==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 19-MAY-10 3N36 . COMPND 2 MOLECULE: LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ERYTHRINA CORALLODENDRON; . AUTHOR S.THAMOTHARAN,T.KARTHIKEYAN,K.A.KULKARNI,K.N.SHETTY,A.SUROLI . 242 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11168.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 64.0 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 . 101 41.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 21 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 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 4 0 1 2 2 3 1 2 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 2 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 V 0 0 100 0, 0.0 2,-0.7 0, 0.0 235,-0.0 0.000 360.0 360.0 360.0 116.8 -50.2 8.7 12.5 2 2 A E E -A 237 0A 75 235,-2.6 235,-2.5 56,-0.0 2,-0.3 -0.773 360.0-177.2 -86.3 115.2 -49.2 5.4 14.1 3 3 A T E -A 236 0A 93 -2,-0.7 2,-0.3 233,-0.2 233,-0.2 -0.892 18.1-176.4-121.2 150.2 -45.7 4.6 12.7 4 4 A I E +A 235 0A 42 231,-1.9 231,-2.2 -2,-0.3 2,-0.3 -0.955 13.0 164.0-135.6 151.1 -43.3 1.8 13.1 5 5 A S E +A 234 0A 81 -2,-0.3 2,-0.3 229,-0.2 229,-0.2 -0.929 11.3 176.3-170.2 145.3 -39.8 1.4 11.6 6 6 A F E -A 233 0A 19 227,-2.0 227,-2.5 -2,-0.3 2,-0.3 -0.977 7.3-166.1-149.2 155.2 -36.6 -0.5 11.9 7 7 A S E -A 232 0A 92 -2,-0.3 2,-0.6 225,-0.2 225,-0.3 -0.912 5.3-173.8-151.1 117.9 -33.3 -0.6 10.0 8 8 A F E +A 231 0A 18 223,-3.0 223,-1.9 -2,-0.3 3,-0.1 -0.904 8.3 174.3-115.2 100.7 -30.6 -3.2 10.2 9 9 A S S S+ 0 0 111 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.640 85.0 7.4 -75.9 -12.7 -27.6 -2.0 8.2 10 10 A E S S- 0 0 127 221,-0.1 2,-0.4 -3,-0.1 -1,-0.2 -0.964 83.1-115.5-160.0 156.6 -26.1 -5.2 9.7 11 11 A F - 0 0 6 19,-1.6 -3,-0.0 -2,-0.3 219,-0.0 -0.834 23.6-159.5-104.3 141.6 -27.3 -8.1 11.7 12 12 A E > - 0 0 126 -2,-0.4 3,-1.8 17,-0.0 16,-0.1 -0.977 22.0-118.8-122.4 129.5 -26.1 -8.8 15.2 13 13 A P T 3 S+ 0 0 66 0, 0.0 3,-0.1 0, 0.0 14,-0.0 -0.380 101.2 24.6 -62.8 138.3 -26.3 -12.2 17.0 14 14 A G T 3 S+ 0 0 79 1,-0.3 2,-0.5 4,-0.1 0, 0.0 0.369 78.8 149.0 89.7 -7.3 -28.5 -11.9 20.1 15 15 A N X - 0 0 37 -3,-1.8 3,-1.4 1,-0.2 -1,-0.3 -0.500 36.5-156.4 -64.4 114.5 -30.5 -8.9 18.9 16 16 A D T 3 S+ 0 0 135 -2,-0.5 -1,-0.2 1,-0.3 -2,-0.0 0.395 81.7 79.6 -76.4 5.2 -33.9 -9.3 20.6 17 17 A N T 3 S+ 0 0 67 36,-0.1 37,-3.4 37,-0.1 2,-0.4 0.600 90.3 64.8 -84.0 -10.6 -35.6 -7.2 17.9 18 18 A L E < -H 53 0B 16 -3,-1.4 2,-0.6 35,-0.2 35,-0.2 -0.927 68.4-152.5-117.9 137.2 -35.6 -10.3 15.6 19 19 A T E -H 52 0B 62 33,-3.5 33,-2.7 -2,-0.4 2,-0.3 -0.920 16.3-157.7-108.6 112.9 -37.2 -13.7 16.0 20 20 A L E -H 51 0B 72 -2,-0.6 2,-0.3 31,-0.2 31,-0.2 -0.681 11.4-175.3 -90.1 140.8 -35.4 -16.5 14.3 21 21 A Q E > -H 50 0B 24 29,-2.8 29,-2.4 -2,-0.3 3,-1.4 -0.980 48.5 -13.3-136.1 148.7 -37.2 -19.7 13.3 22 22 A G E 3 S-H 49 0B 69 -2,-0.3 27,-0.3 1,-0.2 13,-0.1 -0.388 126.1 -16.5 65.9-137.0 -36.0 -23.0 11.7 23 23 A A T 3 S+ 0 0 33 25,-2.5 -1,-0.2 11,-0.2 26,-0.2 0.508 95.4 128.8 -81.8 -5.7 -32.5 -22.9 10.3 24 24 A S < + 0 0 10 -3,-1.4 2,-0.3 24,-0.2 10,-0.2 -0.275 32.9 171.4 -57.0 130.8 -32.1 -19.2 10.2 25 25 A L E -B 33 0A 92 8,-2.4 8,-3.4 10,-0.1 2,-0.6 -0.996 32.0-134.6-144.4 145.1 -28.9 -18.0 11.8 26 26 A I E -B 32 0A 13 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.905 27.9-141.7-102.2 121.6 -27.0 -14.8 12.2 27 27 A T > - 0 0 23 4,-2.8 3,-1.7 -2,-0.6 -16,-0.1 -0.328 22.4-114.1 -78.0 164.0 -23.3 -15.3 11.6 28 28 A Q T 3 S+ 0 0 198 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.734 117.4 66.5 -68.1 -22.0 -20.6 -13.5 13.5 29 29 A S T 3 S- 0 0 89 2,-0.1 -1,-0.3 1,-0.0 -18,-0.1 0.427 122.7-107.1 -78.8 2.3 -19.7 -11.7 10.3 30 30 A G S < S+ 0 0 6 -3,-1.7 -19,-1.6 1,-0.3 2,-0.4 0.647 74.5 135.0 83.7 17.8 -23.2 -10.1 10.5 31 31 A V - 0 0 24 -21,-0.1 -4,-2.8 2,-0.0 2,-0.8 -0.809 52.0-135.2-103.3 138.8 -25.0 -12.0 7.8 32 32 A L E -BC 26 228A 0 196,-2.6 196,-2.7 -2,-0.4 2,-0.8 -0.827 19.0-165.0 -91.8 112.8 -28.5 -13.4 8.2 33 33 A Q E -BC 25 227A 36 -8,-3.4 -8,-2.4 -2,-0.8 194,-0.2 -0.866 6.7-174.0-101.2 103.5 -28.4 -17.0 6.8 34 34 A L S S+ 0 0 0 192,-2.1 2,-0.4 -2,-0.8 180,-0.2 0.867 72.0 37.8 -64.4 -39.8 -32.0 -18.1 6.2 35 35 A T S S- 0 0 1 191,-0.3 191,-0.3 180,-0.1 -10,-0.1 -0.913 98.1 -93.5-118.0 146.5 -31.2 -21.6 5.3 36 36 A K - 0 0 119 -2,-0.4 8,-2.4 7,-0.1 2,-0.5 -0.101 