==== 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 1V6K . 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) . 32325.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 655 70.6 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 . 399 43.0 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 . 126 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 6.9 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 5 3 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 51 0, 0.0 2,-0.7 0, 0.0 241,-0.3 0.000 360.0 360.0 360.0 165.6 18.0 10.7 40.2 2 2 A E E +A 229 0A 10 227,-2.8 227,-2.4 239,-0.1 2,-0.4 -0.916 360.0 179.6-112.5 106.2 20.3 13.7 40.1 3 3 A T E -A 228 0A 25 -2,-0.7 2,-0.5 237,-0.3 237,-0.3 -0.908 18.6-170.6-116.9 133.2 23.9 12.6 39.6 4 4 A V E +A 227 0A 11 223,-2.0 223,-2.1 -2,-0.4 2,-0.4 -0.976 20.3 170.1-116.1 125.6 27.1 14.6 39.4 5 5 A S E +A 226 0A 50 -2,-0.5 2,-0.3 233,-0.3 233,-0.3 -0.991 7.2 161.4-143.6 133.4 30.1 12.6 38.3 6 6 A F E -A 225 0A 18 219,-2.0 219,-2.6 -2,-0.4 2,-0.4 -0.991 17.7-157.2-148.0 151.6 33.6 13.5 37.3 7 7 A N E -A 224 0A 63 -2,-0.3 2,-0.6 229,-0.3 229,-0.3 -0.964 5.2-173.3-137.6 119.0 37.0 11.7 37.0 8 8 A F E +A 223 0A 13 215,-3.1 215,-2.4 -2,-0.4 3,-0.1 -0.932 16.0 164.7-114.3 110.7 40.4 13.3 37.1 9 9 A N S S- 0 0 90 -2,-0.6 2,-0.3 1,-0.4 -1,-0.1 0.580 82.7 -1.8 -94.4 -14.6 43.4 11.1 36.3 10 10 A S S S- 0 0 40 224,-0.2 -1,-0.4 -3,-0.1 2,-0.3 -0.953 74.5-129.9-165.1 160.0 45.5 14.2 35.8 11 11 A F - 0 0 10 19,-2.7 2,-0.3 -2,-0.3 224,-0.0 -0.795 13.6-168.8-119.9 164.4 44.9 17.9 35.8 12 12 A S > - 0 0 23 -2,-0.3 3,-1.4 3,-0.0 6,-0.1 -0.969 29.6-112.0-151.7 132.3 45.8 20.7 33.4 13 13 A E T 3 S+ 0 0 137 -2,-0.3 12,-0.0 1,-0.2 0, 0.0 -0.328 101.6 43.6 -63.5 150.2 45.6 24.4 33.9 14 14 A G T 3 S+ 0 0 45 1,-0.3 -1,-0.2 4,-0.2 0, 0.0 0.199 74.6 134.1 100.1 -17.2 42.9 26.0 31.8 15 15 A N X - 0 0 7 -3,-1.4 3,-1.9 1,-0.2 -1,-0.3 -0.573 48.7-151.7 -70.9 114.1 40.3 23.4 32.6 16 16 A P T 3 S+ 0 0 13 0, 0.0 -1,-0.2 0, 0.0 269,-0.1 0.641 89.6 70.4 -61.8 -15.0 37.1 25.3 33.4 17 17 A A T 3 S+ 0 0 4 32,-0.1 32,-2.8 266,-0.1 2,-0.4 0.563 94.3 65.0 -80.3 -6.9 35.9 22.4 35.6 18 18 A I E < -H 48 0B 11 -3,-1.9 2,-0.4 30,-0.3 30,-0.2 -0.966 65.2-159.1-125.4 128.5 38.6 23.2 38.2 19 19 A N E -H 47 0B 53 28,-2.8 28,-2.3 -2,-0.4 2,-0.4 -0.838 10.4-155.6-101.4 136.6 39.0 26.3 40.3 20 20 A F E -H 46 0B 75 -2,-0.4 