==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 13-JAN-07 2E7T . COMPND 2 MOLECULE: BASIC AGGLUTININ; . SOURCE 2 ORGANISM_SCIENTIFIC: PSOPHOCARPUS TETRAGONOLOBUS; . AUTHOR K.A.KULKARNI,S.KATIYAR,A.SUROLIA,M.VIJAYAN,K.SUGUNA . 947 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37218.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 607 64.1 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 . 386 40.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 91 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 6.9 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 . 4 16 0 5 8 11 8 8 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 . 8 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 K 0 0 105 0, 0.0 234,-2.9 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 104.2 93.5 -4.6 20.1 2 2 A T E -A 234 0A 100 232,-0.2 2,-0.4 234,-0.1 232,-0.2 -0.959 360.0-177.1-120.2 130.9 97.0 -5.2 21.3 3 3 A I E +A 233 0A 54 230,-1.8 230,-2.5 -2,-0.5 2,-0.3 -0.941 12.7 159.9-123.2 145.4 99.8 -6.8 19.3 4 4 A S E -A 232 0A 78 -2,-0.4 2,-0.3 228,-0.2 228,-0.2 -0.977 15.4-177.9-165.1 151.4 103.3 -7.5 20.5 5 5 A F E -A 231 0A 21 226,-2.0 226,-2.4 -2,-0.3 2,-0.4 -0.985 9.4-155.4-148.6 156.6 106.4 -9.6 20.0 6 6 A N E -A 230 0A 98 -2,-0.3 2,-0.4 224,-0.2 224,-0.2 -0.999 6.5-173.8-140.1 139.2 109.8 -10.0 21.7 7 7 A F E +A 229 0A 15 222,-1.3 222,-2.4 -2,-0.4 3,-0.1 -0.940 7.7 175.9-133.3 107.7 113.2 -11.2 20.4 8 8 A N S S- 0 0 105 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.720 82.5 -12.0 -80.5 -23.4 116.0 -11.6 23.0 9 9 A Q S S- 0 0 94 220,-0.1 2,-0.4 219,-0.0 -1,-0.2 -0.866 81.1-105.6-160.4 174.9 118.2 -13.0 20.3 10 10 A F - 0 0 2 19,-1.8 2,-0.4 -2,-0.3 -3,-0.0 -0.931 22.1-151.3-119.7 142.1 117.6 -14.1 16.7 11 11 A H > - 0 0 107 -2,-0.4 3,-1.4 17,-0.1 16,-0.1 -0.897 30.2-103.3-112.4 140.9 117.5 -17.7 15.3 12 12 A Q T 3 S+ 0 0 115 -2,-0.4 3,-0.1 1,-0.3 14,-0.0 -0.354 111.4 20.3 -58.1 134.3 118.4 -18.8 11.8 13 13 A N T 3 S- 0 0 157 1,-0.2 2,-0.3 12,-0.0 -1,-0.3 0.786 82.3-179.0 74.4 28.1 115.1 -19.4 