26.5-157.6 -58.4 147.1 -28.4 -23.8 6.7 37 37 A I B -O 43 0C 41 6,-0.3 4,-0.1 -4,-0.1 -1,-0.1 -0.987 22.6-126.5-127.7 116.7 -24.9 -24.2 5.3 38 38 A N > - 0 0 61 4,-2.0 3,-3.0 -2,-0.5 4,-0.2 -0.165 27.9-101.6 -63.5 157.6 -23.0 -27.3 6.2 39 39 A Q T 3 S+ 0 0 207 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.759 120.6 65.8 -49.2 -33.8 -19.6 -27.3 7.7 40 40 A N T 3 S- 0 0 122 2,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.490 119.9-111.2 -70.5 -0.4 -18.0 -28.1 4.4 41 41 A G S < S+ 0 0 45 -3,-3.0 -2,-0.2 1,-0.3 -1,-0.1 0.550 79.7 119.7 84.2 7.8 -19.3 -24.7 3.4 42 42 A M S S- 0 0 57 -4,-0.2 -4,-2.0 1,-0.1 -1,-0.3 -0.814 71.1 -96.2-106.5 146.7 -22.0 -25.9 0.9 43 43 A P B -O 37 0C 5 0, 0.0 2,-0.3 0, 0.0 -6,-0.3 -0.309 38.3-127.2 -61.8 139.7 -25.7 -25.1 1.3 44 44 A A - 0 0 9 -8,-2.4 3,-0.4 180,-0.1 180,-0.3 -0.628 17.1-131.3 -89.2 145.3 -27.8 -27.8 2.9 45 45 A W S S+ 0 0 89 -2,-0.3 173,-0.2 1,-0.2 178,-0.1 -0.460 85.0 34.1 -90.6 165.9 -30.9 -29.2 1.3 46 46 A D S S+ 0 0 110 171,-3.2 2,-0.4 176,-0.4 -1,-0.2 0.817 86.7 143.7 61.8 31.7 -34.3 -29.7 3.0 47 47 A S - 0 0 12 -3,-0.4 169,-2.4 170,-0.2 2,-0.4 -0.872 28.6-177.0-109.0 135.5 -33.7 -26.5 5.0 48 48 A T E + I 0 215B 34 -2,-0.4 -25,-2.5 167,-0.2 2,-0.3 -0.996 8.8 170.1-131.8 127.7 -36.3 -24.0 6.0 49 49 A G E -HI 22 214B 0 165,-2.4 165,-2.9 -2,-0.4 2,-0.3 -0.991 7.4-178.4-140.9 148.1 -35.6 -20.7 7.9 50 50 A R E -HI 21 213B 4 -29,-2.4 -29,-2.8 -2,-0.3 2,-0.4 -0.961 11.4-160.3-141.9 158.6 -37.4 -17.6 8.8 51 51 A T E -HI 20 212B 0 161,-2.4 161,-2.3 -2,-0.3 2,-0.3 -0.979 13.7-172.0-141.7 125.8 -36.8 -14.3 10.6 52 52 A L E -HI 19 211B 6 -33,-2.7 -33,-3.5 -2,-0.4 2,-0.4 -0.904 32.4-109.0-120.3 147.7 -39.6 -12.1 12.0 53 53 A Y E -H 18 0B 19 157,-2.4 157,-0.3 -2,-0.3 -35,-0.2 -0.614 35.6-125.4 -71.7 130.5 -39.5 -8.6 13.4 54 54 A A S S+ 0 0 43 -37,-3.4 -1,-0.1 -2,-0.4 -36,-0.1 0.580 88.5 62.1 -55.8 -13.4 -40.2 -9.2 17.2 55 55 A K S S- 0 0 116 -38,-0.3 155,-0.3 155,-0.1 -2,-0.1 -0.934 84.4-116.7-121.4 142.8 -43.2 -6.8 17.2 56 56 A P - 0 0 57 0, 0.0 2,-0.4 0, 0.0 153,-0.2 -0.312 28.0-132.3 -69.7 155.6 -46.5 -6.9 15.3 57 57 A V E -J 208 0B 1 151,-3.0 151,-2.3 -4,-0.1 2,-0.9 -0.909 