7.5 6.8 6.3 13 13 A Q - 0 0 95 -4,-0.3 -5,-2.5 1,-0.1 -4,-1.2 -0.843 62.2 -83.7-123.6 160.8 10.9 7.0 4.7 14 14 A V - 0 0 62 -2,-0.3 2,-1.3 -7,-0.2 -1,-0.1 -0.053 50.9 -97.4 -56.0 162.5 12.4 8.8 1.6 15 15 A S + 0 0 53 -7,-0.1 2,-0.2 -8,-0.0 -1,-0.1 -0.680 69.5 139.8 -88.7 89.2 12.1 7.1 -1.8 16 16 A Y + 0 0 137 -2,-1.3 -3,-0.0 2,-0.1 0, 0.0 -0.670 39.5 20.0-122.2 177.6 15.4 5.4 -2.2 17 17 A G S S- 0 0 61 -2,-0.2 2,-0.3 16,-0.1 0, 0.0 0.199 114.6 -20.4 50.4 179.1 16.8 2.1 -3.6 18 18 A E S S- 0 0 139 15,-0.0 16,-1.0 1,-0.0 2,-0.3 -0.378 77.1-176.6 -58.3 113.6 14.7 0.0 -6.0 19 19 A M E -A 33 0A 25 -2,-0.3 2,-0.6 14,-0.2 14,-0.2 -0.877 21.4-140.9-117.1 149.1 11.1 1.1 -5.5 20 20 A V E -A 32 0A 16 12,-2.3 12,-1.1 -2,-0.3 2,-0.4 -0.918 16.7-139.0-113.1 110.7 7.9 -0.2 -7.1 21 21 A G - 0 0 35 -2,-0.6 10,-0.2 10,-0.2 26,-0.2 -0.522 29.0-111.3 -70.4 121.7 5.3 2.4 -8.1 22 22 A C - 0 0 0 -2,-0.4 26,-0.2 1,-0.2 5,-0.1 -0.238 17.8-129.8 -53.1 132.8 1.8 1.2 -7.3 23 23 A D S S+ 0 0 49 24,-1.2 2,-1.0 1,-0.1 -1,-0.2 0.834 94.7 81.3 -53.7 -34.1 -0.2 0.4 -10.4 24 24 A N > - 0 0 49 1,-0.2 3,-2.3 2,-0.1 6,-0.1 -0.654 65.5-165.8 -79.8 102.2 -2.9 2.6 -9.0 25 25 A Q T 3 S+ 0 0 129 -2,-1.0 -1,-0.2 1,-0.3 -3,-0.1 0.796 87.4 67.8 -56.7 -28.7 -1.9 6.2 -9.7 26 26 A D T 3 S+ 0 0 137 -3,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.733 74.9 118.8 -64.0 -21.7 -4.5 7.2 -7.2 27 27 A C < - 0 0 10 -3,-2.3 25,-0.0 1,-0.2 -5,-0.0 -0.153 67.6-138.6 -48.8 134.1 -2.3 5.7 -4.5 28 28 A P S S+ 0 0 112 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.692 102.3 26.3 -69.8 -19.0 -1.2 8.2 -1.9 29 29 A I + 0 0 22 3,-0.0 -20,-0.1 -19,-0.0 -2,-0.1 0.792 69.1 178.6-108.3 -53.4 2.3 6.7 -2.0 30 30 A E + 0 0 53 -6,-0.1 2,-0.2 -9,-0.1 -21,-0.1 0.767 65.6 80.8 51.6 25.9 2.7 5.1 -5.4 31 31 A W + 0 0 103 -10,-0.2 2,-0.4 -23,-0.2 -10,-0.2 -0.720 52.9 164.9-164.1 107.1 6.2 4.2 -4.1 32 32 A F E -A 20 0A 0 -12,-1.1 -12,-2.3 -2,-0.2 -17,-0.0 -0.967 35.9-111.6-128.7 143.9 7.1 1.3 -1.8 33 33 A H E > -A 19 0A 12 -2,-0.4 4,-1.7 -14,-0.2 5,-0.2 -0.301 19.9-129.2 -69.4 154.8 10.5 -0.3 -1.0 34 34 A Y H >>S+ 0 0 36 -16,-1.0 5,-2.5 1,-0.2 4,-2.0 0.861 109.8 46.7 -72.6 -36.7 11.2 -3.9 -2.2 35 35 A G H 45S+ 0 0 78 3,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.770 111.5 51.9 -76.1 -26.3 12.3 -5.0 1.2 36 36 A C H 45S+ 0 0 58 1,-0.1 -2,-0.2 3,-0.1 -1,-0.2 0.876 122.7 28.9 -76.7 -39.6 9.3 -3.4 2.9 37 37 A V H <5S- 0 0 37 -4,-1.7 -2,-0.2 2,-0.1 -3,-0.2 0.703 115.2-113.0 -92.0 -24.1 6.8 -5.1 0.6 38 38 A G T <5 + 0 0 56 -4,-2.0 2,-0.3 -5,-0.2 -3,-0.2 0.937 56.9 152.8 89.1 69.2 8.9 -8.2 -0.1 39 39 A L < - 0 0 25 -5,-2.5 -1,-0.1 1,-0.1 -4,-0.1 -0.678 