==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 31-JUL-06 2DVG . COMPND 2 MOLECULE: GALACTOSE-BINDING LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ARACHIS HYPOGAEA; . AUTHOR S.K.NATCHIAR,O.SRINIVAS,N.MITRA,A.SUROLIA,N.JAYARAMAN, . 928 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32759.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 640 69.0 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 . 396 42.7 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 . 117 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 2.0 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 6 3 0 3 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 50 0, 0.0 2,-0.7 0, 0.0 241,-0.4 0.000 360.0 360.0 360.0 90.6 80.1 52.4 35.8 2 2 A E E +A 229 0A 14 227,-2.7 227,-2.8 239,-0.1 2,-0.4 -0.806 360.0 179.2 -92.9 113.8 82.4 49.3 35.7 3 3 A T E -A 228 0A 27 -2,-0.7 2,-0.4 237,-0.2 237,-0.3 -0.933 22.7-171.9-124.5 140.5 86.0 50.4 36.1 4 4 A V E +A 227 0A 18 223,-2.0 223,-2.5 -2,-0.4 2,-0.3 -0.992 22.3 161.1-123.2 125.5 89.4 48.6 36.3 5 5 A S E +A 226 0A 39 -2,-0.4 2,-0.3 221,-0.2 221,-0.2 -0.971 3.8 152.8-151.7 135.4 92.4 50.7 37.3 6 6 A F E -A 225 0A 25 219,-1.8 219,-2.0 -2,-0.3 2,-0.2 -0.847 22.6-148.2-146.3 179.4 95.9 50.0 38.6 7 7 A N E -A 224 0A 71 -2,-0.3 2,-0.6 217,-0.2 217,-0.3 -0.737 4.6-169.0-164.7 110.4 99.4 51.5 38.6 8 8 A F E +A 223 0A 17 215,-3.9 215,-2.7 -2,-0.2 3,-0.1 -0.899 13.0 170.7-103.9 122.1 102.8 49.9 38.6 9 9 A N S S- 0 0 80 -2,-0.6 2,-0.3 1,-0.3 -1,-0.1 0.577 83.1 -7.1 -98.1 -19.3 105.8 52.2 39.2 10 10 A S S S- 0 0 46 224,-0.2 -1,-0.3 -3,-0.1 2,-0.2 -0.918 75.4-126.5-160.7 175.2 107.9 49.1 39.6 11 11 A F - 0 0 13 19,-1.7 2,-0.3 -2,-0.3 224,-0.0 -0.764 12.6-153.5-129.5 175.1 107.3 45.3 39.7 12 12 A S > - 0 0 23 -2,-0.2 3,-1.7 3,-0.1 2,-0.9 -0.979 27.7-113.8-155.2 138.9 108.2 42.5 42.0 13 13 A E T 3 S+ 0 0 167 -2,-0.3 -2,-0.0 1,-0.2 12,-0.0 -0.620 109.9 34.8 -70.3 106.2 108.7 38.7 41.7 14 14 A G T 3 S+ 0 0 36 -2,-0.9 -1,-0.2 1,-0.4 -3,-0.0 0.166 74.4 131.2 135.1 -20.8 105.8 37.6 43.9 15 15 A N X - 0 0 8 -3,-1.7 3,-1.4 1,-0.2 -1,-0.4 -0.511 47.2-151.9 -65.8 120.0 103.1 40.1 43.2 16 16 A P T 3 S+ 0 0 12 0, 0.0 -1,-0.2 0, 0.0 269,-0.1 0.702 86.9 77.3 -67.4 -17.1 100.0 38.0 42.4 17 17 A A T 3 S+ 0 0 5 32,-0.1 32,-3.2 1,-0.1 2,-0.4 0.514 90.2 65.2 -70.8 -4.1 98.6 40.9 40.2 18 18 A I E < -H 48 0B 9 -3,-1.4 2,-0.4 30,-0.3 30,-0.2 -0.971 66.4-151.3-132.2 127.7 