2,-0.4 26,-0.2 26,-0.2 -0.927 10.3-175.7-114.4 136.7 42.4 27.2 41.8 21 21 A Q E -H 45 0B 21 24,-2.8 24,-2.7 -2,-0.4 2,-0.1 -0.997 51.1 -20.8-131.6 136.2 42.8 29.3 44.9 22 22 A G E S-H 44 0B 53 -2,-0.4 2,-1.3 22,-0.2 22,-0.3 -0.342 120.3 -3.2 74.8-147.7 46.1 30.4 46.4 23 23 A D S S+ 0 0 31 20,-2.9 2,-0.2 11,-0.1 -1,-0.2 -0.131 85.8 143.1 -78.8 41.5 49.5 28.9 45.8 24 24 A V + 0 0 25 -2,-1.3 2,-0.3 21,-0.2 10,-0.2 -0.594 23.5 179.7 -84.2 145.2 48.2 26.0 43.6 25 25 A T E -B 33 0A 63 8,-2.1 8,-3.1 -2,-0.2 2,-0.6 -0.999 24.1-133.6-145.4 142.8 50.4 24.9 40.6 26 26 A V E -B 32 0A 24 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.870 22.5-146.8-100.6 123.7 50.0 22.2 38.0 27 27 A L > - 0 0 49 4,-3.0 3,-1.6 -2,-0.6 -16,-0.1 -0.395 26.0-110.4 -81.9 163.2 53.1 20.1 37.3 28 28 A S T 3 S+ 0 0 137 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.750 116.2 64.2 -66.8 -23.0 53.9 18.7 33.9 29 29 A N T 3 S- 0 0 98 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.492 121.6-106.3 -78.4 -1.5 53.1 15.2 35.1 30 30 A G S < S+ 0 0 8 -3,-1.6 -19,-2.7 1,-0.3 2,-0.1 0.383 79.7 130.7 93.6 -4.7 49.5 16.3 35.6 31 31 A N - 0 0 15 -21,-0.2 -4,-3.0 -5,-0.1 2,-0.5 -0.466 54.7-129.1 -81.4 154.8 49.8 16.4 39.3 32 32 A I E -BC 26 220A 0 188,-2.3 188,-2.2 -6,-0.2 2,-0.6 -0.898 11.6-155.7-106.2 131.8 48.6 19.4 41.4 33 33 A Q E -BC 25 219A 29 -8,-3.1 -8,-2.1 -2,-0.5 186,-0.2 -0.944 5.9-163.8-106.6 117.4 51.0 20.8 43.9 34 34 A L + 0 0 0 184,-2.5 2,-0.3 -2,-0.6 174,-0.2 0.856 63.6 40.5 -73.3 -37.5 48.9 22.7 46.6 35 35 A T S S- 0 0 4 183,-0.3 2,-0.6 181,-0.2 183,-0.2 -0.780 75.5-120.5-116.4 161.0 51.5 24.8 48.3 36 36 A N > - 0 0 59 -2,-0.3 3,-1.3 1,-0.1 6,-0.2 -0.867 16.2-150.4 -97.0 120.3 54.5 26.9 47.3 37 37 A L T 3 S+ 0 0 35 -2,-0.6 -1,-0.1 1,-0.2 180,-0.0 0.627 94.3 52.3 -65.9 -14.1 57.7 25.7 48.9 38 38 A N T 3 S+ 0 0 143 2,-0.1 2,-0.4 177,-0.0 -1,-0.2 0.441 93.6 87.5-102.0 -1.6 59.2 29.2 48.9 39 39 A K S X S- 0 0 92 -3,-1.3 3,-0.8 -16,-0.1 2,-0.2 -0.819 74.0-125.9-105.9 141.0 56.4 31.1 50.5 40 40 A V T 3 S+ 0 0 71 -2,-0.4 172,-0.2 1,-0.3 171,-0.1 -0.555 95.8 4.5 -75.7 141.0 55.7 31.6 54.2 41 41 A N T 3 S- 0 0 57 -2,-0.2 -1,-0.3 1,-0.2 170,-0.2 0.866 90.5-168.9 50.1 45.4 52.3 30.5 55.3 42 42 A S < - 0 0 3 -3,-0.8 168,-1.8 169,-0.3 2,-0.4 -0.375 9.7-172.7 -68.2 139.0 51.4 29.1 51.9 43 43 A V E + I 0 209B 9 166,-0.2 -20,-2.9 -2,-0.1 2,-0.4 -0.996 5.8 