==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BINDING PROTEIN 08-DEC-95 1PUC . COMPND 2 MOLECULE: P13SUC1; . SOURCE 2 ORGANISM_SCIENTIFIC: SCHIZOSACCHAROMYCES POMBE; . AUTHOR N.KHAZANOVICH,K.S.BATEMAN,M.CHERNAIA,M.MICHALAK,M.N.G.JAMES . 101 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8856.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 45 44.6 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 . 8 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.0 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 1.0 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 . 5 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.0 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 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 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 . 1 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 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 2 A S 0 0 170 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 137.0 4.2 14.6 29.7 2 3 A K - 0 0 208 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.936 360.0-168.2-114.2 135.2 4.4 13.7 33.4 3 4 A S - 0 0 111 -2,-0.4 53,-0.0 1,-0.1 2,-0.0 -0.841 27.6 -89.9-123.1 160.1 6.6 15.7 35.8 4 5 A G - 0 0 52 -2,-0.3 -1,-0.1 51,-0.1 50,-0.0 -0.314 37.3-125.6 -67.1 149.9 7.9 15.3 39.3 5 6 A V - 0 0 112 1,-0.1 -1,-0.1 -2,-0.0 2,-0.0 -0.745 29.2-105.6 -97.1 138.6 5.9 16.7 42.2 6 7 A P + 0 0 56 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.394 49.2 174.3 -60.4 146.8 7.6 19.1 44.7 7 8 A R - 0 0 73 46,-0.0 2,-0.2 -3,-0.0 -3,-0.0 -0.982 27.9-122.6-159.6 138.8 8.2 17.3 48.0 8 9 A L - 0 0 100 -2,-0.3 2,-0.1 1,-0.1 61,-0.1 -0.552 35.3-103.6 -85.5 152.8 10.0 18.0 51.3 9 10 A L - 0 0 31 -2,-0.2 2,-0.1 60,-0.1 -1,-0.1 -0.445 30.5-127.5 -75.1 144.9 12.9 15.9 52.7 10 11 A T > - 0 0 67 -2,-0.1 4,-2.7 1,-0.1 5,-0.3 -0.393 32.4 -98.2 -83.5 169.7 12.3 13.5 55.5 11 12 A A H > S+ 0 0 83 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.910 124.0 46.5 -54.7 -47.6 14.5 13.6 58.7 12 13 A S H > S+ 0 0 63 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.883 112.0 50.5 -65.3 -39.1 16.7 10.7 57.5 13 14 A E H 4 S+ 0 0 34 1,-0.2 4,-0.5 2,-0.2 -2,-0.2 0.934 113.3 45.3 -64.7 -44.1 17.1 12.2 54.0 14 15 A R H >X S+ 0 0 72 -4,-2.7 3,-1.3 1,-0.2 4,-0.5 0.876 107.4 58.2 -67.6 -35.7 18.1 15.6 55.5 15 16 A E H >< S+ 0 0 130 -4,-2.3 3,-1.2 -5,-0.3 -1,-0.2 0.874 98.6 61.6 -63.2 -32.3 20.4 14.0 58.0 16 17 A R T 3< S+ 0 0 141 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.705 98.1 56.9 -66.7 -21.1 22.3 12.4 55.1 17 18 A L T X> S+ 0 0 0 -3,-1.3 3,-1.8 -4,-0.5 4,-1.3 0.618 78.9 96.9 -87.3 -11.8 23.2 15.8 53.7 18 19 A E H < S+ 0 0 39 -4,-1.3 3,-1.4 1,-0.3 -1,-0.1 