==== 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 2ZAC . COMPND 2 MOLECULE: ALGINATE LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SPHINGOMONAS SP.; . AUTHOR K.OGURA,M.YAMASAKI,B.MIKAMI,W.HASHIMOTO,K.MURATA . 227 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9508.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 70.5 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 . 102 44.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 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 . 20 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 3.1 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 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 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 . 3 2 2 1 1 4 1 2 0 1 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 0 187 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 12.7 -16.6 16.2 25.6 2 82 A A - 0 0 72 40,-0.2 40,-0.2 1,-0.1 2,-0.1 -0.133 360.0 -86.2 -56.0 155.8 -16.9 14.4 22.2 3 83 A A - 0 0 49 1,-0.1 -1,-0.1 2,-0.1 31,-0.1 -0.395 49.7-104.1 -66.5 145.4 -16.7 10.6 22.1 4 84 A A >> - 0 0 13 -3,-0.1 3,-2.3 1,-0.1 4,-0.5 -0.232 35.3-100.9 -68.6 158.3 -13.2 9.1 21.9 5 85 A P H >> S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 3,-1.6 0.816 118.2 65.7 -55.0 -34.4 -12.0 7.7 18.6 6 86 A G H 34 S+ 0 0 12 25,-0.4 5,-0.4 29,-0.4 6,-0.1 0.616 101.0 51.9 -63.9 -13.3 -12.6 4.1 19.6 7 87 A K H <4 S+ 0 0 121 -3,-2.3 -1,-0.3 3,-0.1 3,-0.1 0.573 116.0 39.7 -91.0 -15.6 -16.3 4.9 19.7 8 88 A N H << S+ 0 0 88 -3,-1.6 2,-0.3 -4,-0.5 -2,-0.2 0.558 117.9 43.1-110.4 -16.6 -16.3 6.4 16.2 9 89 A F S < S- 0 0 24 -4,-1.8 2,-1.3 212,-0.1 -1,-0.1 -0.937 88.1-107.5-128.4 152.7 -14.0 4.0 14.4 10 90 A D + 0 0 114 212,-0.4 3,-0.3 -2,-0.3 -3,-0.1 -0.702 48.0 159.6 -81.4 97.8 -13.7 0.2 14.4 11 91 A L > + 0 0 5 -2,-1.3 3,-1.6 -5,-0.4 21,-0.2 0.152 36.3 112.4-105.8 19.9 -10.5 -0.2 16.4 12 92 A S T 3 S+ 0 0 53 1,-0.3 -1,-0.2 19,-0.1 16,-0.1 0.722 86.8 37.3 -65.3 -21.5 -11.3 -3.8 17.4 13 93 A H T 3 S+ 0 0 89 -3,-0.3 59,-2.7 15,-0.1 2,-0.3 -0.125 106.4 79.3-124.3 37.5 -8.3 -4.9 15.3 14 94 A W E < -A 71 0A 9 -3,-1.6 2,-0.3 57,-0.3 57,-0.2 -0.987 55.0-160.6-132.9 147.1 -5.9 -2.1 15.9 15 95 A K E -A 70 0A 26 55,-2.4 55,-2.8 -2,-0.3 2,-0.5 -0.885 23.1-125.5-114.8 159.3 -3.5 -1.3 