10.0 14 14 A E X - 0 0 44 -3,-1.4 3,-1.1 1,-0.2 -1,-0.2 -0.454 18.5-151.6 -58.6 119.7 113.1 -17.4 12.4 15 15 A E T 3 S+ 0 0 165 -2,-0.3 -1,-0.2 1,-0.2 -3,-0.0 0.595 88.0 61.3 -76.3 -8.3 109.6 -17.8 11.0 16 16 A Q T 3 S+ 0 0 42 36,-0.1 36,-3.9 35,-0.1 2,-0.3 0.475 95.4 74.1 -94.7 -1.4 108.3 -14.4 12.3 17 17 A L E < -H 51 0B 17 -3,-1.1 2,-0.6 34,-0.3 34,-0.2 -0.838 64.3-152.4-112.8 150.1 110.9 -12.4 10.3 18 18 A K E -H 50 0B 105 32,-2.7 32,-2.4 -2,-0.3 2,-0.3 -0.954 18.8-160.1-120.7 104.6 110.9 -11.7 6.6 19 19 A L E -H 49 0B 61 -2,-0.6 2,-0.3 30,-0.2 30,-0.2 -0.713 8.0-168.1 -89.1 137.9 114.5 -11.2 5.5 20 20 A Q E > -H 48 0B 14 28,-2.4 3,-1.7 -2,-0.3 28,-1.7 -0.957 46.8 -25.0-129.8 148.3 115.3 -9.3 2.2 21 21 A R E 3 S-H 47 0B 140 -2,-0.3 26,-0.2 1,-0.3 13,-0.0 -0.276 127.4 -6.4 56.0-133.3 118.4 -8.8 0.1 22 22 A D T 3 S+ 0 0 29 24,-2.6 -1,-0.3 11,-0.0 25,-0.2 0.500 98.6 122.3 -70.5 -7.2 121.6 -9.2 2.0 23 23 A A < + 0 0 4 -3,-1.7 2,-0.3 23,-0.2 10,-0.2 -0.342 34.3 159.6 -63.6 134.2 120.0 -9.4 5.4 24 24 A R E -B 32 0A 125 8,-2.2 8,-2.8 10,-0.1 2,-0.6 -0.994 40.1-118.3-153.7 155.3 120.9 -12.6 7.3 25 25 A I E -B 31 0A 15 -2,-0.3 6,-0.2 6,-0.2 4,-0.0 -0.859 32.9-136.3 -99.1 121.0 121.0 -14.1 10.9 26 26 A S > - 0 0 18 4,-2.7 3,-1.2 -2,-0.6 -14,-0.2 -0.128 23.3-107.4 -70.5 169.5 124.5 -15.1 12.1 27 27 A S T 3 S+ 0 0 115 1,-0.3 -15,-0.1 2,-0.1 -1,-0.1 0.827 118.1 56.8 -68.6 -31.7 125.2 -18.3 14.0 28 28 A N T 3 S- 0 0 131 2,-0.1 -1,-0.3 -17,-0.1 -2,-0.1 0.140 124.7 -98.3 -89.5 25.0 125.7 -16.4 17.3 29 29 A S S < S+ 0 0 15 -3,-1.2 -19,-1.8 1,-0.2 2,-0.4 0.653 76.9 131.6 76.3 19.4 122.2 -14.9 17.0 30 30 A V - 0 0 21 -21,-0.1 -4,-2.7 2,-0.0 2,-0.8 -0.842 54.9-127.9-106.9 144.0 122.7 -11.4 15.6 31 31 A L E -BC 25 226A 0 195,-2.4 195,-2.5 -2,-0.4 2,-0.9 -0.788 22.7-162.5 -87.6 108.2 120.7 -10.0 12.8 32 32 A E E -BC 24 225A 41 -8,-2.8 -8,-2.2 -2,-0.8 193,-0.2 -0.818 8.6-174.4 -96.6 104.3 123.2 -8.6 10.3 33 33 A L S S+ 0 0 0 191,-2.1 2,-0.3 -2,-0.9 -1,-0.2 0.905 70.1 40.1 -63.8 -44.4 121.3 -6.2 8.0 34 34 A T S S- 0 0 0 190,-0.3 