101.0 39.8 37.4 19 19 A N E -H 47 0B 52 28,-2.4 28,-2.4 -2,-0.4 2,-0.5 -0.773 14.3-156.2 -91.9 130.7 101.3 36.7 35.2 20 20 A F E -H 46 0B 75 -2,-0.4 2,-0.4 26,-0.2 26,-0.2 -0.938 12.9-178.6-111.3 121.1 104.8 35.9 34.0 21 21 A Q E > -H 45 0B 20 24,-3.2 24,-3.1 -2,-0.5 3,-0.7 -0.941 48.5 -18.7-119.7 140.8 105.1 33.8 30.8 22 22 A G E 3 S-H 44 0B 54 -2,-0.4 22,-0.3 22,-0.2 13,-0.1 -0.331 121.0 -8.6 73.7-148.6 108.3 32.6 29.2 23 23 A D T 3 S+ 0 0 27 20,-3.0 21,-0.2 11,-0.2 -1,-0.2 0.295 89.6 140.4 -71.2 9.6 111.8 34.1 29.8 24 24 A V < + 0 0 21 -3,-0.7 2,-0.3 19,-0.2 10,-0.2 -0.175 24.7 174.8 -56.0 149.6 110.4 37.0 31.8 25 25 A T E -B 33 0A 66 8,-1.8 8,-3.9 10,-0.0 2,-0.5 -0.980 28.5-125.9-154.6 150.0 112.5 38.0 34.8 26 26 A V E -B 32 0A 32 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.910 27.0-136.6-105.8 123.1 112.3 40.9 37.4 27 27 A L > - 0 0 53 4,-2.7 3,-2.8 -2,-0.5 -16,-0.2 -0.415 24.1-109.7 -78.0 152.0 115.4 43.0 37.9 28 28 A S T 3 S+ 0 0 141 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.623 118.5 57.3 -53.5 -14.9 116.8 44.1 41.3 29 29 A N T 3 S- 0 0 94 2,-0.1 -1,-0.3 -19,-0.0 3,-0.1 0.269 123.5 -99.0-102.6 10.2 115.7 47.6 40.4 30 30 A G S < S+ 0 0 10 -3,-2.8 -19,-1.7 1,-0.3 -2,-0.1 0.238 82.4 126.7 95.6 -16.6 112.0 46.8 39.8 31 31 A N - 0 0 14 -21,-0.2 -4,-2.7 -5,-0.1 2,-0.4 -0.307 56.8-129.2 -71.9 160.5 112.2 46.6 36.0 32 32 A I E -BC 26 220A 0 188,-1.7 188,-2.2 -6,-0.2 2,-0.6 -0.918 13.4-151.1-109.4 135.9 110.9 43.5 34.2 33 33 A Q E -BC 25 219A 33 -8,-3.9 -8,-1.8 -2,-0.4 186,-0.2 -0.956 6.9-166.7-110.3 116.0 113.2 42.0 31.7 34 34 A L + 0 0 0 184,-2.5 2,-0.3 -2,-0.6 174,-0.2 0.744 63.3 45.3 -75.7 -26.3 111.2 40.3 28.9 35 35 A T S S- 0 0 5 183,-0.5 2,-0.7 8,-0.1 183,-0.2 -0.921 71.1-128.1-127.8 151.7 113.9 38.3 27.2 36 36 A N > - 0 0 67 -2,-0.3 3,-1.5 1,-0.1 6,-0.2 -0.838 17.2-156.0 -93.4 114.2 116.8 36.0 28.2 37 37 A L T 3 S+ 0 0 38 -2,-0.7 -1,-0.1 1,-0.3 5,-0.0 0.746 91.1 51.9 -62.7 -28.0 120.0 37.2 26.4 38 38 A N T 3 S+ 0 0 141 2,-0.1 2,-0.3 177,-0.0 -1,-0.3 0.330 97.7 87.1 -93.6 8.9 121.7 33.8 26.5 39 39 A K S X S- 0 0 100 -3,-1.5 3,-0.6 172,-0.0 2,-0.3 -0.802 75.0-123.8-109.7 151.0 118.7 32.0 25.0 40 40 A V T 3 S+ 0 0 72 -2,-0.3 172,-0.2 1,-0.2 171,-0.1 -0.716 92.5 1.3 -91.4 139.5 117.9 31.4 21.3 41 41 A N T 3 S- 0 0 59 -2,-0.3 -1,-0.2 173,-0.2 170,-0.2 0.888 92.2-166.5 50.2 44.5 114.4 32.5 20.1 42 42 A S < - 0 0 4 -3,-0.6 168,-1.5 169,-0.3 2,-0.3 -0.245 12.4-174.7 -62.7 145.8 113.7 33.9 23.5 43 43 A V E + I 0 209B 11 166,-0.2 -20,-3.0 59,-0.1 2,-0.4 -0.964 8.0 168.7-147.0 127.0 110.2 34.9 24.4 44 44 A G E +HI 22 208B 0 164,-1.8 164,-1.4 -2,-0.3 2,-0.3 -0.999 5.6 179.8-141.1 135.7 108.9 36.6 27.6 45 45 A R E -HI 21 207B 2 -24,-3.1 -24,-3.2 -2,-0.4 2,-0.4 -0.980 12.1-159.6-137.6 149.3 105.6 38.1 28.4 46 46 A V E -HI 20 206B 4 160,-2.4 160,-2.2 -2,-0.3 2,-0.3 -0.982 15.7-175.3-127.5 139.3 104.0 39.8 31.3 47 47 A L E -HI 19 205B 2 -28,-2.4 -28,-2.4 -2,-0.4 2,-0.5 -0.939 35.3-102.9-134.7 157.1 100.2 40.2 31.9 48 48 A Y E -H 18 0B 9 156,-2.6 -30,-0.3 -2,-0.3 156,-0.2 -0.694 36.5-137.3 -76.9 122.9 97.8 41.8 34.3 49 49 A A S S+ 0 0 9 -32,-3.2 -1,-0.2 -2,-0.5 -31,-0.1 0.916 81.9 71.6 -47.6 -58.0 96.6 38.9 36.4 50 50 A M S S- 0 0 32 -33,-0.3 2,-0.2 1,-0.1 200,-0.1 -0.410 87.2-121.8 -68.4 130.9 92.9 39.8 36.5 51 51 A P - 0 0 15 0, 0.0 2,-0.5 0, 0.0 152,-0.2 -0.495 25.5-140.1 -71.5 142.2 91.0 39.3 33.3 52 52 A V E -J 202 0B 2 150,-3.2 150,-2.9 -2,-0.2 2,-1.1 -0.912 3.0-139.4-110.2 130.3 89.4 42.5 32.0 53 53 A R E +J 201 0B 23 -2,-0.5 148,-0.2 148,-0.2 147,-0.1 -0.725 21.8 179.3 -88.1 94.6 85.9 42.6 30.5 54 54 A I + 0 0 8 146,-1.2 9,-3.7 -2,-1.1 2,-0.3 0.681 65.8 11.2 -70.9 -21.2 86.3 45.0 27.5 55 55 A W B S-O 62 0C 39 145,-0.7 2,-0.3 7,-0.3 7,-0.2 -0.991 73.4-117.8-157.1 154.3 82.7 44.7 26.3 56 56 A S > - 0 0 3 5,-2.2 4,-0.9 -2,-0.3 191,-0.0 -0.740 2.4-153.5-100.7 143.5 79.3 43.2 27.5 57 57 A S T 4 S+ 0 0 92 -2,-0.3 -1,-0.1 2,-0.1 0, 0.0 0.728 101.3 46.1 -79.4 -23.9 77.2 40.5 25.9 58 58 A A T 4 S+ 0 0 85 1,-0.1 -1,-0.1 3,-0.1 -2,-0.0 0.872 124.2 25.9 -86.6 -42.7 74.1 42.2 27.5 59 59 A T T 4 S- 0 0 53 2,-0.2 -2,-0.1 171,-0.0 3,-0.1 0.557 89.0-136.1 -99.5 -11.7 74.6 45.9 26.7 60 60 A G < + 0 0 25 -4,-0.9 2,-0.2 1,-0.3 -3,-0.1 0.517 56.3 146.7 67.9 1.7 76.7 45.5 23.6 61 61 A N - 0 0 56 169,-0.2 -5,-2.2 170,-0.1 2,-0.4 -0.497 39.9-151.7 -76.2 138.6 78.8 48.3 25.1 62 62 A V B -O 55 0C 16 -7,-0.2 -7,-0.3 -2,-0.2 168,-0.2 -0.903 20.1-125.9-108.1 135.2 82.5 48.4 24.6 63 63 A A - 0 0 9 -9,-3.7 2,-0.3 -2,-0.4 166,-0.2 -0.358 14.6-133.8 -80.4 161.7 84.6 50.0 27.3 64 64 A S E -D 228 0A 11 164,-2.2 164,-2.3 820,-0.2 2,-0.3 -0.775 22.8-162.8-109.3 157.6 87.1 52.8 26.8 65 65 A F E -DE 227 167A 4 102,-1.7 102,-2.5 -2,-0.3 2,-0.4 -0.994 19.7-162.5-151.8 147.7 90.6 52.9 28.2 66 66 A L E +DE 226 166A 26 160,-2.7 160,-2.7 -2,-0.3 2,-0.3 -0.959 26.0 159.8-119.1 137.7 93.6 