==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 17-MAY-02 1GZ9 . COMPND 2 MOLECULE: ERYTHRINA CRISTA-GALLI LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ERYTHRINA CRISTA-GALLI; . AUTHOR C.SVENSSON,S.TENEBERG,C.L.NILSSON,A.KJELLBERG,F.P.SCHWARZ, . 239 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10471.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 149 62.3 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 . 98 41.0 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 . 2 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 . 18 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 2.5 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+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 . 2 3 0 1 2 2 2 3 1 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 1 1 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 0 101 0, 0.0 2,-0.7 0, 0.0 238,-0.0 0.000 360.0 360.0 360.0 124.4 65.1 8.2 54.2 2 2 A E E +A 237 0A 69 235,-2.6 235,-2.6 56,-0.1 2,-0.3 -0.821 360.0 177.1 -94.2 116.3 66.9 11.4 55.1 3 3 A T E -A 236 0A 79 -2,-0.7 2,-0.3 233,-0.2 233,-0.2 -0.777 22.4-176.2-121.8 161.9 65.0 14.4 53.8 4 4 A I E +A 235 0A 35 231,-1.7 231,-2.7 -2,-0.3 2,-0.3 -0.959 14.1 165.7-152.8 133.2 65.0 18.2 53.8 5 5 A S E +A 234 0A 72 -2,-0.3 2,-0.3 229,-0.2 229,-0.2 -0.985 6.2 169.3-148.9 157.1 62.5 20.5 52.3 6 6 A F E -A 233 0A 18 227,-2.2 227,-2.7 -2,-0.3 2,-0.3 -0.966 10.1-163.9-161.3 157.2 61.6 24.2 52.5 7 7 A S E -A 232 0A 86 -2,-0.3 2,-0.6 225,-0.3 225,-0.3 -0.940 7.7-166.6-153.8 125.6 59.4 26.6 50.6 8 8 A F E -A 231 0A 13 223,-3.0 223,-2.0 -2,-0.3 3,-0.1 -0.953 2.2-175.5-114.1 107.0 59.2 30.3 50.4 9 9 A S S S- 0 0 107 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.750 84.9 -14.5 -66.5 -30.0 55.9 31.4 48.8 10 10 A E S S- 0 0 71 -3,-0.1 2,-0.3 221,-0.1 -1,-0.2 -0.907 85.0-101.0-159.5 171.5 57.4 34.9 49.1 11 11 A F - 0 0 3 19,-2.2 -3,-0.0 -2,-0.3 16,-0.0 -0.745 26.4-158.1-104.9 157.4 60.3 36.2 51.1 12 12 A E > - 0 0 131 -2,-0.3 3,-2.0 18,-0.1 16,-0.1 -0.995 26.1-110.8-136.7 130.2 60.2 38.1 54.4 13 13 A P T 3 S+ 0 0 46 0, 0.0 14,-0.0 0, 0.0 12,-0.0 -0.317 106.4 24.8 -56.0 135.3 62.8 40.5 55.8 14 14 A G