==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 24-AUG-00 1FNY . COMPND 2 MOLECULE: BARK AGGLUTININ I,POLYPEPTIDE A; . SOURCE 2 ORGANISM_SCIENTIFIC: ROBINIA PSEUDOACACIA; . AUTHOR A.RABIJNS,C.VERBOVEN,P.ROUGE,A.BARRE,E.J.VAN DAMME, . 234 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10134.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 67.5 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 . 99 42.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 24 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 1 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 . 1 4 0 1 2 2 3 1 2 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 . 1 0 0 0 0 0 2 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 T 0 0 78 0, 0.0 2,-0.3 0, 0.0 234,-0.1 0.000 360.0 360.0 360.0 151.6 50.0 -8.8 59.9 2 2 A G E -A 233 0A 36 231,-1.7 231,-3.1 55,-0.1 2,-0.3 -0.908 360.0-112.5 148.7-175.2 53.8 -8.3 60.3 3 3 A S E -A 232 0A 93 -2,-0.3 2,-0.3 229,-0.2 229,-0.2 -0.965 12.5-168.1-151.6 166.7 57.1 -7.7 58.6 4 4 A L E +A 231 0A 37 227,-1.4 227,-2.8 -2,-0.3 2,-0.3 -0.958 12.1 165.0-157.8 138.5 60.5 -9.2 57.8 5 5 A S E +A 230 0A 74 -2,-0.3 2,-0.3 225,-0.3 225,-0.2 -0.982 3.0 161.3-153.7 154.6 63.8 -7.8 56.5 6 6 A F E -A 229 0A 24 223,-2.2 223,-2.4 -2,-0.3 2,-0.3 -0.974 19.3-150.2-165.2 167.7 67.3 -8.9 56.2 7 7 A S E -A 228 0A 84 -2,-0.3 221,-0.2 221,-0.2 3,-0.1 -0.960 6.7-175.8-152.8 130.9 70.6 -8.2 54.4 8 8 A F E -A 227 0A 37 219,-2.3 219,-2.3 -2,-0.3 3,-0.1 -0.959 8.2-170.0-129.6 108.7 73.5 -10.5 53.4 9 9 A P S S- 0 0 109 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.779 84.5 -11.6 -66.1 -27.7 76.5 -8.7 51.8 10 10 A K S S- 0 0 126 217,-0.1 2,-0.5 -3,-0.1 21,-0.2 -0.909 87.0 -92.0-158.9 173.0 77.7 -12.2 51.0 11 11 A F - 0 0 1 19,-2.6 -3,-0.0 -2,-0.3 215,-0.0 -0.873 23.7-146.3-108.5 124.8 76.7 -15.7 52.0 12 12 A A > - 0 0 49 -2,-0.5 3,-0.6 18,-0.1 2,-0.1 -0.700 26.3-128.5 -83.1 129.2 78.2 -17.6 54.9 13 13 A P T 3 S+ 0 0 39 0, 0.0 14,-0.1 0, 0.0 -1,-0.0 -0.388 83.0 23.2 -77.3 156.7 78.3 -21.4 54.2 14 14 A N T 3 S+ 0 0 155 1,-0.2 -2,-0.0 12,-0.1 0, 0.0 0.810 89.2 125.4 61.0 32.5 