0.817 88.2 50.8 -43.7 -46.8 26.5 21.5 54.0 22 23 A D T 3< S+ 0 0 117 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.541 104.8 60.9 -73.4 -4.8 29.6 23.4 55.1 23 24 A Q T < S+ 0 0 122 -3,-2.6 -1,-0.3 2,-0.1 2,-0.2 0.402 74.1 117.5-101.5 0.3 31.2 22.8 51.8 24 25 A I < - 0 0 15 -3,-1.4 2,-0.4 -4,-0.3 18,-0.2 -0.512 55.5-145.1 -71.3 134.3 28.6 24.6 49.7 25 26 A H E -A 41 0A 96 16,-2.2 16,-2.4 -2,-0.2 2,-0.5 -0.877 8.1-159.2-107.1 132.6 30.0 27.5 47.8 26 27 A Y E -A 40 0A 70 -2,-0.4 14,-0.2 14,-0.2 3,-0.1 -0.937 15.6-140.0-111.8 123.5 28.1 30.8 47.1 27 28 A S - 0 0 1 12,-2.1 3,-0.1 -2,-0.5 0, 0.0 -0.360 28.4 -95.5 -78.4 159.5 29.3 33.0 44.3 28 29 A P - 0 0 106 0, 0.0 11,-0.3 0, 0.0 2,-0.2 -0.304 50.5 -99.0 -68.1 161.9 29.4 36.7 44.5 29 30 A R - 0 0 149 9,-0.1 2,-0.3 -3,-0.1 9,-0.2 -0.604 39.8-178.1 -85.7 144.6 26.3 38.4 43.0 30 31 A Y E -B 37 0B 107 7,-1.9 7,-3.4 -2,-0.2 2,-0.3 -0.871 10.1-171.2-131.7 163.0 26.3 39.9 39.5 31 32 A A E -B 36 0B 67 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.973 20.7-160.6-155.5 169.0 23.5 41.7 37.8 32 33 A D - 0 0 80 3,-2.4 5,-0.0 -2,-0.3 0, 0.0 -0.404 61.4 -54.9-126.1-150.6 21.9 43.3 34.7 33 34 A D S S+ 0 0 167 -2,-0.2 3,-0.0 1,-0.2 -2,-0.0 0.921 128.9 7.5 -63.0 -50.6 19.1 45.9 34.3 34 35 A E S S+ 0 0 154 1,-0.1 2,-0.3 2,-0.0 -1,-0.2 0.524 119.5 58.3-115.4 -4.3 16.3 44.1 36.2 35 36 A Y - 0 0 139 2,-0.0 -3,-2.4 0, 0.0 2,-0.3 -0.957 54.8-147.6-135.8 150.9 17.8 41.1 38.0 36 37 A E E -B 31 0B 96 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.808 27.3-168.9-101.7 145.2 20.5 40.0 40.4 37 38 A Y E +B 30 0B 53 -7,-3.4 -7,-1.9 -2,-0.3 2,-0.3 -0.923 17.1 161.1-135.3 164.7 22.1 36.6 39.8 38 39 A R - 0 0 53 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.1 -0.942 24.1-137.1-170.1 158.8 24.4 34.2 41.6 39 40 A H - 0 0 88 -11,-0.3 -12,-2.1 -2,-0.3 2,-0.4 -0.973 9.7-144.9-128.4 148.2 25.2 30.5 41.3 40 41 A V E -A 26 0A 45 -2,-0.4 2,-0.6 -14,-0.2 -14,-0.2 -0.952 8.8-154.4-114.1 131.0 25.6 27.9 44.0 41 42 A M E -A 25 0A 110 -16,-2.4 -16,-2.2 -2,-0.4 3,-0.0 -0.919 7.9-161.5-112.0 111.6 28.2 25.1 43.7 42 43 A L - 0 0 37 -2,-0.6 2,-0.1 -18,-0.2 -18,-0.1 -0.542 34.0 -98.8 -86.2 150.0 27.5 21.9 45.6 43 44 A P >> - 0 0 32 0, 0.0 3,-1.4 0, 0.0 4,-0.6 -0.520 34.0-124.6 -66.3 138.3 30.3 19.4 46.3 44 45 A K H >> S+ 0 0 177 1,-0.3 3,-0.9 2,-0.2 4,-0.6 0.832 109.2 62.8 -54.2 -33.8 29.9 16.7 43.6 45 46 A A H >4 S+ 0 0 54 1,-0.2 3,-0.7 2,-0.2 4,-0.3 0.804 93.2 65.6 -62.1 -28.8 29.8 14.0 46.4 46 47 A M H X> S+ 0 0 0 -3,-1.4 3,-1.7 1,-0.2 4,-0.8 0.820 87.5 66.9 -64.7 -32.4 26.6 15.6 47.6 47 48 A L H X< S+ 0 0 71 -3,-0.9 3,-0.7 -4,-0.6 -1,-0.2 0.850 94.6 57.5 -59.2 -34.9 24.6 14.8 44.5 48 49 A K T << S+ 0 0 180 