7.6-131.9-113.0 136.8 -47.3 -4.1 12.8 58 58 A H E +J 207 0B 22 -2,-0.4 149,-0.2 149,-0.2 3,-0.1 -0.784 34.9 166.3 -87.5 109.2 -50.6 -2.2 12.7 59 59 A I + 0 0 0 147,-2.6 9,-3.5 -2,-0.9 2,-0.3 0.758 61.0 1.9 -98.4 -29.2 -51.5 -2.4 9.0 60 60 A W E -P 67 0D 35 146,-1.2 2,-0.5 7,-0.3 -1,-0.3 -0.981 60.6-140.7-154.9 157.4 -55.2 -1.3 9.0 61 61 A D E >> -P 66 0D 32 5,-2.8 4,-2.3 -2,-0.3 5,-0.8 -0.955 1.6-162.2-128.7 113.7 -57.7 -0.1 11.5 62 62 A M T 45S+ 0 0 125 -2,-0.5 -1,-0.1 1,-0.2 5,-0.0 0.895 88.5 56.4 -61.0 -43.1 -61.4 -1.2 11.4 63 63 A T T 45S+ 0 0 133 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.944 122.4 23.7 -55.7 -54.6 -62.7 1.5 13.6 64 64 A T T 45S- 0 0 47 2,-0.1 -1,-0.2 175,-0.1 -2,-0.2 0.695 101.4-128.9 -86.6 -19.3 -61.4 4.5 11.6 65 65 A G T <5 + 0 0 37 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.698 55.9 148.1 79.4 20.0 -61.2 2.6 8.4 66 66 A T E < -P 61 0D 8 -5,-0.8 -5,-2.8 173,-0.1 2,-0.4 -0.655 33.4-157.7 -92.5 145.9 -57.6 3.6 7.7 67 67 A V E -P 60 0D 26 -2,-0.3 -7,-0.3 -7,-0.2 2,-0.1 -0.952 19.1-123.8-120.5 138.9 -55.0 1.5 5.9 68 68 A A - 0 0 0 -9,-3.5 2,-0.3 -2,-0.4 169,-0.2 -0.427 11.6-140.4 -82.4 155.8 -51.3 1.9 6.3 69 69 A S E -D 236 0A 44 167,-2.2 167,-2.5 104,-0.1 2,-0.3 -0.819 30.0-178.1-106.4 152.2 -48.8 2.6 3.6 70 70 A F E -DE 235 172A 8 102,-1.9 102,-3.2 -2,-0.3 2,-0.3 -0.990 22.1-164.4-154.2 163.2 -45.4 0.9 3.8 71 71 A E E -DE 234 171A 23 163,-2.2 163,-1.9 -2,-0.3 2,-0.4 -0.993 6.7-175.5-149.1 139.5 -42.0 0.3 2.4 72 72 A T E -DE 233 170A 0 98,-2.5 98,-2.9 -2,-0.3 2,-0.4 -0.997 0.9-174.0-138.7 142.9 -39.3 -2.3 2.9 73 73 A R E +DE 232 169A 122 159,-1.9 159,-2.7 -2,-0.4 2,-0.3 -0.997 11.6 161.1-136.7 139.7 -35.8 -2.6 1.5 74 74 A F E -DE 231 168A 4 94,-1.5 94,-2.4 -2,-0.4 2,-0.4 -0.989 28.7-134.8-155.5 157.7 -33.3 -5.4 1.9 75 75 A S E +DE 230 167A 16 155,-1.9 154,-3.1 -2,-0.3 155,-0.8 -0.966 32.7 161.2-117.8 130.9 -30.1 -6.8 0.3 76 76 A F E -DE 228 166A 0 90,-1.9 90,-3.4 -2,-0.4 2,-0.3 -0.903 22.5-153.7-142.0 170.4 -29.7 -10.5 -0.4 77 77 A S E -D 227 0A 4 150,-2.1 150,-2.2 -2,-0.3 2,-0.5 -0.992 1.9-160.4-147.4 144.0 -27.7 -12.9 -2.4 78 78 A I - 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