76.9 -24.1 56.5 15 15 A Q X - 0 0 109 -3,-0.6 2,-1.1 3,-0.0 3,-1.0 -0.991 62.5-132.6-125.8 126.0 74.5 -21.7 58.2 16 16 A P T 3 S+ 0 0 109 0, 0.0 -2,-0.0 0, 0.0 3,-0.0 0.045 82.3 98.4 -64.2 25.6 70.7 -22.5 58.4 17 17 A Y T 3 S+ 0 0 36 -2,-1.1 36,-2.5 35,-0.1 2,-0.4 0.591 85.2 53.9 -88.1 -9.0 69.4 -19.1 57.3 18 18 A L E < S-H 52 0B 16 -3,-1.0 2,-0.7 34,-0.2 34,-0.2 -0.935 73.5-145.3-122.9 146.0 69.0 -20.6 53.8 19 19 A I E -H 51 0B 53 32,-2.8 32,-2.4 -2,-0.4 2,-0.4 -0.956 23.9-153.7-109.1 109.0 67.2 -23.8 52.7 20 20 A N E -H 50 0B 75 -2,-0.7 2,-0.3 30,-0.2 30,-0.2 -0.727 14.5-176.0 -87.7 132.8 69.3 -25.2 49.9 21 21 A Q E > -H 49 0B 16 28,-3.1 28,-2.4 -2,-0.4 3,-1.5 -0.938 49.1 -11.7-128.4 150.9 67.5 -27.4 47.3 22 22 A G E 3 S-H 48 0B 56 -2,-0.3 26,-0.3 1,-0.2 13,-0.1 -0.377 127.0 -18.7 64.9-137.7 68.8 -29.4 44.4 23 23 A D T 3 S+ 0 0 56 24,-3.4 25,-0.2 11,-0.2 -1,-0.2 0.487 98.6 129.8 -83.2 -3.9 72.4 -28.7 43.4 24 24 A A < + 0 0 11 -3,-1.5 2,-0.3 23,-0.2 10,-0.2 -0.170 27.0 159.3 -56.2 140.9 72.6 -25.4 45.2 25 25 A L E -B 33 0A 67 8,-1.9 8,-2.4 10,-0.1 2,-0.5 -0.972 38.7-119.3-155.7 163.4 75.5 -24.7 47.6 26 26 A V E -B 32 0A 24 -2,-0.3 6,-0.2 6,-0.2 -12,-0.1 -0.958 32.2-134.8-112.3 124.6 77.4 -21.9 49.2 27 27 A T > - 0 0 27 4,-2.7 3,-1.7 -2,-0.5 -16,-0.0 -0.214 24.5-108.8 -72.5 165.4 81.1 -21.7 48.3 28 28 A S T 3 S+ 0 0 117 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.757 121.1 59.8 -65.7 -21.5 83.9 -21.1 50.8 29 29 A T T 3 S- 0 0 91 2,-0.1 -1,-0.3 -17,-0.1 -18,-0.1 0.424 124.0-102.7 -85.7 -1.1 84.1 -17.6 49.3 30 30 A G S < S+ 0 0 1 -3,-1.7 -19,-2.6 1,-0.3 2,-0.4 0.682 73.6 139.8 89.8 19.3 80.5 -16.7 50.1 31 31 A V - 0 0 28 -21,-0.2 -4,-2.7 2,-0.0 2,-1.1 -0.804 52.6-132.7 -99.6 135.8 78.9 -17.2 46.7 32 32 A L E -BC 26 224A 0 192,-2.9 192,-2.6 -2,-0.4 2,-1.1 -0.755 24.0-164.6 -87.2 99.7 75.5 -18.9 46.4 33 33 A Q E -BC 25 223A 32 -8,-2.4 -8,-1.9 -2,-1.1 190,-0.2 -0.749 10.6-180.0 -89.1 97.8 76.2 -21.3 43.5 34 34 A L + 0 0 0 188,-2.0 2,-0.3 -2,-1.1 -1,-0.2 0.921 64.5 38.0 -66.5 -45.3 72.8 -22.4 42.3 35 35 A T S S- 0 0 0 187,-0.4 187,-0.3 11,-0.1 -10,-0.1 -0.801 96.6 -86.2-113.2 