==== 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 SUGAR BINDING PROTEIN 17-NOV-03 1RIT . COMPND 2 MOLECULE: GALACTOSE-BINDING LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ARACHIS HYPOGAEA; . AUTHOR M.GOEL,K.J.KAUR,B.G.MAIYA,M.J.SWAMY,D.M.SALUNKE . 928 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33230.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 636 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 391 42.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 12 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 127 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.6 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 4 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 . 4 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 . 4 13 0 4 9 6 14 7 2 0 1 1 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 7 1 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 A 0 0 56 0, 0.0 2,-0.8 0, 0.0 241,-0.4 0.000 360.0 360.0 360.0 166.1 -12.0 38.6 13.6 2 2 A E E +A 229 0A 19 227,-2.3 227,-3.6 239,-0.1 2,-0.4 -0.807 360.0 177.1 -92.2 108.9 -9.7 40.7 11.4 3 3 A T E -A 228 0A 25 -2,-0.8 2,-0.4 237,-0.4 237,-0.4 -0.936 20.8-165.7-124.0 137.8 -8.7 38.7 8.3 4 4 A V E +A 227 0A 25 223,-2.3 223,-2.6 -2,-0.4 2,-0.3 -0.943 19.5 165.6-113.8 133.8 -6.6 39.4 5.2 5 5 A S E +A 226 0A 45 -2,-0.4 233,-0.3 233,-0.3 2,-0.3 -0.863 3.9 159.1-157.6 120.2 -6.8 37.0 2.3 6 6 A F E -A 225 0A 20 219,-1.6 219,-1.4 -2,-0.3 2,-0.3 -0.779 17.6-155.6-128.7 172.7 -5.7 37.3 -1.3 7 7 A N E -A 224 0A 55 229,-0.4 2,-0.5 -2,-0.3 229,-0.4 -0.873 6.1-173.4-158.8 123.9 -4.8 34.9 -4.1 8 8 A F E +A 223 0A 19 215,-3.7 215,-2.7 -2,-0.3 3,-0.1 -0.969 17.1 163.5-122.4 119.0 -2.7 35.1 -7.2 9 9 A N S S+ 0 0 94 -2,-0.5 2,-0.3 225,-0.3 -1,-0.1 0.473 82.5 9.8-104.3 -8.8 -2.6 32.3 -9.8 10 10 A S S S- 0 0 43 224,-0.2 2,-0.3 213,-0.1 -1,-0.2 -0.937 72.6-140.9-157.1 169.0 -1.0 34.8 -12.3 11 11 A F + 0 0 13 -2,-0.3 2,-0.3 19,-0.3 19,-0.1 -0.879 13.9 178.3-135.5 168.1 0.4 38.3 -12.3 12 12 A S > - 0 0 36 -2,-0.3 3,-1.2 18,-0.1 16,-0.1 -0.872 35.7-104.6-169.3 135.0 0.4 41.3 -14.5 13 13 A E T 3 S+ 0 0 134 -2,-0.3 12,-0.0 1,-0.2 0, 0.0 -0.144 101.8 45.6 -58.1 162.8 2.0 44.8 -14.1 14 14 A G T 3 S+ 0 0 45 1,-0.3 -1,-0.2 4,-0.2 272,-0.0 0.314 72.6 133.1 86.5 -12.7 -0.5 47.6 -13.3 15 15 A N X - 0 0 19 -3,-1.2 3,-1.9 1,-0.2 -1,-0.3 -0.652 51.2-148.6 -74.7 116.1 -2.2 45.6 -10.6 16 16 A P T 3 S+ 0 0 9 0, 0.0 -1,-0.2 0, 0.0 269,-0.1 0.583 89.6 73.4 -62.8 -6.7 -2.5 48.0 -7.6 17 17 A A T 3 S+ 0 0 9 1,-0.1 32,-2.5 32,-0.1 2,-0.4 0.623 95.5 53.2 -81.9 -13.2 -2.3 45.0 -5.2 18 18 A I E < -I 48 0B 13 -3,-1.9 2,-0.5 30,-0.3 30,-0.2 -0.982 65.0-153.8-131.8 132.0 1.4 44.5 -5.9 19 19 A N E -I 47 0B 64 28,-2.8 28,-2.4 -2,-0.4 2,-0.7 -0.867 12.2-150.0-103.4 131.5 4.5 46.7 -5.7 20 20 A F E -I 46 0B 69 -2,-0.5 2,-0.5 26,-0.2 26,-0.2 -0.880 15.4-178.9-105.3 111.9 7.5 45.9 -7.8 21 21 A Q E -I 45 0B 37 24,-1.9 24,-3.4 -2,-0.7 2,-0.3 -0.936 52.7 -14.0-109.4 121.8 10.9 47.0 -6.4 22 22 A G E S-I 44 0B 48 -2,-0.5 22,-0.3 22,-0.2 2,-0.1 -0.650 119.7 -9.7 99.6-150.6 14.0 46.3 -8.4 23 23 A D S S+ 0 0 35 20,-2.9 2,-0.3 -2,-0.3 21,-0.2 0.042 84.1 145.1 -80.8 30.1 14.7 44.1 -11.5 24 24 A V - 0 0 23 21,-0.2 2,-0.4 19,-0.2 10,-0.2 -0.555 25.1-176.8 -73.4 128.0 11.3 42.5 -11.2 25 25 A T E -B 33 0A 63 8,-2.6 8,-2.6 -2,-0.3 2,-0.6 -0.992 19.6-140.6-129.3 125.6 9.8 41.7 -14.6 26 26 A V E -B 32 0A 19 -2,-0.4 6,-0.2 6,-0.2 -13,-0.1 -0.775 23.5-135.6 -88.8 121.1 6.4 40.2 -15.3 27 27 A L > - 0 0 60 4,-3.1 3,-1.5 -2,-0.6 4,-0.3 -0.317 23.0-108.3 -74.6 156.9 6.3 37.7 -18.1 28 28 A S T 3 S+ 0 0 138 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.186 116.6 60.7 -68.2 18.0 3.7 37.5 -20.8 29 29 A N T 3 S- 0 0 90 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.049 121.9 -96.7-134.6 25.0 2.5 34.3 -19.1 30 30 A G S < S+ 0 0 11 -3,-1.5 2,-0.4 1,-0.2 -19,-0.3 0.729 84.4 128.9 66.2 24.6 1.5 35.7 -15.7 31 31 A N - 0 0 11 -4,-0.3 -4,-3.1 -21,-0.2 2,-0.5 -0.878 54.3-133.4-112.6 142.9 4.8 34.7 -14.1 32 32 A I E -BC 26 220A 0 188,-1.8 188,-2.0 -2,-0.4 2,-0.6 -0.830 12.0-161.0 -98.0 130.7 7.0 36.9 -12.1 33 33 A Q E -BC 25 219A 29 -8,-2.6 -8,-2.6 -2,-0.5 186,-0.2 -0.951 3.9-165.0-108.7 116.9 10.8 36.9 -12.8 34 34 A L + 0 0 0 184,-2.9 2,-0.3 -2,-0.6 174,-0.2 0.870 60.7 41.8 -74.9 -36.7 12.7 38.4 -9.9 35 35 A T S S- 0 0 3 183,-0.2 2,-0.5 181,-0.2 183,-0.2 -0.812 72.4-121.6-118.7 157.5 16.2 39.1 -11.3 36 36 A N > - 0 0 63 -2,-0.3 3,-1.0 1,-0.1 6,-0.3 -0.810 16.0-155.6 -92.3 125.2 17.7 40.5 -14.4 37 37 A L T 3 S+ 0 0 35 -2,-0.5 -1,-0.1 1,-0.2 5,-0.0 0.727 88.8 57.4 -73.0 -22.1 20.1 38.0 -16.1 38 38 A N T 3 S+ 0 0 149 2,-0.1 2,-0.3 177,-0.0 -1,-0.2 0.187 94.0 85.5 -96.5 19.0 22.1 40.7 -17.9 39 39 A K S X S- 0 0 91 -3,-1.0 3,-0.6 172,-0.1 2,-0.5 -0.891 72.6-128.6-122.6 152.8 23.1 42.6 -14.8 40 40 A V T 3 S+ 0 0 61 -2,-0.3 172,-0.2 1,-0.2 171,-0.1 -0.819 100.1 7.8 -91.0 131.1 25.9 42.3 -12.2 41 41 A N T 3 S- 0 0 57 -2,-0.5 -1,-0.2 60,-0.3 59,-0.2 0.786 86.1-173.2 68.5 30.6 24.3 42.4 -8.8 42 42 A S < - 0 0 2 -3,-0.6 168,-2.1 169,-0.3 2,-0.3 -0.142 3.4-177.4 -54.0 152.4 20.7 42.1 -9.9 43 43 A V E + J 0 209B 9 166,-0.2 -20,-2.9 -9,-0.1 2,-0.3 -0.939 5.9 169.3-156.3 131.6 18.1 42.5 -7.1 44 44 A G E -IJ 22 208B 0 164,-1.4 164,-2.1 -2,-0.3 2,-0.3 -0.999 8.3-177.2-149.9 145.7 14.3 42.3 -7.2 45 45 A R E -IJ 21 207B 4 -24,-3.4 -24,-1.9 -2,-0.3 2,-0.4 -0.978 11.7-156.8-140.8 152.6 11.4 42.1 -4.9 46 46 A V E -IJ 20 206B 4 160,-2.5 160,-2.0 -2,-0.3 2,-0.4 -1.000 19.8-172.6-128.9 127.4 7.6 41.8 -5.2 47 47 A L E -IJ 19 205B 3 -28,-2.4 -28,-2.8 -2,-0.4 2,-0.8 -0.949 32.8-113.0-126.9 147.1 5.4 43.0 -2.3 48 48 A Y E -I 18 0B 12 156,-2.7 156,-0.3 -2,-0.4 -30,-0.3 -0.675 38.1-133.3 -74.6 113.3 1.7 42.8 -1.4 49 49 A A S S+ 0 0 17 -32,-2.5 -1,-0.1 -2,-0.8 -31,-0.1 0.741 80.4 69.0 -37.0 -51.3 0.8 46.5 -1.7 50 50 A M S S- 0 0 10 -33,-0.3 154,-0.3 1,-0.1 2,-0.3 -0.493 84.1-120.1 -80.8 142.8 -1.2 46.9 1.5 51 51 A P - 0 0 24 0, 0.0 2,-0.5 0, 0.0 152,-0.2 -0.632 25.0-145.3 -78.3 139.0 0.5 46.7 5.0 52 52 A V E -K 202 0B 5 150,-2.3 150,-2.2 -2,-0.3 2,-1.1 -0.943 10.4-132.2-109.0 129.5 -1.0 43.9 7.1 53 53 A R E -K 201 0B 23 -2,-0.5 148,-0.2 148,-0.2 147,-0.1 -0.684 25.8-178.4 -79.2 96.8 -1.2 44.6 10.8 54 54 A I + 0 0 5 146,-1.6 9,-3.6 -2,-1.1 2,-0.3 0.783 63.5 13.7 -71.6 -28.3 0.2 41.4 12.3 55 55 A W B -P 62 0C 35 145,-0.8 2,-0.5 7,-0.2 7,-0.2 -0.985 68.7-127.4-146.9 158.8 -0.2 42.3 16.0 56 56 A S > - 0 0 3 5,-1.7 4,-3.2 -2,-0.3 5,-0.2 -0.925 3.1-155.9-114.2 122.4 -2.1 44.8 18.2 57 57 A S T 4 S+ 0 0 80 -2,-0.5 -1,-0.1 1,-0.2 0, 0.0 0.675 103.1 47.5 -63.5 -15.5 -0.5 47.0 20.8 58 58 A A T 4 S+ 0 0 88 3,-0.1 -1,-0.2 1,-0.0 173,-0.0 0.885 119.4 32.0 -91.9 -49.6 -4.0 47.0 22.3 59 59 A T T 4 S- 0 0 50 2,-0.1 -2,-0.2 1,-0.1 3,-0.1 0.863 90.1-139.8 -77.3 -37.0 -5.0 43.4 22.2 60 60 A G < + 0 0 32 -4,-3.2 -3,-0.1 1,-0.3 135,-0.1 0.282 60.3 134.7 90.0 -8.2 -1.5 42.1 22.7 61 61 A N - 0 0 57 169,-0.2 -5,-1.7 -5,-0.2 2,-0.4 -0.270 47.0-149.0 -75.1 157.9 -2.5 39.5 20.2 62 62 A V B -P 55 0C 17 -7,-0.2 -7,-0.2 -3,-0.1 168,-0.2 -0.998 20.4-119.4-131.3 131.3 -0.6 38.2 17.2 63 63 A A - 0 0 5 -9,-3.6 2,-0.3 -2,-0.4 166,-0.2 -0.234 16.7-141.7 -69.5 155.4 -2.1 37.0 13.9 64 64 A S E -D 228 0A 7 164,-1.8 164,-2.6 820,-0.2 2,-0.3 -0.824 21.7-165.3-110.5 154.0 -1.7 33.5 12.5 65 65 A F E -DE 227 167A 2 102,-0.9 102,-1.9 -2,-0.3 2,-0.5 -0.998 20.8-157.8-147.3 150.0 -1.3 33.0 8.8 66 66 A L E + E 