==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LECTIN 20-MAR-04 1UZZ . COMPND 2 MOLECULE: LECTIN (ECL); . SOURCE 2 ORGANISM_SCIENTIFIC: ERYTHRINA CRISTA-GALLI; . AUTHOR K.TURTON,R.NATESH,N.THIYAGARAJAN,J.A.CHADDOCK,K.R.ACHARYA . 958 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39482.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 608 63.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 389 40.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 84 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 24 2.5 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+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 . 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 0 PARALLEL BRIDGES PER LADDER . 8 12 0 4 8 8 11 9 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 0 4 4 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 V 0 0 116 0, 0.0 2,-0.7 0, 0.0 238,-0.0 0.000 360.0 360.0 360.0 126.7 6.1 20.2 16.4 2 2 A E E +A 237 0A 87 235,-2.0 235,-3.1 56,-0.1 2,-0.3 -0.882 360.0 175.1-100.3 113.5 4.3 16.8 16.6 3 3 A T E +A 236 0A 78 -2,-0.7 2,-0.3 233,-0.2 233,-0.2 -0.891 12.8 177.6-122.3 150.0 6.5 14.1 15.2 4 4 A I E +A 235 0A 38 231,-1.8 231,-2.3 -2,-0.3 2,-0.3 -0.989 9.3 162.1-146.3 147.3 6.1 10.3 14.9 5 5 A S E +A 234 0A 72 -2,-0.3 2,-0.3 229,-0.2 229,-0.2 -0.971 12.0 179.5-166.6 151.1 8.3 7.7 13.3 6 6 A F E -A 233 0A 18 227,-2.2 227,-2.3 -2,-0.3 2,-0.3 -0.971 7.3-163.6-149.8 157.6 9.1 4.0 13.2 7 7 A S E -A 232 0A 95 -2,-0.3 2,-0.8 225,-0.2 225,-0.2 -0.865 6.0-171.7-153.3 115.5 11.5 1.8 11.3 8 8 A F E -A 231 0A 21 223,-2.9 223,-1.8 -2,-0.3 3,-0.1 -0.884 3.4-177.7-107.0 99.0 11.4 -2.0 10.9 9 9 A S S S- 0 0 88 -2,-0.8 2,-0.3 221,-0.2 -1,-0.2 0.750 85.1 -5.8 -66.0 -19.6 14.6 -3.1 9.2 10 10 A E S S- 0 0 114 221,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.925 83.7-105.8-158.8 171.6 12.9 -6.4 9.4 11 11 A F - 0 0 4 19,-1.9 -3,-0.0 -2,-0.3 219,-0.0 -0.840 24.7-160.6-110.9 148.2 9.7 -7.8 10.9 12 12 A E > - 0 0 99 -2,-0.3 3,-1.4 3,-0.1 16,-0.1 -0.992 23.9-116.4-131.9 131.1 9.4 -10.0 14.0 13 13 A P T 3 S+ 0 0 69 0, 0.0 3,-0.1 0, 0.0 14,-0.0 -0.402 101.1 23.2 -62.1 133.7 6.5 -12.3 15.1 14 14 A G T 3 S+ 0 0 77 