176.0-135.7 129.3 47.9 28.0 51.2 44 44 A G E +HI 22 208B 0 164,-2.3 164,-2.1 -2,-0.4 2,-0.3 -0.999 1.7 176.3-135.7 136.0 46.7 26.2 48.1 45 45 A R E -HI 21 207B 3 -24,-2.7 -24,-2.8 -2,-0.4 2,-0.4 -0.993 11.4-166.3-140.4 145.7 43.2 24.9 47.3 46 46 A V E -HI 20 206B 3 160,-2.2 160,-2.2 -2,-0.3 2,-0.3 -0.992 14.2-175.5-131.1 138.0 41.6 23.3 44.3 47 47 A L E -HI 19 205B 1 -28,-2.3 -28,-2.8 -2,-0.4 2,-0.6 -0.964 37.8-105.2-135.7 151.4 37.9 22.9 43.9 48 48 A Y E -H 18 0B 10 156,-2.5 156,-0.3 -2,-0.3 -30,-0.3 -0.680 39.2-138.4 -72.0 120.3 35.5 21.3 41.5 49 49 A A S S+ 0 0 17 -32,-2.8 -1,-0.2 -2,-0.6 -31,-0.1 0.789 79.7 78.8 -54.3 -34.0 34.3 24.5 39.8 50 50 A M S S- 0 0 10 -33,-0.4 154,-0.3 1,-0.0 2,-0.2 -0.611 83.3-125.6 -83.1 130.7 30.7 23.4 39.6 51 51 A P - 0 0 18 0, 0.0 2,-0.4 0, 0.0 152,-0.2 -0.530 24.7-144.4 -73.3 142.4 28.6 23.8 42.8 52 52 A V E -J 202 0B 2 150,-3.5 150,-2.9 -2,-0.2 2,-1.1 -0.884 8.0-133.1-109.1 140.3 26.9 20.5 43.8 53 53 A R E +J 201 0B 19 -2,-0.4 148,-0.2 148,-0.2 147,-0.1 -0.772 27.1 175.4 -92.8 96.5 23.5 20.3 45.4 54 54 A I + 0 0 1 146,-1.6 9,-4.0 -2,-1.1 2,-0.3 0.667 66.3 18.2 -76.2 -19.4 24.0 17.9 48.3 55 55 A W B -O 62 0C 37 145,-0.8 2,-0.5 7,-0.3 7,-0.2 -0.994 69.6-130.7-151.3 153.1 20.4 18.3 49.6 56 56 A S > - 0 0 8 5,-2.2 4,-3.1 -2,-0.3 5,-0.3 -0.922 0.9-159.7-110.4 123.8 17.0 19.6 48.5 57 57 A S T 4 S+ 0 0 79 -2,-0.5 -1,-0.1 1,-0.2 0, 0.0 0.737 96.5 56.6 -68.6 -22.0 15.0 22.0 50.5 58 58 A A T 4 S+ 0 0 90 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.910 124.7 17.3 -76.0 -44.5 12.0 20.8 48.5 59 59 A T T 4 S- 0 0 58 2,-0.1 -2,-0.2 171,-0.1 -1,-0.1 0.615 92.6-132.1-102.3 -17.6 12.2 17.1 49.4 60 60 A G < + 0 0 26 -4,-3.1 2,-0.2 1,-0.3 -3,-0.2 0.602 57.8 145.2 75.0 9.5 14.5 17.4 52.4 61 61 A N - 0 0 48 -5,-0.3 -5,-2.2 169,-0.2 2,-0.4 -0.528 39.7-147.7 -81.8 147.4 16.6 14.6 50.8 62 62 A V B -O 55 0C 14 -7,-0.2 168,-0.3 -2,-0.2 -7,-0.3 -0.880 20.1-117.0-113.0 147.1 20.4 14.5 51.2 63 63 A A - 0 0 1 -9,-4.0 2,-0.3 -2,-0.4 166,-0.2 -0.488 16.6-139.3 -82.6 152.1 22.7 13.1 48.5 64 64 A S E -D 228 0A 9 164,-2.4 164,-2.6 820,-0.2 2,-0.3 -0.800 26.0-168.2-101.9 150.4 24.9 10.1 49.0 65 65 A F E -DE 227 167A 0 102,-1.8 102,-3.1 -2,-0.3 2,-0.4 -0.995 20.1-162.9-145.1 153.3 28.3 10.3 47.5 66 66 A L E +DE 226 166A 23 160,-3.2 160,-2.0 -2,-0.3 2,-0.3 -0.996 21.4 164.2-131.7 124.5 31.3 8.1 46.7 67 67 A T E -DE 225 165A 1 