T 3 S+ 0 0 75 1,-0.3 2,-0.1 4,-0.1 0, 0.0 0.458 81.5 164.5 91.6 -0.6 64.3 38.8 58.9 15 15 A N X - 0 0 46 -3,-2.0 3,-1.2 1,-0.1 -1,-0.3 -0.324 35.5-141.7 -58.8 127.6 63.6 35.3 57.8 16 16 A D T 3 S+ 0 0 150 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.0 0.646 91.5 61.6 -58.3 -26.0 65.6 32.7 59.9 17 17 A N T 3 S+ 0 0 56 36,-0.1 37,-2.3 37,-0.1 2,-0.4 0.408 89.4 73.7 -93.2 2.9 66.2 30.4 57.0 18 18 A L E < -H 53 0B 17 -3,-1.2 2,-0.4 35,-0.2 35,-0.2 -0.957 55.6-155.8-127.5 135.4 68.2 32.5 54.6 19 19 A T E -H 52 0B 54 33,-2.8 33,-2.0 -2,-0.4 2,-0.4 -0.870 18.6-153.4 -98.0 136.1 71.8 33.8 54.5 20 20 A L E -H 51 0B 78 -2,-0.4 2,-0.3 31,-0.2 31,-0.2 -0.946 14.2-175.0-115.4 133.6 72.2 36.9 52.4 21 21 A Q E > -H 50 0B 23 29,-2.9 29,-2.0 -2,-0.4 3,-1.8 -0.940 47.6 -16.2-129.3 150.1 75.6 37.7 50.8 22 22 A G E 3 S-H 49 0B 66 -2,-0.3 27,-0.3 1,-0.3 13,-0.1 -0.376 127.2 -13.9 64.0-133.2 77.0 40.6 48.8 23 23 A A T 3 S+ 0 0 31 25,-2.8 -1,-0.3 11,-0.2 26,-0.2 0.543 99.5 125.5 -81.3 -7.3 74.3 42.9 47.4 24 24 A A < + 0 0 10 -3,-1.8 2,-0.3 24,-0.2 10,-0.2 -0.199 30.2 161.2 -62.4 141.5 71.3 40.6 48.0 25 25 A L E -B 33 0A 78 8,-1.7 8,-2.9 10,-0.1 2,-0.5 -0.989 35.3-125.2-156.2 158.0 68.4 41.8 50.0 26 26 A I E -B 32 0A 22 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.919 27.2-140.6-107.4 129.0 64.7 41.1 50.8 27 27 A T > - 0 0 21 4,-2.8 3,-2.1 -2,-0.5 -16,-0.1 -0.457 23.2-116.5 -85.3 159.6 62.1 43.8 50.2 28 28 A Q T 3 S+ 0 0 174 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.780 118.1 64.7 -64.1 -23.1 59.2 44.5 52.5 29 29 A S T 3 S- 0 0 101 2,-0.1 -1,-0.3 -17,-0.0 -18,-0.1 0.478 124.0-106.2 -76.5 -4.2 57.1 43.6 49.4 30 30 A G S < S+ 0 0 7 -3,-2.1 -19,-2.2 1,-0.3 2,-0.4 0.673 74.0 134.0 91.2 19.1 58.5 40.1 49.7 31 31 A V - 0 0 19 -21,-0.2 -4,-2.8 2,-0.0 2,-0.8 -0.836 50.7-139.9-105.7 139.2 61.0 40.1 46.8 32 32 A L E -BC 26 228A 0 196,-2.9 196,-2.9 -2,-0.4 2,-0.9 -0.855 17.2-162.9 -95.1 109.7 64.6 38.8 46.9 33 33 A Q E -BC 25 227A 38 -8,-2.9 -8,-1.7 -2,-0.8 194,-0.2 -0.832 5.2-171.7 -94.0 104.5 66.6 41.3 44.9 34 34 A L S S+ 0 0 1 192,-2.5 2,-0.3 -2,-0.9 180,-0.3 0.877 71.9 36.8 -65.2 -36.4 69.9 39.4 44.2 35 35 A T S S- 0 0 0 191,-0.3 