1,-0.3 2,-0.2 4,-0.1 0, 0.0 -0.016 78.8 133.7 102.1 -33.1 5.0 -11.0 18.3 15 15 A N X - 0 0 40 -3,-1.4 3,-1.0 1,-0.2 -1,-0.3 -0.381 45.0-155.1 -56.2 117.7 6.1 -7.4 18.1 16 16 A N T 3 S+ 0 0 128 1,-0.2 -1,-0.2 -2,-0.2 3,-0.0 0.245 76.4 88.5 -83.9 13.9 2.9 -5.5 19.0 17 17 A D T 3 S+ 0 0 53 1,-0.1 37,-3.1 36,-0.1 2,-0.5 0.711 88.7 58.8 -79.6 -18.4 3.8 -2.3 17.3 18 18 A L E < S-H 53 0B 17 -3,-1.0 2,-0.5 35,-0.2 35,-0.2 -0.945 74.0-150.0-117.4 128.2 2.2 -3.9 14.2 19 19 A T E -H 52 0B 58 33,-3.0 33,-2.2 -2,-0.5 2,-0.4 -0.814 13.1-153.0 -93.5 127.2 -1.4 -5.1 13.9 20 20 A L E -H 51 0B 72 -2,-0.5 2,-0.3 31,-0.2 31,-0.2 -0.851 15.5-175.3-101.2 136.2 -1.9 -8.0 11.5 21 21 A Q E > -H 50 0B 35 29,-3.1 29,-2.1 -2,-0.4 3,-1.3 -0.965 48.2 -11.8-132.2 150.2 -5.3 -8.3 9.8 22 22 A G E 3 S-H 49 0B 65 -2,-0.3 27,-0.3 1,-0.2 13,-0.1 -0.436 126.6 -17.1 67.0-133.5 -6.8 -10.9 7.5 23 23 A A T 3 S+ 0 0 30 25,-2.4 -1,-0.2 11,-0.2 26,-0.2 0.565 97.8 124.0 -84.0 -11.8 -4.3 -13.4 6.1 24 24 A A < + 0 0 7 -3,-1.3 2,-0.3 10,-0.2 10,-0.2 -0.226 33.7 171.0 -55.5 132.7 -1.1 -11.4 6.8 25 25 A I E -B 33 0A 87 8,-1.8 8,-2.8 10,-0.1 2,-0.6 -0.992 32.6-129.8-143.8 150.1 1.5 -13.2 8.9 26 26 A I E -B 32 0A 21 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.901 30.5-140.1-101.1 119.8 5.1 -12.5 9.9 27 27 A T > - 0 0 24 4,-2.9 3,-2.5 -2,-0.6 -16,-0.1 -0.335 23.5-109.4 -76.4 161.1 7.4 -15.5 9.2 28 28 A Q T 3 S+ 0 0 175 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.834 120.6 62.4 -55.4 -35.2 10.1 -16.7 11.5 29 29 A S T 3 S- 0 0 97 2,-0.1 -1,-0.3 1,-0.1 -18,-0.1 0.496 122.9-108.3 -71.3 -3.1 12.6 -15.4 8.9 30 30 A G S < S+ 0 0 10 -3,-2.5 -19,-1.9 1,-0.3 2,-0.4 0.675 73.2 138.1 85.2 19.0 11.1 -12.0 9.6 31 31 A V - 0 0 25 -21,-0.1 -4,-2.9 -4,-0.0 2,-0.7 -0.794 50.3-134.1-100.6 138.6 9.2 -11.6 6.3 32 32 A L E -BC 26 228A 1 196,-2.8 196,-2.8 -2,-0.4 2,-0.9 -0.824 16.4-166.4 -95.0 112.3 5.7 -10.1 6.1 33 33 A Q E -BC 25 227A 35 -8,-2.8 -8,-1.8 -2,-0.7 194,-0.2 -0.840 5.7-176.3 -99.6 96.6 3.5 -12.2 3.9 34 34 A L S S+ 0 0 1 192,-2.0 2,-0.4 -2,-0.9 180,-0.3 0.838 71.9 43.8 -62.2 -35.8 0.5 -10.0 3.3 35 35 A T S S- 0 0 0 191,-0.2 191,-0.3 -3,-0.1 -10,-0.1 -0.918 104.1 -86.1-117.7 142.3 -1.3 -12.8 1.3 36 36 A K - 0 0 112 -2,-0.4 8,-2.7 7,-0.1 2,-0.6 -0.069 31.3-158.1 -46.9 128.1 -1.5 -16.5 2.2 37 37 A I B -N 43 0C 39 6,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.959 22.4-135.7-109.8 116.0 1.4 -18.8 1.2 38 38 A N > - 0 0 61 4,-2.9 3,-1.0 -2,-0.6 -1,-0.0 0.055 23.9-100.0 -63.4 177.6 0.1 -22.3 1.1 39 39 A Q T 3 S+ 0 0 205 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.781 120.7 61.6 -72.0 -27.8 1.9 -25.4 2.5 40 40 A N T 3 S- 0 0 111 2,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.457 122.4-105.7 -77.8 -0.5 3.2 -26.4 -1.0 41 41 A G S < S+ 0 0 54 -3,-1.0 -2,-0.1 1,-0.3 -1,-0.1 0.502 82.7 114.6 91.4 4.9 5.0 -23.1 -1.1 42 42 A M S S- 0 0 50 1,-0.0 -4,-2.9 182,-0.0 -1,-0.3 -0.744 71.4 -95.7-111.1 157.6 2.8 -21.2 -3.5 43 43 A P B -N 37 0C 12 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.510 37.4-131.8 -72.2 130.4 0.5 -18.1 -3.1 44 44 A A - 0 0 10 -8,-2.7 3,-0.3 -2,-0.3 180,-0.3 -0.589 15.6-129.8 -83.7 142.1 -3.2 -18.9 -2.5 45 45 A W S S+ 0 0 103 -2,-0.3 173,-0.1 1,-0.2 178,-0.1 -0.314 87.4 38.8 -80.8 170.5 -5.9 -17.1 -4.4 46 46 A D S S+ 0 0 87 171,-2.5 2,-0.4 176,-0.4 -1,-0.2 0.880 87.8 136.3 55.5 41.4 -8.8 -15.4 -2.8 47 47 A S + 0 0 11 -3,-0.3 169,-2.7 170,-0.1 2,-0.4 -0.951 30.2 179.1-123.3 141.9 -6.6 -14.0 -0.0 48 48 A T E + I 0 215B 33 -2,-0.4 -25,-2.4 167,-0.2 2,-0.3 -0.995 10.6 158.6-142.1 132.2 -6.5 -10.6 1.5 49 49 A G E +HI 22 214B 0 165,-2.4 165,-3.0 -2,-0.4 2,-0.3 -0.990 8.1 173.3-152.1 158.0 -4.2 -9.3 4.3 50 50 A R E -HI 21 213B 4 -29,-2.1 -29,-3.1 -2,-0.3 2,-0.4 -0.975 19.4-140.9-158.5 167.4 -2.8 -6.2 5.8 51 51 A T E -HI 20 212B 0 161,-2.2 161,-2.4 -2,-0.3 2,-0.3 -0.987 15.1-163.7-135.2 140.9 -0.8 -4.7 8.6 52 52 A L E -HI 19 211B 7 -33,-2.2 -33,-3.0 -2,-0.4 2,-0.4 -0.942 28.3-112.2-124.5 147.3 -1.4 -1.4 10.4 53 53 A Y E -H 18 0B 15 157,-2.5 157,-0.3 -2,-0.3 -35,-0.2 -0.675 30.1-130.8 -78.3 134.2 0.9 0.6 12.6 54 54 A T S S+ 0 0 67 -37,-3.1 -1,-0.1 -2,-0.4 -36,-0.1 0.775 85.6 64.3 -57.2 -34.2 -0.6 0.4 16.1 55 55 A K S S- 0 0 113 -38,-0.3 155,-0.3 155,-0.1 -2,-0.1 -0.754 83.5-122.8 -98.9 142.4 -0.4 4.1 16.9 56 56 A P - 0 0 57 0, 0.0 2,-0.4 0, 0.0 153,-0.2 -0.379 21.8-129.2 -76.7 158.0 -2.4 