==== 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 LYASE 02-OCT-07 2ZA9 . COMPND 2 MOLECULE: ALGINATE LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SPHINGOMONAS SP.; . AUTHOR K.OGURA,M.YAMASAKI,B.MIKAMI,W.HASHIMOTO,K.MURATA . 227 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9442.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 69.6 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 . 99 43.6 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 . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 . 22 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 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 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 . 2 2 2 1 2 3 0 3 1 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 . 0 0 0 0 0 0 1 0 1 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 81 A P 0 0 185 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 136.4 2.1 12.2 -10.3 2 82 A A - 0 0 76 40,-0.2 40,-0.2 1,-0.1 42,-0.0 -0.029 360.0 -72.9 -47.6 158.2 -0.9 12.8 -7.9 3 83 A A - 0 0 52 1,-0.1 -1,-0.1 2,-0.1 5,-0.1 -0.357 55.8-109.8 -63.9 141.7 -0.6 15.8 -5.5 4 84 A A >> - 0 0 13 -3,-0.1 3,-1.7 1,-0.1 4,-1.4 -0.186 32.8-102.6 -70.6 159.7 1.9 15.3 -2.7 5 85 A P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.817 118.9 57.0 -60.2 -29.1 0.5 14.9 0.9 6 86 A G H 34 S+ 0 0 12 29,-0.4 5,-0.4 25,-0.4 6,-0.1 0.501 107.0 50.8 -79.6 -6.2 1.3 18.5 2.1 7 87 A K H <4 S+ 0 0 133 -3,-1.7 -1,-0.2 28,-0.1 25,-0.1 0.675 115.8 41.6 -89.3 -32.7 -0.8 19.8 -0.8 8 88 A N H < S+ 0 0 83 -4,-1.4 2,-0.3 -5,-0.1 -2,-0.2 0.817 122.0 37.1 -76.6 -39.5 -3.7 17.6 0.1 9 89 A F S < S- 0 0 38 -4,-2.4 2,-1.0 -5,-0.2 -1,-0.1 -0.825 89.1-107.3-115.0 157.9 -3.5 18.0 3.9 10 90 A D + 0 0 121 -2,-0.3 3,-0.2 212,-0.2 -3,-0.1 -0.753 47.2 158.8 -87.7 105.3 -2.7 21.0 6.0 11 91 A L > + 0 0 4 -2,-1.0 3,-1.6 -5,-0.4 21,-0.2 0.052 33.1 117.1-118.0 23.1 0.7 20.1 7.3 12 92 A S T 3 S+ 0 0 53 1,-0.3 -1,-0.2 19,-0.1 16,-0.1 0.709 81.9 46.1 -66.2 -20.7 1.8 23.7 8.1 13 93 A H T 3 S+ 0 0 94 -3,-0.2 59,-2.6 15,-0.1 2,-0.3 -0.122 105.4 71.7-113.8 35.2 2.0 22.6 11.8 14 94 A W E < -A 71 0A 11 -3,-1.6 2,-0.3 57,-0.3 57,-0.2 -0.979 56.0-158.9-139.8 153.1 4.0 19.4 11.3 15 95 A K E -A 70 0A 25 55,-1.9 55,-2.3 -2,-0.3 2,-0.5 -0.852 24.6-125.0-118.4 164.0 7.5 18.3 10.4 16 96 A L E -AB 69 26A 0 10,-2.5 10,-2.0 -2,-0.3 2,-0.4 -0.933 13.1-156.6-118.2 129.4 8.3 14.8 9.1 17 97 A Q E -AB 68 25A 10 51,-2.9 51,-2.5 -2,-0.5 8,-0.2 -0.937 19.1-154.7-107.9 133.8 10.8 12.5 10.5 18 98 A L - 0 0 5 6,-2.5 49,-0.2 -2,-0.4 48,-0.2 -0.563 25.4-135.4-113.8 157.4 12.3 9.8 8.2 19 99 A P + 0 0 2 0, 0.0 38,-1.2 0, 0.0 48,-0.1 -0.008 63.6 124.9-101.4 30.1 13.8 6.4 8.4 20 100 A D S > S- 0 0 26 36,-0.2 3,-1.7 4,-0.2 37,-0.5 -0.228 81.7 -86.0 -72.6 175.3 16.7 7.2 5.9 21 101 A A T 3 S+ 0 0 96 1,-0.3 37,-0.2 35,-0.1 -1,-0.1 0.917 129.9 35.2 -44.6 -58.6 20.4 6.7 6.9 22 102 A N T 3 S- 0 0 120 35,-0.1 -1,-0.3 37,-0.0 -4,-0.0 0.197 109.7-118.7 -93.2 29.4 20.8 10.0 8.5 23 103 A T < - 0 0 34 -3,-1.7 2,-0.1 1,-0.1 -2,-0.1 0.959 41.0-153.7 23.6 82.0 17.2 10.2 9.9 24 104 A T - 0 0 43 -7,-0.1 -6,-2.5 1,-0.0 2,-0.5 -0.418 10.6-148.6 -81.3 152.4 16.2 13.3 8.0 25 105 A E E -B 17 0A 89 -8,-0.2 2,-0.5 -2,-0.1 -8,-0.2 -0.980 5.4-151.0-122.1 119.0 13.5 15.8 9.0 26 106 A I E -B 16 0A 26 -10,-2.0 -10,-2.5 -2,-0.5 5,-0.0 -0.765 22.3-130.9 -89.9 123.9 11.5 17.6 6.4 27 107 A S > - 0 0 47 -2,-0.5 4,-2.0 -12,-0.2 5,-0.1 -0.224 22.9-106.2 -66.6 165.9 10.4 21.0 7.7 28 108 A S H > S+ 0 0 8 47,-0.3 4,-2.4 1,-0.2 5,-0.1 0.885 120.5 58.7 -53.9 -41.6 6.7 22.2 7.4 29 109 A A H > S+ 0 0 71 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.908 107.9 43.2 -59.3 -45.7 7.8 24.6 4.7 30 110 A N H >>S+ 0 0 84 2,-0.2 5,-1.8 1,-0.2 4,-0.6 0.839 110.0 55.8 -71.8 -33.9 9.1 21.8 2.5 31 111 A L H ><5S+ 0 0 0 -4,-2.0 3,-0.9 1,-0.2 -25,-0.4 0.912 108.3 51.0 -59.0 -44.2 6.0 19.6 3.3 32 112 A G H 3<5S+ 0 0 31 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.798 101.0 59.8 -61.6 -37.2 4.0 22.5 2.0 33 113 A L H 3<5S- 0 0 136 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.660 130.6 -92.1 -64.2 -14.0 6.1 22.8 -1.3 34 114 A G T <<5 - 0 0 19 -3,-0.9 -3,-0.2 -4,-0.6 -2,-0.2 0.712 53.5-171.3 104.6 28.1 5.0 19.2 -2.0 35 115 A Y < + 0 0 54 -5,-1.8 -29,-0.4 -31,-0.1 2,-0.3 -0.286 15.6 162.5 -45.0 126.3 7.7 16.9 -0.5 36 116 A T + 0 0 75 -32,-0.1 2,-0.2 -31,-0.1 5,-0.2 -0.982 3.3 151.3-144.8 144.7 7.2 13.3 -1.5 37 117 A S B > -J 40 0B 34 3,-2.4 3,-0.9 -2,-0.3 0, 0.0 -0.831 64.8 -75.2-148.9-168.2 9.5 10.3 -1.4 38 118 A Q T 3 S+ 0 0 119 -2,-0.2 3,-0.1 1,-0.2 13,-0.1 0.735 132.7 51.9 -64.5 -22.2 9.4 6.4 -1.1 39 119 A Y T 3 S+ 0 0 37 1,-0.2 12,-1.0 11,-0.1 2,-0.3 0.641 120.9 23.2 -82.4 -20.4 8.8 7.2 2.6 40 120 A F E < S+JK 37 50B 0 -3,-0.9 -3,-2.4 10,-0.2 2,-0.3 -0.902 77.6 138.1-158.8 110.9 5.9 9.6 2.3 41 121 A Y E - K 0 49B 62 8,-1.7 8,-3.1 -2,-0.3 2,-0.5 -0.968 52.7-102.4-157.3 162.3 3.5 9.8 -0.7 42 122 A T E - K 0 48B 22 -2,-0.3 6,-0.2 6,-0.2 -40,-0.2 -0.852 41.3-146.0 -92.2 123.0 -0.1 10.2 -1.7 43 123 A D > - 0 0 48 4,-2.1 3,-2.7 -2,-0.5 -1,-0.0 -0.364 31.7 -93.1 -87.4 174.1 -1.5 6.8 -2.7 44 124 A T T 3 S+ 0 0 144 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.770 127.3 54.9 -64.9 -25.8 -4.1 6.2 -5.4 45 125 A D T 3 S- 0 0 74 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.204 121.9-107.6 -83.4 9.1 -6.9 6.4 -2.9 46 126 A G < + 0 0 34 -3,-2.7 -2,-0.1 1,-0.2 -38,-0.0 0.272 69.7 147.4 84.4 -14.2 -5.6 9.9 -1.8 47 127 A A - 0 0 0 -5,-0.1 -4,-2.1 1,-0.1 2,-0.8 -0.226 56.2-120.0 -60.4 143.7 -4.2 8.6 1.6 48 128 A M E -KL 42 219B 0 171,-2.8 171,-1.8 -6,-0.2 2,-0.3 -0.784 45.3-160.0 -75.0 109.8 -1.1 10.2 3.1 49 129 A T E -KL 41 