190,-0.3 -11,-0.1 -10,-0.1 -0.803 101.0 -80.6-112.7 155.0 124.3 -5.7 5.7 35 35 A K + 0 0 86 -2,-0.3 7,-1.8 188,-0.1 2,-0.4 -0.117 40.0 177.7 -53.1 133.2 126.9 -8.1 4.3 36 36 A V E -N 41 0C 30 5,-0.2 2,-0.5 -4,-0.1 3,-0.3 -0.946 7.5-167.8-139.6 113.6 129.9 -9.1 6.4 37 37 A V E > S-N 40 0C 68 3,-2.7 3,-1.4 -2,-0.4 -2,-0.0 -0.917 73.0 -15.9-109.5 122.8 132.5 -11.6 5.0 38 38 A N T 3 S- 0 0 166 -2,-0.5 -1,-0.2 1,-0.3 0, 0.0 0.928 130.7 -50.5 54.0 48.1 135.1 -13.2 7.3 39 39 A G T 3 S+ 0 0 52 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.0 0.605 118.8 111.7 68.3 11.8 134.4 -10.5 9.9 40 40 A V E < -N 37 0C 65 -3,-1.4 -3,-2.7 182,-0.0 -1,-0.2 -0.968 64.7-131.4-123.4 123.7 134.8 -7.7 7.4 41 41 A P E -N 36 0C 5 0, 0.0 -5,-0.2 0, 0.0 2,-0.2 -0.454 25.2-147.2 -70.9 141.9 131.9 -5.5 6.3 42 42 A T - 0 0 42 -7,-1.8 180,-0.3 -2,-0.1 3,-0.3 -0.686 7.1-121.3-109.9 161.1 131.6 -5.0 2.5 43 43 A W S S+ 0 0 50 -2,-0.2 169,-0.2 1,-0.2 3,-0.1 -0.296 89.1 46.6 -88.6 177.9 130.4 -2.1 0.3 44 44 A N S S+ 0 0 95 167,-3.3 2,-0.4 176,-0.3 -1,-0.2 0.839 84.9 139.3 58.3 34.2 127.5 -2.2 -2.1 45 45 A S + 0 0 0 -3,-0.3 165,-2.7 166,-0.2 2,-0.3 -0.901 25.7 169.6-116.7 145.5 125.3 -4.0 0.5 46 46 A T E + I 0 209B 9 -2,-0.4 -24,-2.6 163,-0.2 2,-0.3 -0.987 6.5 163.5-150.2 135.8 121.6 -3.5 1.3 47 47 A G E -HI 21 208B 0 161,-1.8 161,-2.1 -2,-0.3 2,-0.3 -0.995 13.4-165.3-156.7 150.3 119.3 -5.6 3.5 48 48 A R E -HI 20 207B 0 -28,-1.7 -28,-2.4 -2,-0.3 2,-0.3 -0.893 5.5-161.2-133.3 161.8 116.0 -5.4 5.3 49 49 A A E -HI 19 206B 0 157,-2.3 157,-2.2 -2,-0.3 2,-0.3 -0.942 14.4-176.6-146.7 118.6 114.2 -7.3 8.0 50 50 A L E -HI 18 205B 5 -32,-2.4 -32,-2.7 -2,-0.3 2,-0.3 -0.875 35.5-105.6-118.3 152.0 110.4 -7.1 8.5 51 51 A Y E -H 17 0B 16 153,-2.4 -34,-0.3 -2,-0.3 153,-0.2 -0.611 36.5-128.4 -71.5 131.6 108.1 -8.6 11.0 52 52 A A S S+ 0 0 46 -36,-3.9 -1,-0.1 -2,-0.3 -35,-0.1 0.812 86.7 60.9 -52.9 -39.6 106.3 -11.4 9.1 53 53 A K S S- 0 0 109 -37,-0.3 151,-0.3 1,-0.0 2,-0.1 -0.713 86.1-117.4 -97.5 145.0 102.7 -10.3 10.0 54 54 A P - 0 0 73 0, 0.0 2,-0.4 0, 0.0 149,-0.2 -0.447 25.3-145.7 -75.2 149.8 101.1 -6.9 9.2 55 55 A V E -O 202 0D 2 147,-2.8 147,-2.8 -2,-0.1 2,-0.7 -0.914 11.2-126.9-117.7 146.4 100.1 -4.6 12.1 56 56 A Q E +O 201 0D 86 -2,-0.4 145,-0.3 145,-0.2 144,-0.1 -0.823 25.6 175.7 -94.5 115.3 97.1 -2.3 12.1 57 57 A V + 0 0 2 143,-2.0 9,-3.8 -2,-0.7 2,-0.3 0.693 68.2 9.4 -90.8 -20.3 98.1 1.3 13.0 58 58 A W B -P 65 0E 10 142,-1.2 2,-0.5 7,-0.3 -1,-0.2 -0.995 62.1-134.2-156.8 156.6 94.6 2.8 12.5 59 59 A D > - 0 0 34 5,-2.5 4,-2.5 -2,-0.3 5,-0.3 -0.954 3.7-159.7-116.4 120.4 91.0 1.9 11.9 60 60 A S T 4 S+ 0 0 13 -2,-0.5 -1,-0.1 1,-0.2 5,-0.0 0.707 91.4 58.3 -70.6 -18.8 89.0 3.7 9.2 61 61 A T T 4 S+ 0 0 86 784,-0.1 785,-0.3 1,-0.1 -1,-0.2 0.951 121.6 22.2 -75.1 -49.5 85.7 2.7 10.8 62 62 A T T 4 S- 0 0 78 2,-0.1 -2,-0.2 783,-0.1 -1,-0.1 0.677 97.5-131.4 -89.5 -22.1 86.3 4.2 14.3 63 63 A G < + 0 0 19 -4,-2.5 -3,-0.2 1,-0.3 2,-0.1 0.408 57.4 146.2 83.8 -3.0 88.9 6.7 13.0 64 64 A N - 0 0 62 -5,-0.3 -5,-2.5 -6,-0.1 2,-0.3 -0.347 37.0-150.8 -71.6 146.5 91.2 5.7 15.9 65 65 A V B -P 58 0E 26 -7,-0.2 -7,-0.3 -3,-0.1 103,-0.1 -0.879 18.9-115.7-116.4 149.0 95.0 5.6 15.6 66 66 A A - 0 0 1 -9,-3.8 2,-0.4 -2,-0.3 169,-0.2 -0.406 13.3-144.7 -84.6 158.8 97.3 3.2 17.5 67 67 A S E +D 234 0A 38 167,-1.8 167,-2.8 100,-0.1 2,-0.3 -0.886 27.9 178.2-114.5 146.7 99.9 4.0 20.1 68 68 A F E -DE 233 166A 13 98,-1.7 98,-3.0 -2,-0.4 2,-0.3 -0.978 22.7-160.7-151.0 165.3 103.0 1.9 20.1 69 69 A E E +DE 232 165A 62 163,-2.7 163,-1.6 -2,-0.3 2,-0.4 -0.984 11.7 179.5-147.4 132.7 106.4 1.4 21.7 70 70 A T E -DE 231 164A 1 94,-2.5 94,-2.8 -2,-0.3 2,-0.4 -1.000 5.2-169.6-140.2 141.3 109.4 -0.5 20.4 71 71 A R E +DE 230 163A 75 159,-2.2 159,-3.0 -2,-0.4 2,-0.3 -0.985 14.7 159.2-130.8 139.5 112.8 -1.1 21.9 72 72 A F E -DE 229 162A 5 90,-1.6 90,-2.6 -2,-0.4 2,-0.4 -0.981 29.0-134.8-155.6 161.8 115.9 -2.6 20.3 73 73 A S E +DE 228 161A 19 155,-1.6 154,-2.7 -2,-0.3 155,-1.0 -0.972 25.9 175.4-121.6 137.7 119.6 -2.8 20.5 74 74 A F E -DE 226 160A 1 86,-1.7 86,-2.2 -2,-0.4 2,-0.3 -0.879 16.7-151.9-136.4 168.1 122.0 -2.4 17.7 75 75 A S E -D 225 0A 16 150,-2.2 150,-2.4 -2,-0.3 2,-0.5 -0.985 3.8-168.3-145.2 131.6 125.7 -2.2 17.1 76 76 A I - 0 0 1 82,-0.5 81,-2.7 79,-0.4 2,-0.5 -0.976 7.0-167.9-121.5 114.8 127.6 -0.4 14.3 77 77 A R - 0 0 90 -2,-0.5 146,-2.0 79,-0.2 79,-0.1 -0.909 3.9-165.6-106.5 127.5 131.3 -1.2 13.9 78 78 A Q + 0 0 39 -2,-0.5 144,-0.1 144,-0.2 78,-0.1 -0.786 15.1 168.5-114.2 88.0 133.3 1.1 11.7 79 79 A P + 0 0 54 0, 0.0 -1,-0.1 0, 0.0 143,-0.1 0.730 68.4 56.4 -70.2 -26.0 136.6 -0.7 10.9 80 80 A F + 0 0 65 141,-0.4 141,-0.3 139,-0.2 4,-0.2 -0.825 58.6 176.6-114.5 96.7 137.8 1.7 8.2 81 81 A P + 0 0 84 0, 0.0 -1,-0.2 0, 0.0 138,-0.0 0.911 50.3 95.0 -62.7 -45.4 137.9 5.3 9.4 82 82 A R S S+ 0 0 182 1,-0.2 2,-0.1 2,-0.1 0, 0.0 -0.814 93.0 1.2-100.9 138.2 139.3 6.8 6.1 83 83 A P S S- 0 0 38 0, 0.0 -1,-0.2 0, 0.0 137,-0.1 -0.930 120.5 -58.3 -82.7 -33.0 137.7 8.0 3.9 84 84 A H - 0 0 66 -4,-0.2 -2,-0.1 -2,-0.1 42,-0.1 -0.768 37.7-121.0-178.6 129.8 134.2 7.7 5.4 85 85 A P - 0 0 19 0, 0.0 2,-0.3 0, 0.0 135,-0.2 -0.346 42.4-119.1 -71.9 155.3 131.8 5.0 6.7 86 86 A A - 0 0 1 133,-0.1 125,-0.8 40,-0.1 136,-0.2 -0.970 39.6 -30.4-159.7 152.1 128.3 4.6 5.1 87 87 A D E -J 210 0B 6 123,-0.4 38,-2.7 -2,-0.3 39,-1.1 -0.894 54.2-136.0-120.7 -30.0 125.5 4.6 5.2 88 88 A G E -JK 209 124B 0 121,-1.3 121,-1.7 36,-0.2 2,-0.3 -0.829 18.2 -94.9 140.5-178.2 123.4 3.8 8.3 89 89 A L E -JK 208 123B 0 34,-1.5 34,-2.4 -2,-0.3 2,-0.3 -0.919 27.6-164.6-134.6 160.3 120.4 1.9 9.5 90 90 A V E -JK 207 122B 0 117,-2.7 117,-1.7 -2,-0.3 2,-0.5 -0.962 20.8-137.0-143.8 160.5 116.8 2.7 10.1 91 91 A F E +JK 206 121B 4 30,-1.9 30,-2.6 -2,-0.3 2,-0.3 -0.967 41.8 178.7-111.5 130.6 113.6 1.5 11.8 92 92 A F E -JK 205 120B 0 113,-2.6 113,-1.8 -2,-0.5 2,-0.4 -0.931 32.1-149.9-140.3 165.8 110.7 2.0 9.4 93 93 A I E +JK 204 119B 4 26,-2.2 26,-2.0 -2,-0.3 111,-0.2 -0.999 33.5 153.2-130.8 128.5 107.0 1.5 8.9 94 94 A A E -J 203 0B 0 109,-1.9 109,-3.1 -2,-0.4 24,-0.2 -0.933 49.4 -71.4-150.7 169.9 105.6 1.1 5.4 95 95 A P - 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