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.618 106.9 50.6 -70.1 -14.7 24.8 11.1 45.2 49 50 A A T <4 S+ 0 0 27 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.2 0.557 88.9 96.1 -98.0 -14.2 23.1 11.8 48.6 50 51 A I S << S- 0 0 8 -4,-0.8 5,-0.1 -3,-0.7 2,-0.0 -0.551 89.8 -95.9 -79.7 140.5 20.2 13.8 47.2 51 52 A P > - 0 0 17 0, 0.0 3,-2.2 0, 0.0 4,-0.2 -0.336 28.6-126.3 -56.6 135.2 16.9 11.9 46.5 52 53 A T G > S+ 0 0 126 1,-0.3 3,-1.7 2,-0.2 -2,-0.1 0.771 105.9 66.7 -55.0 -29.3 16.5 10.8 42.9 53 54 A D G 3 S+ 0 0 67 1,-0.3 -1,-0.3 3,-0.1 -46,-0.0 0.466 88.4 67.9 -73.9 -0.6 13.1 12.4 42.6 54 55 A Y G < S+ 0 0 0 -3,-2.2 9,-2.4 2,-0.1 2,-0.3 0.485 91.3 81.0 -91.4 -9.1 14.9 15.8 42.9 55 56 A F B < S-C 62 0C 50 -3,-1.7 7,-0.3 7,-0.3 -51,-0.1 -0.734 79.9-128.3-100.6 149.5 16.5 15.2 39.5 56 57 A N > - 0 0 39 5,-3.4 4,-2.9 -2,-0.3 3,-0.4 -0.873 16.6-156.0 -92.3 116.6 15.1 15.7 36.1 57 58 A P T 4 S+ 0 0 124 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.812 90.9 54.0 -67.7 -27.6 15.8 12.4 34.3 58 59 A E T 4 S+ 0 0 185 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 0.822 121.2 27.8 -75.7 -32.5 15.7 14.1 30.9 59 60 A T T 4 S- 0 0 74 -3,-0.4 -1,-0.2 2,-0.2 3,-0.1 0.687 92.1-134.7-101.7 -24.0 18.3 16.7 31.7 60 61 A G S < S+ 0 0 54 -4,-2.9 2,-0.1 1,-0.4 3,-0.1 0.282 75.1 102.1 84.8 -11.0 20.4 14.9 34.3 61 62 A T S S- 0 0 75 -5,-0.2 -5,-3.4 1,-0.1 -1,-0.4 -0.373 87.1 -79.1 -96.2 176.2 20.3 18.1 36.4 62 63 A L B -C 55 0C 29 -7,-0.3 -7,-0.3 -2,-0.1 -1,-0.1 -0.493 50.0-115.7 -73.3 145.6 18.1 19.0 39.4 63 64 A R - 0 0 28 -9,-2.4 2,-0.4 -2,-0.1 -1,-0.1 -0.372 49.0 -74.0 -76.6 163.4 14.6 20.0 38.5 64 65 A I - 0 0 65 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 -0.487 59.1-150.0 -61.6 116.3 13.5 23.6 39.3 65 66 A L - 0 0 6 -2,-0.4 18,-0.5 -3,-0.1 2,-0.1 -0.695 6.7-126.4 -94.6 143.3 13.2 23.5 43.1 66 67 A Q >> - 0 0 115 -2,-0.3 4,-2.1 16,-0.1 3,-0.9 -0.408 38.1 -97.1 -77.7 163.7 10.7 25.7 45.0 67 68 A E H 3> S+ 0 0 89 1,-0.3 4,-2.6 2,-0.2 5,-0.4 0.907 125.2 51.2 -50.2 -49.6 12.2 27.8 47.8 68 69 A E H 3> S+ 0 0 122 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.804 110.5 52.6 -59.3 -29.6 11.2 25.3 50.6 69 70 A E H <> S+ 0 0 2 -3,-0.9 4,-0.6 2,-0.2 -2,-0.2 0.937 112.3 39.6 -74.8 -49.6 12.9 22.6 48.5 70 71 A W H ><>S+ 0 0 10 -4,-2.1 5,-1.6 2,-0.2 3,-0.8 0.896 116.6 49.9 -71.4 -33.2 16.3 24.3 48.0 71 72 A R H ><5S+ 0 0 64 -4,-2.6 3,-2.0 -5,-0.3 -1,-0.2 0.918 106.6 59.1 -68.2 -34.7 16.5 25.7 51.5 72 73 A G H 3<5S+ 0 0 26 -4,-1.3 -1,-0.3 -5,-0.4 -2,-0.2 0.699 96.4 61.2 -64.6 -20.9 15.6 22.2 52.7 73 74 A L T <<5S- 0 0 0 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.532 127.5 -97.3 -81.9 -8.4 18.7 20.9 50.9 74 75 A G T < 5S+ 0 0 5 -3,-2.0 2,-0.6 1,-0.3 -3,-0.2 0.488 79.0 141.3 104.8 3.9 20.9 23.1 53.2 75 76 A I < - 0 0 17 -5,-1.6 2,-0.5 -35,-0.0 -1,-0.3 -0.725 31.9-166.9 -81.9 121.3 21.3 26.0 50.8 76 77 A T + 0 0 100 -2,-0.6 2,-0.3 -3,-0.1 -5,-0.0 -0.956 20.5 143.8-117.5 127.0 21.1 29.3 52.7 77 78 A Q - 0 0 30 -2,-0.5 3,-0.1 1,-0.2 -2,-0.0 -0.892 48.3 -91.6-146.5 171.7 20.6 32.6 51.0 78 79 A S - 0 0 72 -2,-0.3 3,-0.4 1,-0.2 -1,-0.2 0.128 62.8 -63.4 -73.0-163.7 18.8 35.9 51.7 79 80 A L S S+ 0 0 152 1,-0.2 -1,-0.2 0, 0.0 0, 0.0 -0.533 106.7 35.6 -89.2 154.1 15.3 36.6 50.5 80 81 A G S S+ 0 0 65 1,-0.3 -1,-0.2 -2,-0.2 2,-0.0 0.038 73.1 135.2 101.6 -26.2 14.0 36.9 46.9 81 82 A W - 0 0 35 -3,-0.4 2,-0.4 -44,-0.0 -1,-0.3 -0.287 30.0-172.9 -62.8 137.8 16.1 34.3 45.1 82 83 A E - 0 0 170 -16,-0.0 2,-0.2 -2,-0.0 -16,-0.1 -0.995 24.6-119.6-132.5 136.5 14.4 31.9 42.7 83 84 A M + 0 0 68 -18,-0.5 2,-0.3 -2,-0.4 -16,-0.1 -0.516 37.8 175.1 -74.7 142.8 16.0 29.0 41.0 84 85 A Y - 0 0 135 -2,-0.2 2,-0.3 -20,-0.0 -19,-0.1 -0.927 17.2-141.2-143.6 165.5 16.2 29.0 37.2 85 86 A E - 0 0 68 -2,-0.3 2,-0.3 -21,-0.0 -22,-0.0 -0.934 19.7-114.4-132.9 154.6 17.6 27.0 34.4 86 87 A V - 0 0 121 -2,-0.3 2,-0.7 1,-0.0 0, 0.0 -0.648 31.4-135.1 -82.6 141.2 19.2 27.6 31.1 87 88 A H - 0 0 147 -2,-0.3 -1,-0.0 0, 0.0 -2,-0.0 -0.888 15.4-159.8-107.9 110.6 17.2 26.4 28.1 88 89 A V - 0 0 125 -2,-0.7 2,-0.0 1,-0.1 -2,-0.0 -0.716 23.8-115.2 -85.8 134.0 19.0 24.4 25.4 89 90 A P - 0 0 52 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.337 34.9 -98.1 -69.0 148.6 17.4 24.2 22.0 90 91 A E > - 0 0 125 1,-0.1 3,-2.5 2,-0.1 0, 0.0 -0.283 45.0 -97.8 -58.3 155.3 16.3 20.8 20.6 91 92 A P T 3 S+ 0 0 129 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.664 121.1 60.3 -53.1 -21.3 18.9 19.2 18.2 92 93 A H T 3 S+ 0 0 136 2,-0.0 2,-0.5 1,-0.0 -2,-0.1 0.476 91.3 80.8 -88.0 -0.3 17.1 20.4 15.1 93 94 A I < - 0 0 78 -3,-2.5 2,-0.4 2,-0.0 -1,-0.0 -0.924 62.5-167.5-110.4 124.4 17.5 24.1 16.1 94 95 A L - 0 0 123 -2,-0.5 2,-0.4 2,-0.0 -4,-0.0 -0.908 9.6-143.9-112.5 141.0 20.8 25.8 15.4 95 96 A L + 0 0 134 -2,-0.4 2,-0.3 -6,-0.1 -2,-0.0 -0.838 19.3 177.4-107.9 137.7 21.8 29.2 16.7 96 97 A F + 0 0 178 -2,-0.4 2,-0.3 2,-0.0 -2,-0.0 -0.939 2.7 176.2-134.6 156.0 23.9 31.7 14.8 97 98 A K - 0 0 208 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.971 7.2-167.0-154.6 158.6 25.2 35.2 15.5 98 99 A R - 0 0 236 -2,-0.3 2,-0.1 0, 0.0 -2,-0.0 -0.988 32.5 -97.8-150.2 148.3 27.3 37.9 13.9 99 100 A E - 0 0 181 -2,-0.3 2,-0.3 1,-0.1 -2,-0.0 -0.407 36.8-127.4 -67.1 138.9 29.0 41.1 15.1 100 101 A K 0 0 202 -2,-0.1 -1,-0.1 1,-0.0 0, 0.0 -0.668 360.0 360.0 -86.2 144.2 27.1 44.3 14.3 101 102 A D 0 0 213 -2,-0.3 -1,-0.0 0, 0.0 0, 0.0 -0.436 360.0 360.0-122.4 360.0 29.0 47.1 12.5