6.8 15.0 57 57 A V E -O 208 0D 1 151,-3.2 151,-2.1 -2,-0.1 2,-1.3 -0.928 8.1-132.6-114.4 132.1 -0.7 9.7 13.2 58 58 A H E +O 207 0D 25 -2,-0.4 149,-0.2 149,-0.2 3,-0.1 -0.690 35.7 166.4 -83.0 97.2 -1.6 13.4 13.6 59 59 A I - 0 0 0 147,-1.8 9,-3.3 -2,-1.3 2,-0.3 0.806 59.8 -3.9 -84.1 -35.0 -1.7 14.4 9.9 60 60 A W B -P 67 0E 28 146,-1.5 2,-0.5 7,-0.2 -1,-0.2 -0.991 57.3-133.6-157.3 159.9 -3.5 17.7 10.2 61 61 A D > - 0 0 34 5,-2.2 4,-2.5 -2,-0.3 5,-0.3 -0.956 5.1-159.1-123.5 114.7 -5.2 20.1 12.7 62 62 A M T 4 S+ 0 0 111 -2,-0.5 -1,-0.1 2,-0.2 139,-0.0 0.895 91.0 50.2 -55.2 -47.9 -8.5 21.7 12.0 63 63 A T T 4 S+ 0 0 131 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.955 123.1 27.2 -59.3 -57.0 -8.1 24.6 14.5 64 64 A T T 4 S- 0 0 82 2,-0.1 -1,-0.2 1,-0.0 -2,-0.2 0.698 96.6-135.2 -80.9 -20.3 -4.7 25.8 13.5 65 65 A G < + 0 0 25 -4,-2.5 -3,-0.2 1,-0.3 -2,-0.1 0.507 50.9 151.4 78.3 3.0 -5.0 24.6 9.9 66 66 A T - 0 0 31 -5,-0.3 -5,-2.2 172,-0.1 2,-0.4 -0.386 30.8-153.8 -70.2 146.1 -1.5 23.1 10.0 67 67 A V B -P 60 0E 20 -7,-0.2 -7,-0.2 -3,-0.1 2,-0.2 -0.980 10.7-125.7-126.5 136.0 -0.7 20.1 7.8 68 68 A A - 0 0 0 -9,-3.3 2,-0.4 -2,-0.4 169,-0.2 -0.461 10.7-145.9 -82.2 146.5 1.9 17.4 8.3 69 69 A S E +D 236 0A 41 167,-1.9 167,-2.5 -2,-0.2 2,-0.3 -0.834 29.1 174.8-103.9 147.0 4.6 16.4 5.8 70 70 A F E -DE 235 172A 7 102,-2.0 102,-3.4 -2,-0.4 2,-0.3 -0.938 22.6-162.3-149.7 172.8 5.5 12.8 5.7 71 71 A E E -DE 234 171A 55 163,-2.3 163,-2.1 -2,-0.3 2,-0.3 -0.976 6.3-174.4-156.7 143.4 7.6 10.0 4.1 72 72 A T E -DE 233 170A 0 98,-2.8 98,-2.8 -2,-0.3 2,-0.3 -0.997 2.8-170.6-143.8 144.0 7.5 6.2 4.1 73 73 A R E +DE 232 169A 70 159,-2.2 159,-3.2 -2,-0.3 2,-0.3 -0.979 11.4 160.5-135.7 147.8 9.8 3.6 2.6 74 74 A F E -DE 231 168A 4 94,-1.7 94,-3.1 -2,-0.3 2,-0.4 -0.989 28.5-133.6-162.5 158.9 9.5 -0.1 2.2 75 75 A S E +DE 230 167A 21 155,-1.4 154,-2.5 -2,-0.3 155,-0.9 -0.962 31.0 163.1-119.0 134.9 10.8 -3.1 0.3 76 76 A F E -DE 228 166A 0 90,-1.7 90,-3.2 -2,-0.4 2,-0.3 -0.910 21.5-151.8-142.9 168.6 8.6 -5.8 -1.2 77 77 A S E -D 227 0A 3 150,-2.1 150,-1.7 -2,-0.3 2,-0.4 -0.992 3.8-160.2-145.6 140.9 8.7 -8.6 -3.8 78 78 A I - 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