==== 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 1V6L . 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) . 32333.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 662 71.3 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 . 400 43.1 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 . 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 . 128 13.8 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 . 4 12 0 4 8 4 16 4 4 0 4 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 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 49 0, 0.0 2,-0.7 0, 0.0 241,-0.4 0.000 360.0 360.0 360.0 160.7 18.0 10.6 40.2 2 2 A E E +A 229 0A 10 227,-2.6 227,-2.4 239,-0.1 2,-0.3 -0.895 360.0 177.2-110.6 104.3 20.3 13.6 40.2 3 3 A T E -A 228 0A 20 -2,-0.7 2,-0.4 237,-0.3 237,-0.3 -0.829 18.1-172.9-112.3 145.8 23.9 12.5 39.7 4 4 A V E +A 227 0A 11 223,-2.1 223,-2.2 -2,-0.3 2,-0.4 -0.982 18.5 165.4-133.9 118.1 27.1 14.4 39.4 5 5 A S E +A 226 0A 37 -2,-0.4 2,-0.3 233,-0.3 233,-0.3 -0.999 6.8 165.4-140.6 141.6 30.3 12.5 38.5 6 6 A F E -A 225 0A 19 219,-2.1 219,-2.8 -2,-0.4 2,-0.4 -0.963 16.2-155.0-147.5 159.2 33.7 13.4 37.3 7 7 A N E -A 224 0A 61 -2,-0.3 2,-0.5 229,-0.3 229,-0.3 -0.945 6.0-173.9-146.4 119.8 37.0 11.7 37.1 8 8 A F E +A 223 0A 14 215,-3.0 215,-2.4 -2,-0.4 3,-0.1 -0.955 13.9 168.4-116.0 115.0 40.5 13.3 37.0 9 9 A N S S- 0 0 93 -2,-0.5 2,-0.3 1,-0.4 -1,-0.1 0.517 84.1 -2.6 -96.7 -9.3 43.5 11.0 36.4 10 10 A S S S- 0 0 41 224,-0.2 -1,-0.4 213,-0.1 2,-0.3 -0.941 75.3-128.6-169.8 159.1 45.6 14.1 35.9 11 11 A F - 0 0 8 19,-3.0 2,-0.3 -2,-0.3 224,-0.0 -0.796 15.9-168.8-119.1 163.7 45.0 17.8 35.9 12 12 A S > - 0 0 23 -2,-0.3 3,-0.9 3,-0.0 2,-0.1 -0.974 30.0-103.3-146.2 153.5 45.9 20.5 33.5 13 13 A E T 3 S+ 0 0 129 -2,-0.3 12,-0.0 1,-0.2 0, 0.0 -0.453 102.5 35.6 -76.6 153.9 45.8 24.3 33.7 14 14 A G T 3 S+ 0 0 42 1,-0.3 -1,-0.2 4,-0.1 0, 0.0 0.307 75.4 139.5 89.2 -12.3 42.9 26.0 31.9 15 15 A N X - 0 0 8 -3,-0.9 3,-1.6 1,-0.2 -1,-0.3 -0.557 45.0-152.6 -69.3 116.8 40.4 23.3 32.7 16 16 A P T 3 S+ 0 0 8 0, 0.0 -1,-0.2 0, 0.0 269,-0.1 0.655 89.7 70.3 -66.3 -13.9 37.1 25.2 33.5 17 17 A A T 3 S+ 0 0 4 32,-0.1 32,-2.8 266,-0.1 2,-0.4 0.598 94.7 65.0 -78.8 -10.1 36.0 22.3 35.7 18 18 A I E < -H 48 0B 10 -3,-1.6 2,-0.5 30,-0.2 30,-0.2 -0.952 65.3-158.8-120.8 133.5 38.7 23.1 38.3 19 19 A N E -H 47 0B 53 28,-2.8 28,-2.4 -2,-0.4 2,-0.4 -0.908 11.2-155.1-106.9 