==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 01-DEC-03 1V6J . COMPND 2 MOLECULE: GALACTOSE-BINDING LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ARACHIS HYPOGAEA; . AUTHOR S.KUNDHAVAI NATCHIAR,A.AROCKIA JEYAPRAKASH,T.N.C.RAMYA, . 928 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32852.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 668 72.0 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 . 401 43.2 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 . 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 . 133 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 . 5 11 0 4 8 4 17 3 4 0 1 3 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 8 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 A 0 0 52 0, 0.0 2,-0.7 0, 0.0 241,-0.3 0.000 360.0 360.0 360.0 166.6 17.9 10.9 40.6 2 2 A E E -A 229 0A 11 227,-2.9 227,-2.2 239,-0.1 2,-0.4 -0.866 360.0-178.8-105.9 104.3 20.4 13.7 40.5 3 3 A T E -A 228 0A 26 -2,-0.7 2,-0.5 237,-0.3 237,-0.3 -0.877 15.6-176.1-112.6 134.9 24.0 12.6 39.9 4 4 A V E +A 227 0A 13 223,-2.2 223,-2.1 -2,-0.4 2,-0.4 -0.992 19.4 161.1-123.5 119.9 27.2 14.5 39.7 5 5 A S E +A 226 0A 52 -2,-0.5 2,-0.3 233,-0.3 221,-0.3 -0.998 9.0 167.3-146.1 141.6 30.3 12.6 38.9 6 6 A F E -A 225 0A 23 219,-2.3 219,-3.5 -2,-0.4 2,-0.4 -0.972 17.0-152.9-147.2 156.8 33.8 13.4 37.7 7 7 A N E -A 224 0A 66 -2,-0.3 2,-0.6 217,-0.3 217,-0.3 -0.972 6.0-170.4-140.2 120.6 37.1 11.6 37.4 8 8 A F E +A 223 0A 17 215,-2.7 215,-2.3 -2,-0.4 3,-0.1 -0.931 16.0 166.7-114.4 109.2 40.5 13.3 37.4 9 9 A N S S- 0 0 88 -2,-0.6 2,-0.3 1,-0.3 -1,-0.1 0.682 81.7 -0.6 -89.2 -21.2 43.6 11.1 36.5 10 10 A S S S- 0 0 44 224,-0.2 -1,-0.3 213,-0.1 2,-0.3 -0.969 72.5-131.5-159.6 159.5 45.6 14.2 36.1 11 11 A F - 0 0 7 19,-3.1 2,-0.3 -2,-0.3 224,-0.0 -0.802 14.6-171.0-118.2 160.9 45.1 17.9 36.3 12 12 A S > - 0 0 30 -2,-0.3 3,-1.7 3,-0.0 6,-0.1 -0.889 30.6-114.4-155.1 118.5 46.1 20.7 33.9 13 13 A E T 3 S+ 0 0 130 -2,-0.3 12,-0.0 1,-0.2 -2,-0.0 -0.236 102.7 48.5 -51.6 137.8 45.9 24.5 34.5 14 14 A G T 3 S+ 0 0 39 1,-0.4 -1,-0.2 4,-0.2 0, 0.0 0.125 73.9 129.7 114.8 -19.5 43.3 25.9 32.1 15 15 A N X - 0 0 16 -3,-1.7 3,-1.6 1,-0.2 -1,-0.4 -0.577 50.1-152.5 -72.2 117.9 40.6 23.4 32.9 16 16 A P T 3 S+ 0 0 12 0, 0.0 -1,-0.2 0, 0.0 269,-0.1 0.593 89.8 72.1 -67.1 -10.2 37.4 25.3 33.7 17 17 A A T 3 S+ 0 0 6 32,-0.1 32,-2.2 1,-0.1 2,-0.4 0.460 94.5 60.4 -85.1 -0.8 36.3 22.4 35.8 18 18 A I E < -H 48 0B 12 -3,-1.6 