0 166A 28 160,-3.4 160,-0.5 -2,-0.3 2,-0.4 -0.946 26.4 165.0-126.5 106.8 -1.5 30.3 6.2 67 67 A T E + E 0 165A 0 98,-2.0 98,-3.5 -2,-0.5 2,-0.3 -0.975 10.2 179.1-127.2 139.3 0.4 31.1 3.1 68 68 A S E +FE 224 164A 40 156,-2.5 156,-2.4 -2,-0.4 2,-0.3 -0.989 8.2 167.6-136.8 145.6 1.4 28.8 0.3 69 69 A F E -FE 223 163A 5 94,-2.1 94,-2.5 -2,-0.3 2,-0.4 -0.964 22.3-136.1-152.0 165.1 3.2 29.6 -3.0 70 70 A S E +FE 222 162A 14 152,-1.8 151,-1.8 -2,-0.3 152,-1.4 -0.973 23.1 169.0-131.3 144.6 5.1 28.1 -5.9 71 71 A F E -FE 220 161A 1 90,-1.4 90,-3.0 -2,-0.4 2,-0.3 -0.889 17.5-150.6-144.2 175.3 8.3 28.9 -7.7 72 72 A E E -FE 219 160A 35 147,-1.9 147,-3.1 -2,-0.3 2,-0.4 -0.984 0.9-164.8-152.5 139.2 10.9 27.7 -10.2 73 73 A M - 0 0 4 86,-0.5 85,-0.4 83,-0.4 2,-0.4 -0.868 11.5-171.8-130.9 100.1 14.6 28.3 -10.7 74 74 A K - 0 0 118 -2,-0.4 143,-2.2 83,-0.3 83,-0.1 -0.727 20.7-126.2 -93.4 138.2 16.0 27.4 -14.0 75 75 A D - 0 0 77 -2,-0.4 2,-0.4 141,-0.2 141,-0.1 -0.229 15.9-139.6 -73.8 167.5 19.8 27.4 -14.6 76 76 A I - 0 0 39 139,-0.4 3,-0.2 3,-0.3 139,-0.1 -0.967 31.8 -91.6-138.7 122.0 21.6 29.3 -17.4 77 77 A K S S+ 0 0 182 -2,-0.4 3,-0.1 1,-0.2 0, 0.0 0.177 107.6 9.0 -26.7 128.4 24.6 28.1 -19.4 78 78 A D S S+ 0 0 135 1,-0.2 2,-0.3 -3,-0.0 -1,-0.2 0.893 106.4 108.1 61.0 47.0 27.9 29.1 -18.0 79 79 A Y S S- 0 0 90 -3,-0.2 -3,-0.3 135,-0.0 135,-0.2 -0.993 70.2-116.5-153.8 143.7 26.6 30.5 -14.7 80 80 A D B -q 214 0D 88 133,-2.2 135,-2.0 -2,-0.3 2,-0.7 -0.653 40.6-114.7 -80.3 128.2 26.6 29.6 -11.0 81 81 A P - 0 0 46 0, 0.0 2,-0.3 0, 0.0 135,-0.2 -0.529 56.9-154.3 -67.0 109.7 23.0 29.1 -9.8 82 82 A A - 0 0 0 -2,-0.7 129,-0.1 129,-0.1 2,-0.1 -0.970 22.2 -23.1-165.0 167.2 22.3 31.8 -7.3 83 83 A D - 0 0 2 -2,-0.3 41,-1.4 127,-0.2 42,-0.5 -0.939 68.0-140.2 -94.5 -22.4 21.3 33.4 -5.1 84 84 A G E -LM 123 209B 0 125,-0.5 125,-0.6 39,-0.2 39,-0.2 -0.598 22.2 -77.9 126.6 171.1 17.9 31.9 -4.5 85 85 A I E -LM 122 208B 1 37,-1.0 37,-2.4 -2,-0.2 2,-0.3 -0.537 37.2-161.4 -99.7 170.6 14.4 33.2 -3.6 86 86 A I E -LM 121 207B 0 121,-1.1 121,-2.8 35,-0.2 2,-0.6 -0.946 13.5-150.3-156.7 134.4 13.2 34.3 -0.2 87 87 A F E +LM 120 206B 4 33,-2.6 33,-2.7 -2,-0.3 2,-0.3 -0.930 38.4 172.2-104.1 122.6 9.7 34.8 1.3 88 88 A F E -LM 119 205B 1 117,-2.8 117,-1.8 -2,-0.6 2,-0.4 -0.900 36.8-143.3-140.3 168.6 9.8 37.6 3.9 89 89 A I E +LM 118 204B 7 29,-2.8 29,-2.2 -2,-0.3 115,-0.2 -0.991 31.4 164.4-127.5 130.4 8.2 40.0 6.3 90 90 A A E - 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