131.4 39.1 26.3 40.5 20 20 A F E -H 46 0B 76 -2,-0.5 2,-0.4 26,-0.2 26,-0.2 -0.903 12.0-177.5-109.6 134.9 42.5 27.1 41.8 21 21 A Q E -H 45 0B 22 24,-2.9 24,-3.0 -2,-0.4 3,-0.1 -0.994 50.0 -19.7-131.2 137.7 42.9 29.2 45.0 22 22 A G E S-H 44 0B 54 -2,-0.4 2,-1.3 22,-0.2 22,-0.3 -0.332 120.6 -3.8 72.7-148.7 46.1 30.3 46.6 23 23 A D S S+ 0 0 31 20,-3.1 21,-0.2 11,-0.1 -1,-0.2 -0.107 86.5 142.9 -77.2 40.7 49.5 28.8 45.9 24 24 A V + 0 0 26 -2,-1.3 2,-0.3 21,-0.2 10,-0.2 -0.538 23.3 179.7 -83.6 150.3 48.4 26.0 43.7 25 25 A T E -B 33 0A 56 8,-1.6 8,-2.9 -2,-0.2 2,-0.6 -0.995 24.3-133.0-148.2 144.2 50.4 24.8 40.7 26 26 A V E -B 32 0A 23 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.895 22.7-145.3-103.7 119.5 50.1 22.2 38.0 27 27 A L > - 0 0 52 4,-2.9 3,-2.3 -2,-0.6 -16,-0.1 -0.438 26.1-110.5 -79.1 156.1 53.1 20.0 37.4 28 28 A S T 3 S+ 0 0 137 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.705 117.1 63.1 -59.7 -21.0 53.9 18.8 33.9 29 29 A N T 3 S- 0 0 95 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.417 121.7-106.0 -84.7 2.9 53.1 15.3 35.0 30 30 A G S < S+ 0 0 8 -3,-2.3 -19,-3.0 1,-0.3 2,-0.2 0.411 79.5 130.1 89.8 -3.2 49.5 16.4 35.6 31 31 A N - 0 0 12 -21,-0.2 -4,-2.9 -5,-0.0 2,-0.5 -0.518 54.9-128.3 -83.4 153.1 49.8 16.3 39.4 32 32 A I E -BC 26 220A 0 188,-2.1 188,-2.0 -6,-0.2 2,-0.7 -0.882 11.1-156.7-104.7 131.1 48.8 19.3 41.5 33 33 A Q E -BC 25 219A 31 -8,-2.9 -8,-1.6 -2,-0.5 186,-0.2 -0.934 6.7-165.1-106.3 112.7 51.1 20.8 44.0 34 34 A L + 0 0 0 184,-2.7 2,-0.3 -2,-0.7 174,-0.2 0.861 63.2 44.2 -69.0 -39.2 49.0 22.6 46.6 35 35 A T S S- 0 0 4 183,-0.3 2,-0.7 181,-0.2 183,-0.2 -0.742 75.2-122.3-113.1 160.3 51.7 24.7 48.4 36 36 A N > - 0 0 58 -2,-0.3 3,-1.8 1,-0.1 6,-0.2 -0.871 15.8-152.4 -98.7 113.2 54.6 26.9 47.4 37 37 A L T 3 S+ 0 0 39 -2,-0.7 -1,-0.1 1,-0.3 180,-0.0 0.639 93.1 52.5 -59.2 -17.1 57.8 25.6 49.0 38 38 A N T 3 S+ 0 0 142 2,-0.1 2,-0.3 -3,-0.0 -1,-0.3 0.427 94.0 84.9-101.6 0.3 59.3 29.1 48.9 39 39 A K S X S- 0 0 96 -3,-1.8 3,-0.7 -16,-0.1 2,-0.3 -0.801 74.9-123.5-106.7 147.2 56.5 31.0 50.6 40 40 A V T 3 S+ 0 0 71 -2,-0.3 172,-0.2 1,-0.3 171,-0.1 -0.614 95.8 4.7 -81.6 142.8 55.9 31.5 54.3 41 41 A N T 3 S- 0 0 60 -2,-0.3 -1,-0.3 1,-0.2 170,-0.2 0.882 91.4-168.2 49.1 46.6 52.4 30.3 55.5 42 42 A S < - 0 0 3 -3,-0.7 168,-1.8 169,-0.3 2,-0.4 -0.385 10.8-173.6 -69.6 140.2 51.6 28.9 52.0 43 43 A V E + I 0 209B 9 166,-0.2 -20,-3.1 -2,-0.1 2,-0.4 -0.984 6.2 175.0-138.8 125.1 48.0 27.9 51.2 44 44 A G E +HI 22 208B 0 164,-2.3 164,-2.2 -2,-0.4 2,-0.4 -0.993 3.3 180.0-131.1 137.2 46.8 26.2 48.1 45 45 A R E -HI 21 207B 2 -24,-3.0 -24,-2.9 -2,-0.4 2,-0.4 -1.000 10.7-165.1-140.6 138.6 43.3 24.9 47.4 46 46 A V E -HI 20 206B 2 160,-2.1 160,-2.2 -2,-0.4 2,-0.3 -0.966 15.2-176.1-121.1 137.0 41.8 23.1 44.4 47 47 A L E -HI 19 205B 1 -28,-2.4 -28,-2.8 -2,-0.4 2,-0.6 -0.963 37.0-107.3-134.9 151.7 38.0 22.8 44.0 48 48 A Y E -H 18 0B 8 156,-2.7 156,-0.3 -2,-0.3 -30,-0.2 -0.698 37.8-139.7 -74.1 120.1 35.6 21.2 41.6 49 49 A A S S+ 0 0 17 -32,-2.8 -1,-0.2 -2,-0.6 -31,-0.1 0.807 79.1 77.8 -54.4 -37.7 34.4 24.4 39.9 50 50 A M S S- 0 0 10 -33,-0.4 2,-0.1 1,-0.1 -2,-0.1 -0.605 83.9-126.0 -80.7 129.4 30.7 23.3 39.7 51 51 A P - 0 0 21 0, 0.0 2,-0.4 0, 0.0 152,-0.2 -0.501 25.1-141.9 -71.7 143.5 28.7 23.7 42.9 52 52 A V E -J 202 0B 2 150,-3.9 150,-3.0 -2,-0.1 2,-0.9 -0.889 5.4-135.1-111.4 140.4 27.0 20.5 43.9 53 53 A R E +J 201 0B 27 -2,-0.4 148,-0.3 148,-0.2 147,-0.1 -0.818 26.5 173.3 -92.2 105.8 23.6 20.3 45.4 54 54 A I + 0 0 0 146,-2.0 9,-4.2 -2,-0.9 2,-0.3 0.585 65.9 20.9 -90.0 -12.9 23.9 17.8 48.3 55 55 A W B -O 62 0C 37 145,-0.8 2,-0.5 7,-0.3 7,-0.2 -0.971 67.4-135.2-157.1 143.2 20.4 18.3 49.7 56 56 A S > - 0 0 8 5,-1.7 4,-3.1 -2,-0.3 5,-0.3 -0.868 1.4-158.5-102.5 123.8 17.0 19.6 48.5 57 57 A S T 4 S+ 0 0 83 -2,-0.5 -1,-0.1 1,-0.2 0, 0.0 0.732 96.9 57.7 -68.0 -20.0 15.0 22.0 50.7 58 58 A A T 4 S+ 0 0 89 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.920 123.9 17.0 -75.8 -46.7 12.0 20.8 48.7 59 59 A T T 4 S- 0 0 57 2,-0.1 -2,-0.2 171,-0.1 -1,-0.1 0.632 93.5-133.4 -99.9 -19.5 12.3 17.1 49.4 60 60 A G < + 0 0 24 -4,-3.1 -3,-0.2 1,-0.3 2,-0.1 0.605 56.6 145.1 75.7 9.9 14.6 17.4 52.4 61 61 A N - 0 0 51 -5,-0.3 -5,-1.7 169,-0.2 2,-0.4 -0.478 40.7-144.2 -82.0 153.3 16.7 14.6 50.9 62 62 A V B -O 55 0C 16 -7,-0.2 168,-0.3 -2,-0.1 -7,-0.3 -0.919 20.4-115.8-116.6 143.4 20.5 14.5 51.3 63 63 A A - 0 0 1 -9,-4.2 2,-0.4 -2,-0.4 166,-0.2 -0.421 17.8-140.7 -77.2 150.5 22.8 13.2 48.6 64 64 A S E -D 228 0A 8 164,-2.5 164,-2.8 820,-0.1 2,-0.4 -0.864 25.5-168.9-104.5 143.9 25.0 10.1 49.0 65 65 A F E -DE 227 167A 0 102,-1.6 102,-2.8 -2,-0.4 2,-0.4 -0.991 20.7-163.6-141.4 151.7 28.4 10.3 47.6 66 66 A L E +DE 226 166A 19 160,-3.1 160,-1.8 -2,-0.4 2,-0.4 -0.997 21.6 164.9-129.7 123.6 31.4 8.1 46.8 67 67 A T E -DE 