==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-MAY-96 1RDX . COMPND 2 MOLECULE: FRUCTOSE 1,6-BISPHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR B.STEC,R.ABRAHAM,E.GIROUX,E.R.KANTROWITZ . 674 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30648.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 422 62.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 63 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 5 0.7 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 . 73 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 114 16.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.2 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 5 1 1 0 2 2 0 1 0 1 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 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 PARALLEL BRIDGES PER LADDER . 4 8 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 4 2 2 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 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 T 0 0 161 0, 0.0 399,-1.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 161.5 24.7 103.2 -10.5 2 2 A D + 0 0 93 397,-0.2 397,-0.2 1,-0.1 0, 0.0 -0.944 360.0 103.2-138.2 118.2 25.2 99.8 -12.3 3 3 A Q + 0 0 170 -2,-0.4 2,-1.1 2,-0.1 396,-0.4 0.104 31.2 173.8-175.1 29.3 28.3 98.4 -14.2 4 4 A A - 0 0 35 1,-0.1 393,-0.5 394,-0.0 395,-0.1 -0.324 32.0-148.8 -55.4 94.1 29.9 95.8 -11.9 5 5 A A - 0 0 64 -2,-1.1 393,-0.1 391,-0.2 -1,-0.1 0.270 6.8 -94.5 -61.8-179.8 32.4 94.6 -14.4 6 6 A F - 0 0 187 1,-0.2 -1,-0.1 391,-0.1 391,-0.1 -0.199 52.3 -75.6 -85.4-177.9 34.2 91.2 -15.2 7 7 A D S S+ 0 0 67 1,-0.1 -1,-0.2 -2,-0.1 3,-0.1 0.264 74.0 106.1 -72.4-165.2 37.7 90.1 -13.9 8 8 A T S S+ 0 0 143 1,-0.4 2,-0.3 0, 0.0 -1,-0.1 0.654 79.6 75.3 97.6 33.9 41.4 90.9 -14.7 9 9 A N - 0 0 112 2,-0.0 -1,-0.4 0, 0.0 2,-0.3 -0.988 49.6-175.3-165.8 158.5 41.8 92.9 -11.5 10 10 A I - 0 0 73 -2,-0.3 2,-0.4 -3,-0.1 184,-0.1 -0.957 19.5-139.1-154.0 161.2 42.3 92.8 -7.7 11 11 A V + 0 0 32 -2,-0.3 184,-2.9 184,-0.2 -2,-0.0 -0.835 29.1 174.5-131.8 93.5 42.6 95.3 -4.9 12 12 A T - 0 0 10 -2,-0.4 183,-0.3 182,-0.2 4,-0.2 0.124 41.1-112.0 -80.4-162.4 45.2 94.5 -2.3 13 13 A L S > S+ 0 0 5 2,-0.1 4,-1.4 3,-0.1 3,-0.3 0.732 110.6 63.3-103.3 -36.8 46.4 96.5 0.6 14 14 A T H >> S+ 0 0 49 1,-0.3 4,-3.6 2,-0.2 3,-1.0 0.965 102.3 53.0 -50.2 -58.7 49.9 97.3 -0.7 15 15 A R H 3> S+ 0 0 75 1,-0.3 4,-3.2 2,-0.2 5,-0.4 0.816 99.1 64.9 -47.3 -39.2 48.3 99.2 -3.5 16 16 A F H 3> S+ 0 0 16 -3,-0.3 4,-1.5 1,-0.2 5,-0.4 0.924 118.9 22.2 -57.4 -45.4 46.3 101.3 -1.0 17 17 A V