2,-0.4 30,-0.3 30,-0.2 -0.989 65.6-154.3-135.7 130.7 38.8 23.2 38.5 19 19 A N E -H 47 0B 52 28,-2.1 28,-2.5 -2,-0.4 2,-0.5 -0.844 11.7-154.0 -99.7 133.1 39.3 26.4 40.6 20 20 A F E -H 46 0B 75 -2,-0.4 2,-0.4 26,-0.2 26,-0.2 -0.934 13.0-177.3-109.5 126.6 42.8 27.1 42.0 21 21 A Q E -H 45 0B 20 24,-3.4 24,-3.4 -2,-0.5 2,-0.1 -0.985 49.9 -18.0-124.3 132.9 43.1 29.2 45.2 22 22 A G E S-H 44 0B 49 -2,-0.4 2,-0.7 22,-0.2 22,-0.3 -0.446 120.8 -6.3 82.8-150.2 46.4 30.3 46.7 23 23 A D S S+ 0 0 28 20,-2.9 21,-0.2 -2,-0.1 -1,-0.2 -0.005 86.5 146.8 -78.1 33.3 49.9 28.8 46.1 24 24 A V - 0 0 26 -2,-0.7 2,-0.3 19,-0.2 10,-0.2 -0.475 22.5-179.1 -73.4 140.4 48.5 26.0 43.9 25 25 A T E -B 33 0A 54 8,-2.1 8,-3.1 -2,-0.2 2,-0.7 -0.998 23.3-136.1-144.3 135.8 50.7 24.9 41.1 26 26 A V E -B 32 0A 23 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.834 22.3-144.7 -97.1 116.0 50.3 22.2 38.3 27 27 A L > - 0 0 54 4,-2.4 3,-2.2 -2,-0.7 -16,-0.1 -0.386 25.1-111.2 -75.5 154.7 53.4 20.0 37.7 28 28 A S T 3 S+ 0 0 137 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.676 115.8 64.9 -59.3 -19.7 54.2 18.8 34.2 29 29 A N T 3 S- 0 0 92 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.387 121.2-105.2 -85.6 3.9 53.4 15.3 35.3 30 30 A G S < S+ 0 0 9 -3,-2.2 -19,-3.1 1,-0.3 2,-0.2 0.461 80.5 127.7 88.4 0.4 49.8 16.3 35.8 31 31 A N - 0 0 13 -21,-0.2 -4,-2.4 -4,-0.0 2,-0.5 -0.543 57.3-126.6 -88.8 157.4 49.9 16.3 39.6 32 32 A I E -BC 26 220A 0 188,-2.1 188,-2.4 -6,-0.2 2,-0.7 -0.912 13.3-158.1-106.4 125.5 48.8 19.3 41.7 33 33 A Q E -BC 25 219A 29 -8,-3.1 -8,-2.1 -2,-0.5 186,-0.2 -0.921 8.0-162.2-101.0 115.2 51.3 20.6 44.2 34 34 A L + 0 0 0 184,-2.5 2,-0.2 -2,-0.7 174,-0.2 0.887 60.3 39.6 -68.9 -44.3 49.2 22.5 46.8 35 35 A T S S- 0 0 4 183,-0.3 2,-0.5 181,-0.2 183,-0.2 -0.690 75.4-115.0-112.9 165.2 51.8 24.7 48.6 36 36 A N > - 0 0 57 -2,-0.2 3,-0.9 1,-0.1 6,-0.2 -0.833 15.1-154.9 -96.1 124.5 54.8 26.9 47.8 37 37 A L T 3 S+ 0 0 42 -2,-0.5 -1,-0.1 1,-0.2 180,-0.0 0.707 92.6 49.7 -71.2 -21.1 58.1 25.7 49.2 38 38 A N T 3 S+ 0 0 148 2,-0.1 2,-0.3 177,-0.0 -1,-0.2 0.331 96.7 86.0-100.9 5.9 59.6 29.2 49.2 39 39 A K S X S- 0 0 94 -3,-0.9 3,-0.7 -16,-0.1 2,-0.2 -0.845 73.9-124.7-111.7 147.0 56.8 31.1 50.9 40 40 A V T 3 S+ 0 0 72 -2,-0.3 172,-0.2 1,-0.2 171,-0.1 -0.582 94.0 3.5 -83.0 148.3 56.0 31.6 54.6 41 41 A N T 3 S- 0 0 62 -2,-0.2 -1,-0.2 170,-0.2 170,-0.2 0.839 90.4-169.9 42.3 47.4 52.5 30.5 55.7 42 42 A S < - 0 0 3 -3,-0.7 168,-1.5 169,-0.4 