18.7 16 96 A L E -AB 69 26A 0 10,-2.4 10,-2.5 -2,-0.3 2,-0.4 -0.918 14.0-158.2-110.6 127.7 -2.1 2.2 19.2 17 97 A Q E -AB 68 25A 18 51,-2.8 51,-2.3 -2,-0.5 8,-0.2 -0.894 19.4-154.7-104.7 130.0 1.6 2.9 19.5 18 98 A L - 0 0 7 6,-2.3 49,-0.2 -2,-0.4 48,-0.1 -0.647 23.4-134.6-113.1 158.9 2.5 6.1 21.3 19 99 A P + 0 0 2 0, 0.0 38,-1.8 0, 0.0 48,-0.1 0.087 61.9 125.0 -98.6 19.7 5.4 8.6 21.3 20 100 A D S > S- 0 0 30 36,-0.2 3,-2.1 4,-0.2 37,-0.2 -0.251 83.4 -92.1 -65.9 170.5 5.7 9.0 25.1 21 101 A A T 3 S+ 0 0 90 1,-0.3 37,-0.2 35,-0.1 -1,-0.1 0.826 129.3 42.5 -56.0 -33.6 9.2 8.3 26.6 22 102 A N T 3 S- 0 0 138 35,-0.1 -1,-0.3 37,-0.0 -4,-0.1 0.248 106.9-124.9 -99.1 10.5 8.3 4.6 27.1 23 103 A T < - 0 0 41 -3,-2.1 -2,-0.1 1,-0.1 33,-0.0 0.901 38.2-158.8 41.8 56.5 6.5 4.1 23.7 24 104 A T - 0 0 59 -7,-0.1 -6,-2.3 1,-0.1 2,-0.4 -0.228 6.0-144.7 -62.9 148.4 3.4 2.9 25.4 25 105 A E E -B 17 0A 88 -8,-0.2 2,-0.5 -10,-0.0 -8,-0.2 -0.951 2.1-148.5-118.8 139.8 0.9 0.8 23.5 26 106 A I E -B 16 0A 19 -10,-2.5 -10,-2.4 -2,-0.4 5,-0.0 -0.932 22.5-125.7-109.7 127.1 -2.9 0.9 24.0 27 107 A S > - 0 0 51 -2,-0.5 4,-2.3 -12,-0.2 5,-0.2 -0.200 20.8-111.4 -68.4 160.4 -4.8 -2.3 23.4 28 108 A S H > S+ 0 0 10 47,-0.3 4,-2.3 1,-0.2 5,-0.2 0.904 119.4 52.5 -54.5 -45.2 -7.8 -2.7 21.0 29 109 A A H > S+ 0 0 70 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.909 109.3 47.6 -61.1 -44.5 -10.0 -3.2 24.0 30 110 A N H 4>S+ 0 0 88 2,-0.2 5,-1.9 1,-0.2 4,-0.5 0.831 109.3 54.1 -69.5 -31.1 -8.9 -0.0 25.7 31 111 A L H ><5S+ 0 0 0 -4,-2.3 3,-1.2 3,-0.2 -25,-0.4 0.937 109.7 48.0 -61.2 -44.8 -9.3 1.9 22.5 32 112 A G H 3<5S+ 0 0 29 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.815 105.1 59.4 -66.4 -30.3 -12.9 0.7 22.3 33 113 A L T 3<5S- 0 0 130 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.592 130.3 -91.3 -74.7 -13.5 -13.4 1.6 25.9 34 114 A G T < 5 - 0 0 21 -3,-1.2 -3,-0.2 -4,-0.5 -2,-0.2 0.698 53.5-177.5 113.2 24.3 -12.6 5.2 25.0 35 115 A Y < + 0 0 54 -5,-1.9 -29,-0.4 -31,-0.1 2,-0.3 -0.263 13.9 163.6 -49.9 132.7 -8.8 5.8 25.5 36 116 A T + 0 0 78 -32,-0.1 2,-0.3 -31,-0.1 5,-0.2 -0.980 3.6 147.3-152.0 148.6 -7.9 9.4 24.7 37 117 A S B > -J 40 0B 33 3,-2.5 3,-1.3 -2,-0.3 -2,-0.0 -0.921 64.9 -71.4-161.6-176.9 -4.8 11.6 25.4 38 118 A Q T 3 S+ 0 0 120 -2,-0.3 3,-0.1 1,-0.3 13,-0.0 