22.2-174.9-131.5 79.1 10.0 -8.1 -3.7 40 40 A T S S+ 0 0 127 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.768 81.0 2.3 -42.1 -28.7 13.3 -10.0 -4.1 41 41 A E S S- 0 0 105 -3,-0.1 3,-0.1 -7,-0.1 -1,-0.1 -0.989 102.4 -63.8-158.6 156.9 13.0 -8.8 -7.7 42 42 A A - 0 0 52 -2,-0.3 2,-0.4 1,-0.1 3,-0.0 -0.085 62.4-105.1 -44.2 134.5 10.8 -6.7 -10.0 43 43 A P - 0 0 40 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 -0.511 20.1-147.2 -69.8 122.2 7.3 -8.3 -10.3 44 44 A K S S+ 0 0 165 -2,-0.4 3,-0.1 -3,-0.1 -2,-0.1 0.936 83.8 25.7 -53.5 -51.6 6.8 -10.0 -13.7 45 45 A G S S- 0 0 58 1,-0.2 2,-0.4 -3,-0.0 0, 0.0 0.166 117.8 -41.3 -92.2-148.4 3.1 -9.1 -13.8 46 46 A K - 0 0 163 2,-0.0 2,-0.5 -24,-0.0 -1,-0.2 -0.677 53.8-160.1 -85.7 132.9 1.1 -6.4 -12.1 47 47 A W - 0 0 44 -2,-0.4 -24,-1.2 -26,-0.2 2,-0.5 -0.952 5.3-168.9-117.5 129.8 2.0 -5.5 -8.6 48 48 A Y - 0 0 80 -2,-0.5 5,-0.1 -26,-0.2 -26,-0.1 -0.968 28.6-111.8-121.6 123.9 -0.3 -3.6 -6.2 49 49 A C >> - 0 0 0 -2,-0.5 4,-1.9 1,-0.1 3,-0.9 0.027 28.7-113.2 -45.5 155.4 0.8 -2.2 -2.8 50 50 A P H 3> S+ 0 0 69 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.601 114.7 65.1 -69.8 -10.9 -0.6 -3.9 0.3 51 51 A Q H 3> S+ 0 0 81 2,-0.1 4,-0.5 3,-0.1 -2,-0.1 0.783 109.8 34.6 -81.7 -29.5 -2.4 -0.6 1.0 52 52 A C H X> S+ 0 0 14 -3,-0.9 4,-3.1 2,-0.2 3,-1.3 0.926 111.2 56.6 -88.3 -57.7 -4.6 -0.9 -2.1 53 53 A T H 3X S+ 0 0 48 -4,-1.9 4,-1.6 1,-0.3 -2,-0.1 0.801 108.2 53.9 -44.5 -32.4 -5.1 -4.7 -2.4 54 54 A A H 3X S+ 0 0 50 -4,-0.5 4,-1.1 -5,-0.2 -1,-0.3 0.871 113.3 40.1 -72.1 -38.4 -6.5 -4.4 1.1 55 55 A A H < S+ 0 0 41 -4,-1.9 3,-0.6 -5,-0.2 -2,-0.1 0.883 110.2 24.6 -67.7-103.8 -15.2 -6.5 -3.9 61 61 A S T 3< S+ 0 0 101 -4,-0.5 3,-0.2 1,-0.2 -1,-0.1 -0.352 128.9 20.3 -65.8 142.9 -16.8 -9.3 -2.0 62 62 A R T 3 S- 0 0 214 1,-0.2 2,-2.1 -3,-0.1 -1,-0.2 0.897 77.4-176.8 65.3 41.4 -19.1 -8.3 0.8 63 63 A H < + 0 0 152 -3,-0.6 2,-0.4 -4,-0.1 -1,-0.2 -0.491 26.7 138.4 -73.5 81.0 -19.6 -4.8 -0.6 64 64 A K + 0 0 182 -2,-2.1 2,-0.5 -6,-0.2 -1,-0.1 -0.830 12.3 155.3-132.0 95.0 -21.8 -3.5 2.2 65 65 A S + 0 0 128 -2,-0.4 3,-0.1 -6,-0.1 -2,-0.0 -0.756 20.7 147.9-122.4 84.2 -21.1 0.1 3.3 66 66 A G - 0 0 52 -2,-0.5 2,-0.1 1,-0.2 -2,-0.0 -0.191 53.5 -48.3-101.2-164.8 -24.2 1.6 4.8 67 67 A P - 0 0 121 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 -0.424 51.0-127.4 -69.7 139.2 -24.9 4.2 7.5 68 68 A S + 0 0 131 -2,-0.1 2,-0.3 -3,-0.1 -3,-0.0 -0.777 51.3 138.4 -92.6 103.4 -23.1 3.7 10.9 69 69 A S 0 0 112 -2,-0.9 0, 0.0 0, 0.0 0, 0.0 -0.992 360.0 360.0-148.2 136.9 -25.7 3.8 13.6 70 70 A G 0 0 135 -2,-0.3 -2,-0.0 0, 0.0 0, 0.0 -0.975 360.0 360.0 125.0 360.0 -26.2 1.7 16.8