225 165A 0 98,-2.4 98,-3.5 -2,-0.4 2,-0.3 -1.000 13.0-175.4-143.5 139.9 34.8 9.6 46.1 68 68 A S E +DE 224 164A 44 156,-1.6 156,-2.5 -2,-0.4 2,-0.3 -0.968 11.4 167.9-132.1 149.0 38.3 8.3 46.0 69 69 A F E -DE 223 163A 4 94,-2.1 94,-3.0 -2,-0.3 2,-0.4 -0.987 23.1-138.8-156.4 159.9 41.5 10.1 45.5 70 70 A S E +DE 222 162A 10 152,-1.4 151,-2.6 -2,-0.3 152,-1.3 -0.967 23.2 172.9-125.9 142.4 45.3 9.7 45.8 71 71 A F E -DE 220 161A 1 90,-1.8 90,-3.0 -2,-0.4 2,-0.4 -0.915 16.5-148.5-141.9 168.0 47.8 12.1 47.2 72 72 A E E -DE 219 160A 15 147,-2.4 147,-3.1 -2,-0.3 2,-0.4 -0.998 4.7-169.3-144.1 136.1 51.5 12.3 48.0 73 73 A M E -DE 218 159A 3 86,-0.6 85,-2.4 83,-0.4 86,-0.5 -0.995 13.3-177.1-124.3 128.0 53.4 14.2 50.7 74 74 A K E -D 217 0A 95 143,-1.3 143,-2.7 -2,-0.4 83,-0.1 -0.992 25.1-118.6-130.1 136.6 57.2 14.3 50.4 75 75 A D - 0 0 85 -2,-0.4 2,-0.3 141,-0.2 141,-0.1 -0.336 22.8-153.7 -68.3 149.7 59.7 15.9 52.8 76 76 A I > - 0 0 32 139,-0.5 3,-0.5 3,-0.2 139,-0.1 -0.910 44.2 -56.3-121.8 153.3 61.9 18.7 51.6 77 77 A K T 3 S- 0 0 163 -2,-0.3 2,-0.4 1,-0.2 3,-0.1 -0.314 101.4 -32.5 -52.5 136.9 65.3 19.4 53.1 78 78 A D T 3 S+ 0 0 133 1,-0.2 -1,-0.2 -3,-0.0 2,-0.1 -0.385 104.2 113.2-136.4 19.7 65.8 20.1 56.5 79 79 A Y S < S- 0 0 92 -3,-0.5 -3,-0.2 -2,-0.4 -1,-0.2 -0.320 73.4-101.6 -72.0 159.1 62.3 21.9 57.0 80 80 A D B -p 214 0D 91 133,-2.3 135,-3.3 -5,-0.1 2,-0.3 -0.491 33.2-122.3 -81.0 152.1 59.5 20.4 59.1 81 81 A P + 0 0 42 0, 0.0 2,-0.2 0, 0.0 135,-0.1 -0.818 50.2 166.0-137.9 100.5 56.7 18.6 57.3 82 82 A A + 0 0 1 -2,-0.3 2,-0.2 127,-0.1 129,-0.1 -0.193 21.7 14.7 82.3 103.4 54.1 20.1 58.2 83 83 A D - 0 0 4 -2,-0.2 41,-3.6 132,-0.1 42,-0.6 -0.667 60.3-152.8-112.4 -51.1 51.3 20.6 57.8 84 84 A G E -KL 123 209B 0 125,-0.8 125,-1.0 39,-0.2 2,-0.3 -0.856 20.4 -65.0 146.2-170.2 49.1 18.4 55.5 85 85 A I E -KL 122 208B 0 37,-1.3 37,-3.3 -2,-0.3 2,-0.4 -0.822 28.9-166.9-114.9 149.6 46.1 18.0 53.3 86 86 A I E -KL 121 207B 0 121,-2.5 121,-2.1 -2,-0.3 2,-0.6 -1.000 13.7-149.0-136.8 135.8 42.4 18.2 53.9 87 87 A F E -KL 120 206B 2 33,-3.1 33,-2.9 -2,-0.4 2,-0.3 -0.924 37.0-179.6 -99.8 118.7 39.6 17.1 51.7 88 88 A F E -KL 119 205B 1 117,-2.7 117,-1.9 -2,-0.6 2,-0.4 -0.831 33.8-150.8-129.2 166.0 36.7 19.5 52.4 89 89 A I E +KL 118 204B 4 29,-2.7 29,-2.3 -2,-0.3 115,-0.2 -0.999 34.2 156.1-128.3 127.4 33.1 20.4 51.6 90 90 A A E - 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