98,-2.2 98,-3.2 -2,-0.4 2,-0.4 -0.999 13.3-174.6-143.8 143.0 34.7 9.6 46.0 68 68 A S E +DE 224 164A 44 156,-1.6 156,-2.8 -2,-0.3 2,-0.3 -0.988 11.8 165.0-135.8 146.1 38.2 8.3 45.9 69 69 A F E -DE 223 163A 4 94,-1.9 94,-3.0 -2,-0.4 2,-0.4 -0.975 23.2-139.9-154.4 161.9 41.5 10.2 45.4 70 70 A S E +DE 222 162A 14 152,-1.5 151,-2.6 -2,-0.3 152,-1.3 -0.978 22.0 173.9-130.4 143.5 45.2 9.7 45.8 71 71 A F E -DE 220 161A 1 90,-1.9 90,-2.9 -2,-0.4 2,-0.4 -0.884 16.9-144.9-140.6 171.8 47.7 12.2 47.1 72 72 A E E -DE 219 160A 17 147,-2.2 147,-3.0 -2,-0.3 2,-0.5 -0.994 4.5-167.3-145.4 135.4 51.4 12.4 48.0 73 73 A M E -DE 218 159A 3 86,-0.6 85,-2.4 83,-0.4 86,-0.5 -0.989 13.3-176.8-121.6 127.5 53.3 14.3 50.7 74 74 A K E -D 217 0A 92 143,-1.5 143,-2.8 -2,-0.5 2,-0.1 -0.993 24.0-122.4-129.6 134.2 57.1 14.4 50.4 75 75 A D - 0 0 77 -2,-0.4 2,-0.3 141,-0.2 141,-0.1 -0.379 22.0-151.9 -69.7 147.3 59.5 16.0 52.8 76 76 A I - 0 0 36 139,-0.5 3,-0.4 3,-0.3 139,-0.1 -0.886 34.7 -84.0-118.0 153.8 61.8 18.7 51.5 77 77 A K S S+ 0 0 169 -2,-0.3 2,-1.3 1,-0.2 -1,-0.1 -0.268 105.4 2.8 -56.3 154.5 65.2 19.4 53.0 78 78 A D S S+ 0 0 134 1,-0.1 -1,-0.2 -3,-0.0 2,-0.2 -0.228 103.7 98.6 58.2 -29.1 65.3 21.6 56.1 79 79 A Y S S- 0 0 83 -2,-1.3 -3,-0.3 -3,-0.4 135,-0.2 -0.543 79.7-106.9 -89.3 150.6 61.6 22.3 56.6 80 80 A D B -p 214 0D 93 133,-2.5 135,-1.8 -2,-0.2 2,-1.1 -0.554 41.3-112.2 -67.8 126.9 59.3 20.5 59.1 81 81 A P - 0 0 47 0, 0.0 2,-0.3 0, 0.0 135,-0.2 -0.506 64.0-164.5 -66.7 100.6 57.0 18.2 57.1 82 82 A A - 0 0 1 -2,-1.1 129,-0.1 129,-0.1 21,-0.1 -0.947 14.9 -19.0-152.5 168.0 53.7 20.0 57.7 83 83 A D - 0 0 4 -2,-0.3 41,-1.9 132,-0.1 42,-0.8 -0.976 66.2-140.1-109.6 -12.2 50.9 20.7 57.9 84 84 A G E -KL 123 209B 0 125,-0.5 125,-0.9 39,-0.3 2,-0.3 -0.725 18.3 -69.2 124.6-170.9 48.9 18.4 55.7 85 85 A I E -KL 122 208B 0 37,-1.7 37,-3.2 -2,-0.2 2,-0.4 -0.922 31.7-162.4-122.3 147.9 46.0 18.0 53.3 86 86 A I E -KL 121 207B 0 121,-2.6 121,-2.1 -2,-0.3 2,-0.7 -0.997 12.2-149.8-134.8 134.9 42.3 18.3 53.8 87 87 A F E +KL 120 206B 2 33,-2.9 33,-2.7 -2,-0.4 2,-0.3 -0.914 37.8 180.0 -98.3 116.1 39.4 17.1 51.6 88 88 A F E -KL 119 205B 2 117,-2.6 117,-2.0 -2,-0.7 2,-0.4 -0.826 35.3-151.7-128.5 164.9 36.6 19.5 52.3 89 89 A I E +KL 118 204B 3 29,-3.0 29,-2.4 -2,-0.3 115,-0.2 -0.999 34.0 159.2-127.2 123.8 33.0 20.5 51.5 90 90 A A E - 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