218B 0 -8,-3.1 -8,-1.7 -2,-0.8 2,-0.4 -0.852 18.1-157.4-111.4 136.0 1.2 7.0 3.3 50 130 A F E -KL 40 217B 0 167,-2.4 167,-1.9 -2,-0.3 2,-0.5 -0.960 5.7-175.8 -97.9 130.3 4.7 5.8 5.4 51 131 A W E + L 0 216B 59 -12,-1.0 165,-0.2 -2,-0.4 152,-0.1 -0.950 12.0 169.4-115.5 130.4 6.7 3.4 4.2 52 132 A A E - L 0 215B 0 163,-1.8 163,-2.6 -2,-0.5 2,-0.2 -0.954 22.4-144.1-137.3 131.7 9.5 2.6 6.7 53 133 A P E > - L 0 214B 16 0, 0.0 3,-1.5 0, 0.0 161,-0.3 -0.632 20.0-126.9 -86.7 150.3 11.9 -0.3 6.6 54 134 A T T 3 S+ 0 0 3 159,-2.0 160,-0.1 1,-0.3 157,-0.1 0.728 111.3 58.3 -68.7 -20.8 13.1 -2.1 9.8 55 135 A T T 3 S+ 0 0 99 158,-0.4 -1,-0.3 155,-0.1 3,-0.1 0.227 87.4 116.3 -89.5 9.7 16.8 -1.5 8.5 56 136 A G S < S- 0 0 18 -3,-1.5 -36,-0.2 1,-0.2 -35,-0.1 -0.138 75.6 -73.1 -75.7-179.6 16.2 2.3 8.5 57 137 A G - 0 0 10 -38,-1.2 9,-0.5 -37,-0.5 2,-0.4 -0.393 41.5-164.2 -77.5 146.4 17.9 4.9 10.5 58 138 A T - 0 0 68 -37,-0.2 2,-0.2 7,-0.2 5,-0.0 -0.999 11.2-145.1-131.0 135.9 17.1 5.4 14.2 59 139 A T > - 0 0 39 -2,-0.4 3,-1.4 5,-0.3 5,-0.1 -0.470 34.4 -77.5-102.2 173.7 18.0 8.5 16.2 60 140 A A T 3 S+ 0 0 109 1,-0.3 -1,-0.0 -2,-0.2 -2,-0.0 0.595 124.5 34.0 -36.3 -43.5 19.1 9.4 19.7 61 141 A a T 3 S+ 0 0 67 2,-0.0 2,-0.3 58,-0.0 -1,-0.3 -0.260 109.5 68.9-118.7 52.0 15.8 9.2 21.4 62 142 A S < - 0 0 21 -3,-1.4 4,-0.1 1,-0.0 -4,-0.0 -0.930 56.2-160.2-161.8 131.9 14.1 6.3 19.5 63 143 A S S S+ 0 0 80 -2,-0.3 -5,-0.1 2,-0.1 -3,-0.0 0.700 80.7 48.0 -89.6 -17.3 15.1 2.6 19.5 64 144 A Y S S- 0 0 67 1,-0.1 -5,-0.3 -5,-0.1 142,-0.1 -0.829 88.1 -99.0-127.5 155.8 13.3 2.1 16.1 65 145 A P - 0 0 0 0, 0.0 140,-1.7 0, 0.0 2,-0.3 -0.272 41.6-173.2 -73.0 155.4 13.0 3.7 12.6 66 146 A R E - C 0 204A 23 -9,-0.5 2,-0.4 138,-0.2 138,-0.2 -0.995 36.5-163.8-148.7 150.4 10.1 5.9 11.7 67 147 A S E + C 0 203A 0 136,-2.4 136,-2.5 -2,-0.3 2,-0.4 -0.903 55.2 145.0-123.8 100.0 8.3 7.8 8.9 68 148 A E E -AC 17 202A 0 -51,-2.5 -51,-2.9 -2,-0.4 134,-0.3 -0.994 52.1-120.2-151.8 139.1 6.3 10.0 11.2 69 149 A L E -AC 16 201A 0 132,-2.9 132,-1.1 -2,-0.4 2,-0.4 -0.562 22.6-160.3 -80.0 139.9 4.7 13.4 11.7 70 150 A R E -AC 15 200A 7 -55,-2.3 -55,-1.9 -2,-0.2 130,-0.2 -0.992 25.6-114.9-123.4 123.2 5.8 15.5 14.7 71 151 A E E -A 14 0A 6 128,-3.0 2,-0.5 -2,-0.4 -57,-0.3 -0.348 27.1-168.1 -65.1 132.5 3.5 18.4 15.8 72 152 A M + 0 0 8 -59,-2.6 9,-0.1 1,-0.2 6,-0.1 -0.836 15.4 179.1-122.1 89.0 5.0 21.8 15.5 73 153 A L S S+ 0 0 55 7,-0.7 -1,-0.2 -2,-0.5 8,-0.1 0.943 94.4 32.6 -44.9 -46.5 3.0 24.5 17.2 74 154 A D S > S- 0 0 50 6,-0.6 3,-2.2 3,-0.5 -1,-0.3 -0.937 82.1-154.1-113.4 106.9 5.8 26.8 16.0 75 155 A P T 3 S+ 0 0 60 0, 0.0 -47,-0.3 0, 0.0 3,-0.1 0.808 95.9 45.1 -53.7 -24.4 7.1 25.5 12.6 76 156 A S T 3 S+ 0 0 111 1,-0.2 2,-0.2 -3,-0.1 -3,-0.0 0.299 113.9 48.4-100.2 7.2 10.5 27.2 13.3 77 157 A N X - 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