H X S+ 0 0 100 -4,-3.2 4,-1.6 -5,-0.3 3,-0.8 0.979 127.3 35.0 -82.0 -78.2 48.9 104.5 -4.3 20 20 A Q H 3< S+ 0 0 68 -4,-1.5 4,-0.2 -5,-0.4 -3,-0.2 0.849 112.8 67.2 -47.9 -38.9 47.5 107.0 -1.8 21 21 A G H >< S+ 0 0 20 -4,-1.5 3,-1.4 -5,-0.4 -1,-0.2 0.883 102.2 40.4 -50.0 -55.7 50.9 107.1 -0.2 22 22 A R H X< S+ 0 0 207 -3,-0.8 3,-3.5 -4,-0.8 -1,-0.2 0.837 104.2 68.1 -66.9 -29.5 52.8 108.8 -3.1 23 23 A K T 3< S+ 0 0 156 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.599 101.0 50.7 -64.3 -9.4 49.7 111.0 -3.6 24 24 A A T < S- 0 0 75 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.121 117.0-123.5-108.5 15.4 50.9 112.4 -0.2 25 25 A R < + 0 0 210 -3,-3.5 -3,-0.2 1,-0.1 2,-0.2 0.920 64.8 121.3 37.0 79.5 54.5 112.8 -1.7 26 26 A G S S- 0 0 59 -5,-0.2 -1,-0.1 3,-0.0 -4,-0.0 -0.463 71.8 -81.5-138.1-148.8 56.4 110.7 0.8 27 27 A T - 0 0 114 -2,-0.2 -5,-0.1 -6,-0.0 -2,-0.0 0.665 49.7-116.0-104.5 -20.7 58.7 107.6 1.3 28 28 A G S S+ 0 0 34 -7,-0.1 4,-0.4 -11,-0.1 -10,-0.1 0.757 82.8 123.5 82.3 25.4 56.4 104.6 1.3 29 29 A E >> + 0 0 36 2,-0.2 3,-0.9 1,-0.1 4,-0.7 0.835 62.2 59.7 -85.7 -42.3 57.7 104.2 4.8 30 30 A M T 34 S+ 0 0 32 1,-0.3 3,-0.5 2,-0.2 4,-0.4 0.849 107.4 52.4 -54.2 -32.5 54.3 104.3 6.4 31 31 A T T 3> S+ 0 0 22 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.694 85.1 75.5 -78.2 -26.6 53.8 101.2 4.2 32 32 A Q T <4 S+ 0 0 97 -3,-0.9 4,-0.4 -4,-0.4 -1,-0.2 0.822 100.5 61.5 -51.9 -28.8 56.8 99.2 5.3 33 33 A L T >< S+ 0 0 15 -4,-0.7 3,-3.0 -3,-0.5 2,-0.6 0.855 98.2 33.0 -59.7-120.0 54.4 98.8 8.2 34 34 A L T 3> S+ 0 0 16 -4,-0.4 4,-2.7 1,-0.3 6,-0.3 0.407 102.5 75.6 -22.8 -23.0 51.0 97.1 7.9 35 35 A N H 3X S+ 0 0 75 -4,-0.9 4,-4.0 -2,-0.6 -1,-0.3 0.890 93.7 54.2 -61.4 -40.7 52.2 94.6 5.1 36 36 A S H <4 S+ 0 0 23 -3,-3.0 -1,-0.2 -4,-0.4 -2,-0.2 0.788 115.0 39.5 -62.3 -24.6 53.9 92.8 7.9 37 37 A L H > S+ 0 0 9 -4,-0.3 4,-2.3 2,-0.2 3,-0.3 0.743 111.2 56.6 -95.1 -26.7 50.4 92.7 9.5 38 38 A C H >X S+ 0 0 8 -4,-2.7 4,-0.7 1,-0.3 3,-0.6 0.982 105.3 52.4 -63.5 -50.5 48.8 92.1 6.2 39 39 A T H 3X S+ 0 0 68 -4,-4.0 4,-1.3 1,-0.3 -1,-0.3 0.634 111.9 49.3 -56.6 -16.5 51.1 89.1 6.1 40 40 A A H 3>>S+ 0 0 5 -6,-0.3 4,-1.3 -3,-0.3 5,-1.0 0.799 92.5 69.1 -94.5 -34.1 49.5 88.4 9.5 41 41 A V H <<5S+ 0 0 0 -4,-2.3 -2,-0.2 -3,-0.6 -3,-0.1 0.622 117.2 30.9 -62.3 -8.9 45.8 88.8 8.6 42 42 A K H X5S+ 0 0 51 -4,-0.7 4,-1.9 -5,-0.2 5,-0.3 0.720 111.5 66.7-109.4 -49.1 46.5 85.6 6.7 43 43 A A H >X5S+ 0 0 56 -4,-1.3 4,-0.5 1,-0.3 3,-0.5 0.891 121.4 16.6 -39.6 -74.1 49.2 84.1 9.0 44 44 A I H >X5S+ 0 0 25 -4,-1.3 4,-1.1 1,-0.2 