154.4 73.9 -24.8 39.6 36 36 A N - 0 0 56 -2,-0.3 7,-2.5 6,-0.1 2,-0.4 -0.161 36.6-171.9 -58.0 139.4 76.8 -27.2 39.4 37 37 A V E -O 42 0C 37 5,-0.3 2,-0.6 -4,-0.1 3,-0.1 -0.997 6.3-162.5-135.0 125.8 80.2 -26.2 38.2 38 38 A V E > S-O 41 0C 94 3,-3.3 3,-1.7 -2,-0.4 -2,-0.0 -0.932 78.0 -23.8-115.2 109.1 83.0 -28.6 37.6 39 39 A N T 3 S- 0 0 165 -2,-0.6 -1,-0.2 1,-0.3 0, 0.0 0.882 128.8 -48.5 59.4 40.5 86.5 -27.1 37.5 40 40 A G T 3 S+ 0 0 62 1,-0.2 -1,-0.3 -3,-0.1 181,-0.1 0.137 119.0 111.3 88.6 -20.5 85.0 -23.7 36.6 41 41 A V E < -O 38 0C 75 -3,-1.7 -3,-3.3 38,-0.1 -1,-0.2 -0.777 69.7-125.4 -93.6 121.1 82.8 -25.2 33.8 42 42 A P E -O 37 0C 6 0, 0.0 -5,-0.3 0, 0.0 2,-0.2 -0.355 26.1-130.0 -64.0 139.4 79.1 -25.2 34.5 43 43 A S - 0 0 33 -7,-2.5 3,-0.4 177,-0.1 177,-0.3 -0.553 17.0-116.8 -90.0 154.6 77.4 -28.6 34.1 44 44 A S S S+ 0 0 32 1,-0.2 170,-0.2 -2,-0.2 169,-0.1 -0.392 90.8 29.0 -85.8 167.3 74.3 -29.4 32.1 45 45 A K S S+ 0 0 116 168,-3.2 2,-0.3 1,-0.2 -1,-0.2 0.829 86.5 148.9 52.9 36.9 71.0 -30.6 33.4 46 46 A S - 0 0 2 -3,-0.4 166,-1.8 167,-0.3 2,-0.3 -0.753 24.5-179.2-102.4 150.2 71.6 -28.8 36.8 47 47 A L E + I 0 211B 13 -2,-0.3 -24,-3.4 164,-0.2 2,-0.3 -0.957 6.7 165.2-149.4 125.5 68.9 -27.4 39.0 48 48 A G E -HI 22 210B 0 162,-2.3 162,-2.0 -2,-0.3 2,-0.3 -0.997 7.8-177.5-143.6 146.4 69.4 -25.6 42.3 49 49 A R E -HI 21 209B 1 -28,-2.4 -28,-3.1 -2,-0.3 2,-0.4 -0.964 8.2-162.1-140.8 156.5 67.2 -23.4 44.5 50 50 A A E -HI 20 208B 0 158,-2.5 158,-2.3 -2,-0.3 2,-0.3 -0.976 8.4-172.0-143.1 126.0 67.7 -21.5 47.8 51 51 A L E -HI 19 207B 2 -32,-2.4 -32,-2.8 -2,-0.4 156,-0.2 -0.870 33.7-106.0-117.1 150.5 64.9 -20.2 50.1 52 52 A Y E -H 18 0B 43 154,-2.3 154,-0.3 -2,-0.3 -34,-0.2 -0.507 37.7-118.3 -68.9 146.9 65.2 -18.0 53.1 53 53 A A S S+ 0 0 31 -36,-2.5 -1,-0.1 -2,-0.1 -35,-0.1 0.853 95.7 53.1 -57.5 -36.0 64.7 -20.2 56.1 54 54 A A S S- 0 0 40 -37,-0.3 152,-0.3 152,-0.0 -2,-0.1 -0.786 76.2-139.5-106.6 145.6 61.6 -18.3 57.2 55 55 A P - 0 0 37 0, 0.0 2,-0.3 0, 0.0 150,-0.2 -0.371 17.7-143.2 -87.2 174.0 58.4 -17.6 55.2 56 56 A F E -J 204 0B 5 148,-2.1 148,-2.3 -2,-0.1 2,-0.7 -0.947 21.0-105.9-136.1 157.8 