2,-0.4 -0.394 9.7-171.9 -69.2 138.9 51.7 29.1 52.3 43 43 A V E + I 0 209B 10 166,-0.2 -20,-2.9 -2,-0.1 2,-0.4 -0.997 6.8 175.0-135.7 130.2 48.1 28.1 51.5 44 44 A G E +HI 22 208B 0 164,-2.1 164,-1.9 -2,-0.4 2,-0.3 -0.996 1.0 175.6-138.8 131.2 46.9 26.3 48.4 45 45 A R E -HI 21 207B 3 -24,-3.4 -24,-3.4 -2,-0.4 2,-0.4 -0.982 11.7-164.7-135.4 146.6 43.5 24.9 47.7 46 46 A V E -HI 20 206B 3 160,-2.0 160,-2.2 -2,-0.3 2,-0.3 -0.999 16.1-174.9-131.9 127.1 42.0 23.3 44.6 47 47 A L E -HI 19 205B 1 -28,-2.5 -28,-2.1 -2,-0.4 2,-0.6 -0.803 35.2-101.7-122.6 163.2 38.2 23.0 44.2 48 48 A Y E -H 18 0B 11 156,-2.3 -30,-0.3 -2,-0.3 156,-0.2 -0.767 37.0-135.9 -82.8 121.5 35.7 21.4 41.8 49 49 A A S S+ 0 0 15 -32,-2.2 -1,-0.2 -2,-0.6 -31,-0.1 0.868 82.5 67.7 -43.6 -55.2 34.5 24.4 39.8 50 50 A M S S- 0 0 11 -33,-0.3 2,-0.2 1,-0.1 -2,-0.1 -0.494 85.4-123.3 -75.9 134.1 30.8 23.5 39.8 51 51 A P - 0 0 21 0, 0.0 2,-0.4 0, 0.0 152,-0.2 -0.512 24.6-139.8 -75.5 148.1 28.9 23.7 43.1 52 52 A V E -J 202 0B 1 150,-3.3 150,-2.7 -2,-0.2 2,-1.0 -0.901 6.5-133.1-111.0 136.8 27.1 20.5 44.1 53 53 A R E +J 201 0B 24 -2,-0.4 148,-0.2 148,-0.2 147,-0.1 -0.756 26.0 176.5 -89.6 100.9 23.7 20.4 45.6 54 54 A I + 0 0 2 146,-1.5 9,-3.8 -2,-1.0 2,-0.3 0.565 65.8 12.6 -81.7 -10.0 24.0 18.0 48.6 55 55 A W B -O 62 0C 38 145,-0.8 2,-0.4 7,-0.3 7,-0.2 -0.956 67.8-128.2-165.1 147.8 20.5 18.5 49.8 56 56 A S > - 0 0 9 5,-1.7 4,-1.2 -2,-0.3 5,-0.1 -0.796 1.9-157.1-101.4 140.1 17.1 19.9 48.8 57 57 A S T 4 S+ 0 0 84 -2,-0.4 -1,-0.1 2,-0.2 0, 0.0 0.703 97.8 56.7 -82.0 -20.8 15.0 22.3 50.8 58 58 A A T 4 S+ 0 0 89 1,-0.1 -1,-0.1 3,-0.1 -2,-0.0 0.906 123.2 18.3 -75.7 -47.0 12.0 21.0 48.8 59 59 A T T 4 S- 0 0 59 2,-0.1 -2,-0.2 171,-0.1 -1,-0.1 0.649 93.5-132.5 -99.1 -21.1 12.3 17.3 49.6 60 60 A G < + 0 0 25 -4,-1.2 2,-0.2 1,-0.3 -3,-0.1 0.621 58.3 142.9 77.1 12.0 14.5 17.6 52.6 61 61 A N - 0 0 50 169,-0.2 -5,-1.7 -5,-0.1 2,-0.4 -0.492 42.2-144.2 -85.7 155.3 16.7 14.8 51.2 62 62 A V B -O 55 0C 17 -7,-0.2 168,-0.4 -2,-0.2 -7,-0.3 -0.917 19.1-120.0-118.0 144.7 20.4 14.7 51.4 63 63 A A - 0 0 2 -9,-3.8 2,-0.3 -2,-0.4 166,-0.2 -0.412 18.3-139.9 -80.5 160.4 22.7 13.3 48.7 64 64 A S E -D 228 0A 9 164,-2.4 164,-2.6 820,-0.1 2,-0.3 -0.848 22.7-169.1-113.1 152.9 25.0 10.3 49.2 65 65 A F E -DE 227 167A 1 102,-1.3 102,-2.3 -2,-0.3 2,-0.4 -1.000 20.4-162.0-149.4 150.0 28.4 10.4 47.7 66 66 A L E +DE 226 166A 23 160,-2.7 160,-1.9 -2,-0.3 2,-0.3 -0.999 23.6 167.8-126.8 128.5 31.4 8.0 