3,-1.0 0.786 108.1 88.3 -75.8 -20.7 47.1 83.5 12.1 45 45 A S H >4< S+ 0 0 54 -4,-0.9 3,-1.1 -3,-0.4 -2,-0.3 0.764 100.1 92.2-103.4 -35.7 43.8 74.3 13.3 51 51 A A H 3< S+ 0 0 17 -4,-3.0 -3,-0.2 1,-0.2 4,-0.2 0.660 70.4 84.5 -35.8 -29.7 44.1 75.9 16.7 52 52 A G T 3< S- 0 0 50 -4,-0.7 -1,-0.2 74,-0.1 -2,-0.1 0.858 107.0 -51.0 -45.3 -57.8 41.5 73.5 18.0 53 53 A I S < S+ 0 0 94 -3,-1.1 2,-0.6 481,-0.0 482,-0.1 0.401 119.5 37.5-147.0 -83.0 43.4 70.3 18.9 54 54 A A S S+ 0 0 46 480,-0.2 2,-0.3 1,-0.1 -3,-0.1 -0.157 101.7 85.4 -82.3 36.0 45.9 68.2 17.0 55 55 A H S S+ 0 0 38 -2,-0.6 5,-0.1 -5,-0.3 2,-0.1 -0.836 76.6 35.7-145.2 104.5 47.4 71.3 15.5 56 56 A L S S+ 0 0 38 3,-0.4 6,-0.7 -2,-0.3 2,-0.3 -0.612 92.5 60.6 160.5 -91.6 50.1 73.3 17.3 57 57 A Y S S- 0 0 122 1,-0.2 2,-2.9 4,-0.2 -1,-0.2 -0.533 128.4 -18.5 -70.6 129.8 52.7 71.5 19.4 58 58 A G S > S+ 0 0 63 -2,-0.3 2,-2.6 4,-0.3 3,-1.4 -0.404 128.3 76.7 73.1 -64.0 54.8 69.1 17.4 59 59 A I T 3 S+ 0 0 74 -2,-2.9 -3,-0.4 1,-0.3 -1,-0.2 -0.265 115.2 18.0 -76.1 53.8 52.2 69.1 14.6 60 60 A A T 3 S- 0 0 86 -2,-2.6 -1,-0.3 -5,-0.1 -3,-0.1 0.171 121.0 -92.2 162.5 -4.9 53.4 72.5 13.4 61 61 A G < + 0 0 58 -3,-1.4 2,-0.9 1,-0.2 -4,-0.2 0.881 59.0 172.4 77.1 45.4 56.9 72.7 15.1 62 62 A S + 0 0 6 -6,-0.7 -4,-0.3 1,-0.1 -1,-0.2 -0.734 15.9 138.6 -93.4 102.6 56.0 74.5 18.4 63 63 A T + 0 0 130 -2,-0.9 -1,-0.1 1,-0.1 -6,-0.0 -0.597 31.4 98.4-146.5 80.5 59.0 74.6 20.8 64 64 A N - 0 0 95 -2,-0.1 -1,-0.1 2,-0.1 -2,-0.0 -0.340 69.1-142.0-155.8 51.3 59.5 77.9 22.7 65 65 A V + 0 0 127 -3,-0.1 2,-0.4 1,-0.1 7,-0.1 0.089 31.4 171.8 -29.2 92.1 57.8 76.8 26.0 66 66 A T + 0 0 47 5,-0.1 5,-0.2 0, 0.0 2,-0.2 -0.907 39.2 9.0-112.4 137.4 56.1 80.0 27.1 67 67 A G S S- 0 0 59 -2,-0.4 5,-0.1 1,-0.1 0, 0.0 -0.588 83.3 -82.8 101.8-164.0 53.6 80.2 30.0 68 68 A D S S- 0 0 155 -2,-0.2 -1,-0.1 3,-0.1 -3,-0.0 0.673 88.3 -61.9-112.3 -45.1 52.5 77.9 32.8 69 69 A Q S S+ 0 0 186 2,-0.1 3,-0.1 -3,-0.0 -2,-0.1 0.262 113.8 93.0 164.6 25.1 49.9 75.8 31.0 70 70 A V S S- 0 0 118 1,-0.3 2,-0.3 2,-0.0 -3,-0.1 0.456 94.4 -16.2-111.8 -6.5 47.2 78.2 29.9 71 71 A K + 0 0 83 -5,-0.2 -1,-0.3 2,-0.1 -5,-0.1 -0.980 39.0 163.7 179.2 172.8 48.5 79.1 26.4 72 72 A K S > S+ 0 0 3 -2,-0.3 4,-3.1 -3,-0.1 5,-0.2 0.051 79.7 64.6-168.6 -51.6 51.3 79.1 23.8 73 73 A L H > S+ 0 0 41 2,-0.2 4,-3.1 1,-0.2 6,-0.3 0.908 101.9 54.8 -51.5 -49.9 49.7 79.7 20.3 74 74 A D H > S+ 0 0 11 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.918 113.1 41.8 -49.7 -47.9 48.6 83.2 21.4 75 75 A V H > S+ 0 0 26 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.875 