55.1 29.0 67 67 A T E -DE 225 165A 0 98,-1.9 98,-3.2 -2,-0.4 2,-0.3 -0.964 13.5-178.8-161.0 140.8 96.9 53.6 29.7 68 68 A S E +DE 224 164A 42 156,-1.1 156,-2.6 -2,-0.3 2,-0.3 -0.962 9.7 160.4-140.0 158.5 100.5 54.8 29.6 69 69 A F E -DE 223 163A 6 94,-2.4 94,-3.2 -2,-0.3 2,-0.4 -0.978 24.9-132.5-166.8 168.1 103.9 53.1 30.3 70 70 A S E +DE 222 162A 8 152,-1.2 151,-2.4 -2,-0.3 152,-1.5 -0.995 22.6 172.2-137.0 142.2 107.6 53.3 29.7 71 71 A F E -DE 220 161A 1 90,-1.4 90,-2.5 -2,-0.4 2,-0.4 -0.840 18.9-136.2-139.0 174.9 110.2 50.7 28.5 72 72 A E E -DE 219 160A 23 147,-2.6 147,-2.9 -2,-0.3 2,-0.6 -0.987 5.9-166.5-142.7 132.5 113.8 50.4 27.5 73 73 A M E -D 218 0A 3 86,-0.6 85,-1.2 -2,-0.4 86,-0.4 -0.949 17.2-178.5-118.5 112.8 115.6 48.7 24.7 74 74 A K E -D 217 0A 95 143,-1.6 143,-2.3 -2,-0.6 83,-0.1 -0.886 21.9-124.6-114.0 142.6 119.4 48.4 25.1 75 75 A D - 0 0 72 -2,-0.4 2,-0.3 141,-0.2 141,-0.1 -0.287 22.1-157.2 -76.5 165.4 121.9 46.9 22.7 76 76 A I - 0 0 33 139,-0.3 2,-0.6 3,-0.3 3,-0.5 -0.976 32.1 -72.9-141.4 152.5 124.4 44.1 23.7 77 77 A K S S- 0 0 182 -2,-0.3 3,-0.1 1,-0.3 139,-0.0 -0.819 104.1 -14.8 -88.5 125.0 127.7 43.0 22.3 78 78 A D S S+ 0 0 135 -2,-0.6 -1,-0.3 1,-0.2 2,-0.1 -0.694 98.3 97.7-138.8 48.0 127.4 41.6 19.9 79 79 A Y S S- 0 0 84 -3,-0.5 -3,-0.3 1,-0.1 135,-0.2 -0.319 77.3 -84.7 -85.0 172.1 124.0 40.4 18.8 80 80 A D B -p 214 0D 90 133,-2.9 2,-1.8 1,-0.1 135,-1.7 -0.642 45.6-111.1 -79.2 131.1 121.6 42.1 16.4 81 81 A P - 0 0 52 0, 0.0 2,-0.3 0, 0.0 135,-0.2 -0.458 65.9-172.7 -65.0 86.7 119.5 44.7 18.1 82 82 A A - 0 0 1 -2,-1.8 129,-0.2 133,-0.3 2,-0.1 -0.961 13.2 -13.6-152.0 163.6 116.2 42.7 17.8 83 83 A D - 0 0 5 -2,-0.3 41,-2.3 127,-0.2 42,-0.5 -0.932 62.7-137.2-108.2 -28.8 113.3 42.1 17.9 84 84 A G E -KL 123 209B 0 125,-0.7 125,-0.8 39,-0.2 2,-0.4 -0.913 15.4 -75.7 147.4-174.4 111.1 44.5 19.9 85 85 A I E -KL 122 208B 0 37,-1.1 37,-2.2 -2,-0.3 2,-0.4 -0.991 29.5-168.9-132.1 136.4 108.3 45.0 22.3 86 86 A I E -KL 121 207B 0 121,-2.5 121,-2.1 -2,-0.4 2,-0.5 -0.984 13.2-152.5-130.1 134.3 104.5 44.8 21.9 87 87 A F E +KL 120 206B 4 33,-2.6 33,-2.2 -2,-0.4 2,-0.3 -0.893 37.3 173.1 -98.0 126.4 101.7 45.9 24.1 88 88 A F E -KL 119 205B 0 117,-2.0 117,-1.4 -2,-0.5 2,-0.4 -0.943 37.7-144.6-144.8 164.3 98.7 43.7 23.5 89 89 A I E +KL 118 204B 7 29,-3.8 29,-2.6 -2,-0.3 115,-0.2 -0.943 35.4 151.9-120.2 139.7 95.2 42.6 24.3 90 90 A A E - 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