47.1 67 67 A T E -DE 225 165A 2 98,-2.2 98,-3.0 -2,-0.4 2,-0.4 -0.990 13.5-174.4-148.3 136.4 34.8 9.6 46.4 68 68 A S E +DE 224 164A 43 156,-1.5 156,-2.7 -2,-0.3 2,-0.3 -0.981 11.3 164.1-131.3 142.9 38.3 8.3 46.2 69 69 A F E -DE 223 163A 4 94,-2.0 94,-2.5 -2,-0.4 2,-0.4 -0.975 23.0-139.7-151.4 160.2 41.6 10.2 45.7 70 70 A S E +DE 222 162A 13 152,-1.5 151,-2.9 -2,-0.3 152,-1.2 -0.984 21.3 174.8-129.8 139.4 45.3 9.7 46.1 71 71 A F E -DE 220 161A 2 90,-1.8 90,-2.8 -2,-0.4 2,-0.3 -0.846 16.1-147.9-135.6 171.8 47.9 12.1 47.5 72 72 A E E -DE 219 160A 18 147,-2.3 147,-2.7 -2,-0.3 2,-0.4 -0.988 4.2-167.7-146.1 132.8 51.6 12.2 48.3 73 73 A M E -DE 218 159A 3 86,-0.6 85,-2.2 -2,-0.3 86,-0.5 -0.979 13.0-177.2-120.1 131.5 53.5 14.2 51.0 74 74 A K E -D 217 0A 90 143,-1.3 143,-3.1 -2,-0.4 2,-0.1 -0.992 24.3-118.6-132.5 140.2 57.3 14.3 50.8 75 75 A D E -D 216 0A 80 -2,-0.4 2,-0.3 141,-0.2 141,-0.1 -0.404 22.0-153.3 -74.1 149.8 59.8 15.9 53.1 76 76 A I > - 0 0 32 139,-0.5 3,-0.6 3,-0.4 139,-0.1 -0.899 36.6 -87.0-121.4 151.8 62.1 18.7 51.9 77 77 A K T 3 S+ 0 0 184 -2,-0.3 -2,-0.0 1,-0.2 139,-0.0 0.593 106.4 10.0 -36.9 -59.3 65.5 19.4 53.4 78 78 A D T 3 S+ 0 0 125 2,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.455 98.4 86.3-121.2 13.1 65.0 21.7 56.3 79 79 A Y S < S- 0 0 84 -3,-0.6 -3,-0.4 136,-0.2 135,-0.3 -0.698 80.3-104.4-102.8 148.4 61.5 22.3 57.3 80 80 A D B -p 214 0D 99 133,-1.7 2,-1.4 -2,-0.3 135,-1.1 -0.515 48.7-104.5 -63.9 131.3 59.5 20.2 59.7 81 81 A P - 0 0 47 0, 0.0 2,-0.3 0, 0.0 135,-0.2 -0.464 67.6-164.4 -63.7 95.4 57.1 18.2 57.4 82 82 A A - 0 0 1 -2,-1.4 134,-0.2 2,-0.1 129,-0.1 -0.894 19.8 -10.5-139.3 167.1 54.0 20.2 58.1 83 83 A D - 0 0 4 -2,-0.3 41,-1.4 132,-0.1 42,-0.8 -0.975 68.5-135.3-111.7 -8.9 51.2 20.9 58.2 84 84 A G E -KL 123 209B 0 125,-0.6 125,-1.0 39,-0.2 2,-0.3 -0.594 17.4 -77.1 123.6 176.8 49.1 18.4 56.2 85 85 A I E -KL 122 208B 0 37,-1.3 37,-3.1 -2,-0.2 2,-0.3 -0.799 32.2-163.9-114.5 156.0 46.3 18.0 53.6 86 86 A I E -KL 121 207B 0 121,-2.0 121,-1.8 -2,-0.3 2,-0.7 -0.984 14.9-149.1-146.1 132.8 42.5 18.2 54.1 87 87 A F E +KL 120 206B 2 33,-3.1 33,-2.6 -2,-0.3 2,-0.3 -0.888 38.1 178.9 -96.8 116.8 39.6 17.1 51.9 88 88 A F E -KL 119 205B 2 117,-2.3 117,-1.8 -2,-0.7 2,-0.4 -0.808 33.7-150.9-127.7 166.6 36.8 19.6 52.6 89 89 A I E +KL 118 204B 4 29,-2.9 29,-2.2 -2,-0.3 115,-0.2 -0.999 33.9 155.5-128.9 127.6 33.2 20.6 51.8 90 90 A A E - 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