56.7 -14.2 55.4 57 57 A Q E -J 203 0B 20 -2,-0.3 146,-0.3 146,-0.2 145,-0.1 -0.780 30.8-179.3 -88.6 116.5 53.0 -13.3 55.3 58 58 A I + 0 0 0 144,-2.4 9,-3.0 -2,-0.7 2,-0.3 0.649 69.6 3.0 -89.8 -17.8 52.2 -11.8 52.0 59 59 A W B -P 66 0D 45 143,-1.2 2,-0.5 7,-0.3 -1,-0.2 -0.978 66.0-131.1-161.7 159.0 48.5 -11.2 52.8 60 60 A D > - 0 0 18 5,-2.3 4,-2.2 -2,-0.3 5,-0.1 -0.971 1.0-159.3-122.7 125.4 46.0 -11.6 55.6 61 61 A S T 4 S+ 0 0 71 -2,-0.5 -1,-0.1 2,-0.2 0, 0.0 0.725 92.9 53.7 -72.0 -23.7 42.6 -13.3 55.4 62 62 A T T 4 S+ 0 0 127 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.939 124.8 21.5 -77.1 -48.3 41.3 -11.6 58.5 63 63 A T T 4 S- 0 0 56 2,-0.1 -2,-0.2 171,-0.1 -1,-0.1 0.718 94.8-134.9 -90.8 -24.6 42.0 -8.0 57.5 64 64 A G < + 0 0 21 -4,-2.2 -3,-0.1 1,-0.3 133,-0.1 0.455 54.3 146.6 82.7 0.4 42.2 -8.6 53.8 65 65 A N - 0 0 53 169,-0.2 -5,-2.3 -5,-0.1 2,-0.4 -0.300 38.7-143.6 -71.3 155.7 45.4 -6.5 53.7 66 66 A V B -P 59 0D 29 -7,-0.2 -7,-0.3 -3,-0.1 104,-0.1 -0.948 15.0-121.8-122.5 140.8 48.2 -7.2 51.2 67 67 A A - 0 0 0 -9,-3.0 2,-0.4 -2,-0.4 166,-0.2 -0.431 13.2-148.1 -81.4 153.4 51.9 -6.8 51.9 68 68 A S E +D 232 0A 46 164,-2.2 164,-2.3 -2,-0.1 2,-0.3 -0.894 26.7 171.8-114.1 147.4 54.3 -4.6 50.0 69 69 A F E -DE 231 168A 7 99,-1.4 99,-2.7 -2,-0.4 2,-0.3 -0.976 22.1-159.6-153.2 166.2 57.9 -5.8 49.6 70 70 A V E -DE 230 167A 45 160,-2.4 160,-2.4 -2,-0.3 2,-0.3 -0.973 9.4-177.9-144.4 152.1 61.2 -5.1 48.0 71 71 A T E -DE 229 166A 1 95,-2.2 95,-2.8 -2,-0.3 2,-0.3 -0.983 2.8-171.2-151.7 146.4 64.3 -7.3 47.4 72 72 A S E +DE 228 165A 40 156,-2.1 156,-2.7 -2,-0.3 2,-0.3 -0.988 11.7 160.6-139.8 147.4 67.6 -6.7 45.8 73 73 A F E -DE 227 164A 4 91,-1.8 91,-3.5 -2,-0.3 2,-0.4 -0.977 28.5-132.3-158.8 163.1 70.4 -9.0 44.9 74 74 A T E +DE 226 163A 22 152,-1.1 151,-2.8 -2,-0.3 152,-1.0 -0.939 30.3 170.9-120.5 146.2 73.5 -9.2 42.7 75 75 A F E -DE 224 162A 1 87,-2.2 87,-2.9 -2,-0.4 2,-0.4 -0.981 22.0-146.3-152.5 162.6 74.3 -12.1 40.5 76 76 A I E -D 223 0A 36 147,-2.5 147,-2.3 -2,-0.3 2,-0.5 -0.995 3.6-168.1-134.2 138.8 76.6 -13.3 37.8 77 77 A I - 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