0.707 131.7 49.7 -58.8 -21.2 -2.7 14.4 24.0 39 119 A Y T 3 S+ 0 0 35 1,-0.3 12,-1.8 11,-0.1 2,-0.3 0.595 121.7 24.5 -91.7 -15.0 -1.5 11.9 21.5 40 120 A F E < S+JK 37 50B 0 -3,-1.3 -3,-2.5 10,-0.2 2,-0.3 -0.878 77.5 131.2-161.8 108.8 -4.8 10.6 20.3 41 121 A Y E - K 0 49B 62 8,-2.1 8,-3.0 -2,-0.3 2,-0.6 -0.969 54.9 -96.2-158.0 166.1 -8.2 12.3 20.5 42 122 A T E - K 0 48B 22 -2,-0.3 6,-0.2 6,-0.2 -40,-0.2 -0.855 42.8-147.9 -92.0 123.7 -11.4 13.2 18.7 43 123 A D > - 0 0 44 4,-2.1 3,-2.3 -2,-0.6 -1,-0.0 -0.261 33.7 -89.7 -84.9 179.1 -11.1 16.8 17.4 44 124 A T T 3 S+ 0 0 144 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.757 128.4 54.5 -63.0 -26.4 -14.0 19.3 17.0 45 125 A D T 3 S- 0 0 69 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.316 121.1-107.1 -87.9 7.3 -14.7 18.0 13.5 46 126 A G S < S+ 0 0 32 -3,-2.3 -2,-0.1 1,-0.3 2,-0.0 0.371 70.1 148.3 84.9 -4.6 -15.0 14.4 14.8 47 127 A A - 0 0 0 1,-0.1 -4,-2.1 -5,-0.1 2,-0.7 -0.334 57.0-118.4 -66.7 142.6 -11.6 13.3 13.3 48 128 A M E -KL 42 219B 0 171,-2.5 171,-2.4 -6,-0.2 2,-0.5 -0.759 44.5-157.6 -73.9 117.0 -9.4 10.6 14.9 49 129 A T E -KL 41 218B 0 -8,-3.0 -8,-2.1 -2,-0.7 2,-0.5 -0.901 16.3-162.7-118.6 127.9 -6.5 12.9 15.6 50 130 A F E -KL 40 217B 1 167,-3.1 167,-2.1 -2,-0.5 2,-0.4 -0.939 8.9-177.1-113.9 120.8 -2.9 11.8 16.1 51 131 A W E + L 0 216B 57 -12,-1.8 165,-0.2 -2,-0.5 152,-0.1 -0.961 6.2 169.2-118.8 133.3 -0.3 14.2 17.7 52 132 A A E - L 0 215B 0 163,-1.8 163,-2.2 -2,-0.4 2,-0.2 -0.980 24.1-138.7-144.2 132.7 3.4 13.4 18.2 53 133 A P E > - L 0 214B 18 0, 0.0 3,-1.9 0, 0.0 161,-0.3 -0.605 22.9-124.5 -84.1 149.9 6.3 15.6 19.2 54 134 A T T 3 S+ 0 0 3 159,-2.5 160,-0.1 1,-0.3 157,-0.1 0.701 112.5 59.5 -65.8 -17.9 9.7 15.2 17.5 55 135 A T T 3 S+ 0 0 97 158,-0.4 -1,-0.3 155,-0.1 3,-0.1 0.351 84.7 124.2 -88.0 2.6 11.2 14.7 21.0 56 136 A G S < S- 0 0 15 -3,-1.9 -36,-0.2 1,-0.1 -35,-0.1 -0.052 71.6 -86.0 -65.1 163.7 9.0 11.6 21.6 57 137 A G - 0 0 13 -38,-1.8 9,-0.5 -37,-0.2 2,-0.3 -0.332 45.1-144.6 -62.8 151.3 10.1 8.1 22.4 58 138 A T B -Q 65 0C 58 -37,-0.2 5,-0.1 7,-0.2 -1,-0.0 -0.926 13.9-108.1-124.3 149.0 11.0 5.9 19.5 59 139 A T > - 0 0 36 5,-0.5 3,-1.7 -2,-0.3 -36,-0.1 -0.178 45.7 -91.8 -67.9 168.0 10.6 2.1 18.9 60 140 A A T 3 S+ 0 0 101 1,-0.3 -1,-0.1 3,-0.0 -2,-0.0 0.731 122.6 32.5 -55.6 -31.7 13.6 -0.2 18.9 61 141 A N T 3 S+ 0 0 125 2,-0.0 2,-0.4 0, 0.0 -1,-0.3 0.065 107.0 77.4-120.6 23.0 14.3 0.0 15.2 62 142 A S < - 0 0 24 -3,-1.7 -4,-0.0 1,-0.1 0, 0.0 -0.983 55.8-156.6-129.0 146.8 13.3 3.6 14.4 63 143 A S S S+ 0 0 59 -2,-0.4 -1,-0.1 -5,-0.1 -3,-0.0 0.443 78.9 77.3 -85.2 -4.2 14.9 6.9 14.9 64 144 A Y S S- 0 0 73 -5,-0.0 -5,-0.5 142,-0.0 144,-0.1 -0.862 75.2-126.1-121.7 143.1 11.5 8.6 14.7 65 145 A P B -Q 58 0C 1 0, 0.0 140,-2.2 0, 0.0 2,-0.3 -0.398 28.7-170.6 -82.2 159.1 8.5 8.9 17.1 66 146 A R E - C 0 204A 16 -9,-0.5 2,-0.4 138,-0.2 138,-0.2 -0.997 34.9-163.3-147.3 150.5 4.9 8.0 16.2 67 147 A S E + C 0 203A 0 136,-2.6 136,-2.2 -2,-0.3 2,-0.3 -0.928 54.6 145.1-122.4 103.2 1.3 8.1 17.3 68 148 A E E -AC 17 202A 0 -51,-2.3 -51,-2.8 -2,-0.4 134,-0.3 -0.999 51.3-120.8-151.9 137.3 0.2 5.3 15.0 69 149 A L E -AC 16 201A 0 132,-3.0 132,-1.6 -2,-0.3 2,-0.4 -0.581 22.4-157.4 -80.8 144.4 -2.3 2.4 14.8 70 150 A R E -AC 15 200A 8 -55,-2.8 -55,-2.4 -2,-0.2 130,-0.2 -0.993 23.4-117.6-125.4 119.4 -0.8 -1.0 14.2 71 151 A E E -A 14 0A 6 128,-2.9 2,-0.5 -2,-0.4 -57,-0.3 -0.384 26.0-167.2 -65.6 133.6 -3.2 -3.7 12.6 72 152 A M - 0 0 10 -59,-2.7 9,-0.1 1,-0.1 6,-0.1 -0.870 16.1-177.5-124.7 93.7 -3.9 -6.7 14.8 73 153 A L S S+ 0 0 58 7,-0.7 -1,-0.1 -2,-0.5 8,-0.1 0.902 97.0 30.2 -51.6 -41.1 -5.6 -9.6 13.0 74 154 A D S > S- 0 0 55 6,-0.5 3,-2.4 3,-0.4 -1,-0.3 -0.952 79.2-158.1-118.4 106.9 -5.5 -11.1 16.5 75 155 A P T 3 S+ 0 0 59 0, 0.0 -47,-0.3 0, 0.0 3,-0.2 0.671 95.2 50.7 -58.3 -16.7 -5.8 -8.3 19.1 76 156 A S T 3 S+ 0 0 104 1,-0.2 2,-0.2 -49,-0.1 -3,-0.0 0.298 114.6 40.9-101.7 2.9 -4.2 -10.8 21.6 77 157 A N X - 0 0 66 -3,-2.4 3,-1.8 3,-0.1 -3,-0.4 -0.693 54.6-170.6-154.8 102.4 -1.3 -11.8 19.5 78 158 A S T 3 S+ 0 0 42 1,-0.3 -5,-0.1 -2,-0.2 39,-0.1 0.545 84.1 74.1 -69.0 -6.1 0.8 -9.4 17.3 79 159 A K T 3 S+ 0 0 128 37,-0.1 2,-0.7 -5,-0.1 -1,-0.3 0.495 74.6 91.6 -84.7 -4.9 2.6 -12.4 15.7 80 160 A V < + 0 0 58 -3,-1.8 -7,-0.7 -6,-0.2 -6,-0.5 -0.837 58.0 150.2 -93.8 111.2 -0.6 -13.2 13.7 81 161 A N - 0 0 14 -2,-0.7 117,-0.2 -8,-0.1 2,-0.2 -0.826 41.3 -98.2-140.0 169.1 -0.2 -11.3 10.4 82 162 A W B -D 197 0A 10 115,-2.3 115,-2.5 -2,-0.3 2,-0.1 -0.524 30.6-133.6 -98.2 164.1 -1.3 -11.7 6.7 83 163 A G - 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