112.8 54.5 -71.0 -33.8 52.2 83.8 22.4 76 76 A L H X S+ 0 0 50 -4,-3.1 4,-0.8 2,-0.2 5,-0.3 0.847 103.4 57.8 -68.1 -31.5 53.4 82.1 19.1 77 77 A S H >X S+ 0 0 11 -4,-3.1 3,-2.4 1,-0.2 4,-2.2 0.972 117.6 30.4 -56.6 -77.9 51.1 84.5 17.2 78 78 A N H 3< S+ 0 0 11 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.698 106.1 81.5 -53.7 -22.1 52.8 87.6 18.5 79 79 A D H 3< S+ 0 0 43 -4,-1.8 4,-0.4 -6,-0.3 -1,-0.3 0.735 111.5 19.8 -61.0 -26.7 56.0 85.5 18.7 80 80 A L H > S+ 0 0 43 -5,-0.2 3,-2.8 -4,-0.1 4,-0.8 0.709 109.9 31.7-104.5 -82.1 57.2 90.7 16.9 83 83 A N H 3> S+ 0 0 70 -4,-0.4 4,-2.9 1,-0.3 5,-0.2 0.735 107.1 74.4 -52.5 -22.2 60.4 90.5 14.9 84 84 A V H 3< S+ 0 0 28 -4,-2.0 4,-0.3 1,-0.3 -1,-0.3 0.923 95.7 51.8 -54.4 -40.1 58.3 90.8 11.8 85 85 A L H X4 S+ 0 0 10 -3,-2.8 3,-1.2 1,-0.2 6,-0.5 0.881 108.0 49.1 -63.4 -38.9 58.0 94.4 12.9 86 86 A K H >< S+ 0 0 38 -4,-0.8 3,-2.4 1,-0.2 -2,-0.2 0.887 100.1 66.7 -69.6 -31.7 61.8 94.5 13.1 87 87 A S T 3< S+ 0 0 95 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.581 90.9 65.0 -63.1 -12.1 61.9 93.0 9.6 88 88 A S T < S- 0 0 10 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.533 93.0-146.4 -85.5 -13.2 60.3 96.2 8.3 89 89 A F S < S+ 0 0 134 -3,-2.4 21,-0.2 -4,-0.2 -2,-0.1 0.395 84.5 78.8 63.7 -4.5 63.4 98.1 9.3 90 90 A A + 0 0 11 -5,-0.4 23,-0.5 19,-0.2 22,-0.5 0.316 59.2 125.1-116.5 7.5 61.0 101.1 10.1 91 91 A T B +a 113 0A 5 -6,-0.5 23,-0.1 18,-0.4 3,-0.1 -0.502 25.0 168.0 -74.0 133.1 59.6 100.1 13.5 92 92 A C + 0 0 2 21,-0.7 13,-2.1 18,-0.2 2,-0.7 0.811 69.6 10.7-104.8 -78.0 59.9 102.6 16.4 93 93 A V E -B 104 0B 0 11,-0.2 2,-1.3 20,-0.1 -1,-0.2 -0.895 67.4-158.4-116.1 95.7 57.9 101.7 19.4 94 94 A L E -B 103 0B 2 9,-1.2 9,-0.8 -2,-0.7 2,-0.5 -0.684 14.9-159.3 -76.1 95.8 56.5 98.2 19.1 95 95 A V E +c 116 0C 2 20,-3.3 22,-1.9 -2,-1.3 2,-0.3 -0.735 21.2 161.7 -84.6 121.2 53.6 98.4 21.5 96 96 A T E > -c 117 0C 2 -2,-0.5 3,-1.5 3,-0.2 22,-0.1 -0.897 37.6-152.8-151.0 121.9 52.4 95.0 22.7 97 97 A E T 3 S+ 0 0 51 20,-0.6 -1,-0.1 -2,-0.3 21,-0.1 0.788 92.0 76.1 -52.9 -42.6 50.2 93.8 25.7 98 98 A E T 3 S+ 0 0 54 2,-0.0 2,-0.4 -23,-0.0 -1,-0.3 0.883 96.8 55.8 -40.1 -41.1 51.9 90.4 25.7 99 99 A D S < S- 0 0 80 -3,-1.5 -3,-0.2 1,-0.1 4,-0.0 -0.765 92.5-124.2 -99.9 139.1 54.8 92.3 27.3 100 100 A K S S+ 0 0 188 -2,-0.4 211,-0.3 210,-0.0 2,-0.3 0.849 100.3 7.0 -42.9 -42.7 54.3 94.3 30.5 101 101 A N S S- 0 0 59 1,-0.3 -2,-0.1 209,-0.1 -6,-0.0 -0.815 94.9 -91.9-134.5 170.1 55.7 97.2 28.5 102 102 A A - 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