191,-0.3 -3,-0.1 -10,-0.1 -0.886 103.5 -80.9-122.3 151.8 71.5 42.5 42.7 36 36 A K - 0 0 111 -2,-0.3 8,-2.6 7,-0.1 2,-0.6 -0.130 32.5-161.5 -54.4 131.3 71.3 46.1 43.6 37 37 A I B -N 43 0C 37 6,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.979 23.5-134.1-112.8 117.2 68.3 48.1 42.5 38 38 A N - 0 0 38 4,-3.4 3,-0.3 -2,-0.6 6,-0.0 -0.009 28.9 -90.4 -65.2 174.0 69.1 51.9 42.7 39 39 A Q S S+ 0 0 206 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.914 125.1 53.3 -51.9 -53.0 66.9 54.5 44.1 40 40 A N S S- 0 0 127 1,-0.1 -1,-0.2 2,-0.1 -3,-0.0 0.864 123.5-101.6 -53.4 -38.7 65.2 55.4 40.8 41 41 A G S S+ 0 0 40 1,-0.4 -2,-0.1 -3,-0.3 -1,-0.1 0.406 82.7 129.0 122.9 12.6 64.3 51.7 40.4 42 42 A M - 0 0 58 1,-0.0 -4,-3.4 182,-0.0 -1,-0.4 -0.738 63.7-107.8 -98.7 143.0 67.1 51.0 37.9 43 43 A P B -N 37 0C 0 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.494 31.6-130.9 -74.4 136.9 69.5 48.1 38.3 44 44 A A - 0 0 11 -8,-2.6 3,-0.3 -2,-0.2 180,-0.3 -0.644 15.1-129.7 -86.6 141.9 73.0 49.0 39.3 45 45 A W S S+ 0 0 75 -2,-0.3 173,-0.1 1,-0.2 178,-0.1 -0.281 87.2 40.6 -78.5 171.5 76.1 47.6 37.4 46 46 A D S S+ 0 0 86 171,-2.3 2,-0.4 176,-0.3 -1,-0.2 0.834 85.2 136.4 56.1 43.0 79.0 46.0 39.2 47 47 A S + 0 0 9 -3,-0.3 169,-2.7 170,-0.1 2,-0.4 -0.935 29.0 177.8-121.8 140.0 76.7 44.2 41.7 48 48 A T E + I 0 215B 34 -2,-0.4 -25,-2.8 167,-0.2 2,-0.3 -0.993 10.5 163.7-138.2 131.5 76.9 40.6 42.9 49 49 A G E -HI 22 214B 0 165,-2.2 165,-2.6 -2,-0.4 2,-0.3 -0.998 9.6-177.0-150.7 151.3 74.6 39.0 45.5 50 50 A R E -HI 21 213B 3 -29,-2.0 -29,-2.9 -2,-0.3 2,-0.4 -0.949 12.8-154.2-142.1 159.7 73.6 35.5 46.8 51 51 A T E -HI 20 212B 0 161,-2.8 161,-2.1 -2,-0.3 2,-0.4 -0.989 12.7-168.0-132.4 145.6 71.3 33.8 49.2 52 52 A L E -HI 19 211B 6 -33,-2.0 -33,-2.8 -2,-0.4 159,-0.2 -0.986 29.2-113.4-129.3 146.3 71.9 30.4 50.8 53 53 A Y E -H 18 0B 22 157,-2.6 157,-0.3 -2,-0.4 -35,-0.2 -0.553 31.7-128.1 -71.7 144.0 69.5 28.2 52.7 54 54 A T S S+ 0 0 45 -37,-2.3 -1,-0.1 -2,-0.2 -36,-0.1 0.742 86.7 67.0 -70.5 -21.0 70.8 28.1 56.2 55 55 A K S S- 0 0 114 -38,-0.3 155,-0.3 155,-0.1 -2,-0.1 -0.827 82.9-124.3-102.8 139.4 70.9 24.3 56.6 56 56 A P - 0 0 54 0, 0.0 2,-0.4 0, 0.0 153,-0.2 -0.362 23.5-129.8 -74.5 159.4 73.2 22.0 54.6 57 57 A V E -O 208 0D 1 151,-3.0 151,-2.1 -2,-0.1 2,-0.9 -0.922 10.1-129.6-115.0 135.2 71.7 19.2 52.5 58 58 A H E +O 207 0D 25 -2,-0.4 149,-0.2 149,-0.2 3,-0.1 -0.741 32.0 172.3 -87.7 108.1 72.9 15.6 52.6 59 59 A M + 0 0 0 147,-2.2 9,-3.2 -2,-0.9 2,-0.3 0.714 63.6 2.4 -89.6 -25.8 73.5 14.7 48.9 60 60 A W B S-P 67 0E 46 146,-1.2 2,-0.7 7,-0.3 -1,-0.3 -0.949 70.1-118.3-159.8 144.8 75.2 11.3 49.3 61 61 A D > - 0 0 39 5,-2.1 4,-2.7 -2,-0.3 5,-0.2 -0.761 13.9-155.8 -90.2 112.4 76.1 9.0 52.2 62 62 A S T 4 S+ 0 0 82 -2,-0.7 -1,-0.1 1,-0.2 144,-0.0 0.367 92.3 45.4 -68.3 8.1 79.8 8.4 52.4 63 63 A T T 4 S+ 0 0 124 3,-0.1 -1,-0.2 0, 0.0 -2,-0.0 0.736 125.1 22.9-114.4 -51.2 79.2 5.1 54.2 64 64 A T T 4 S- 0 0 89 2,-0.1 -2,-0.2 0, 0.0 175,-0.0 0.712 94.9-128.6 -91.3 -21.6 76.5 3.4 52.3 65 65 A G < + 0 0 26 -4,-2.7 -3,-0.1 1,-0.3 136,-0.1 0.585 52.9 151.3 85.2 9.2 76.9 5.1 49.0 66 66 A T - 0 0 37 -5,-0.2 -5,-2.1 172,-0.1 2,-0.4 -0.401 32.9-145.8 -71.5 153.2 73.3 6.1 48.6 67 67 A V B -P 60 0E 26 -7,-0.2 -7,-0.3 -2,-0.1 107,-0.2 -0.979 8.7-123.4-128.8 137.0 72.6 9.3 46.6 68 68 A A - 0 0 0 -9,-3.2 2,-0.3 -2,-0.4 169,-0.2 -0.387 12.1-151.4 -75.4 149.6 70.0 11.9 47.0 69 69 A S E -D 236 0A 34 167,-1.9 167,-2.3 104,-0.1 2,-0.3 -0.850 24.2-177.7-110.1 152.4 67.4 13.0 44.4 70 70 A F E -DE 235 172A 9 102,-1.9 102,-2.5 -2,-0.3 2,-0.3 -0.950 21.3-157.1-148.8 169.5 66.1 16.6 44.7 71 71 A E E -DE 234 171A 55 163,-2.1 163,-2.3 -2,-0.3 2,-0.3 -0.984 11.7-179.0-145.3 140.6 63.7 19.1 43.2 72 72 A T E -DE 233 170A 0 98,-2.5 98,-2.7 -2,-0.3 2,-0.3 -0.996 1.8-174.6-143.8 144.1 63.8 22.8 43.3 73 73 A R E +DE 232 169A 113 159,-2.1 159,-2.7 -2,-0.3 2,-0.3 -0.995 8.9 163.9-137.3 142.2 61.5 25.5 41.9 74 74 A F E -DE 231 168A 3 94,-1.5 94,-2.7 -2,-0.3 2,-0.4 -0.987 26.8-139.2-154.4 157.7 61.7 29.3 41.8 75 75 A S E +DE 230 167A 20 155,-1.6 154,-2.4 -2,-0.3 155,-0.9 -0.971 31.6 165.1-118.9 135.3 60.1 32.2 40.0 76 76 A F E -DE 228 166A 0 90,-2.0 90,-3.2 -2,-0.4 2,-0.4 -0.932 22.9-147.7-142.2 165.9 62.3 35.1 38.9 77 77 A S E -DE 227 165A 3 150,-2.6 150,-2.2 -2,-0.3 2,-0.5 -1.000 3.5-165.1-139.7 144.2 62.3 38.1 36.7 78 78 A I - 0 0 0 86,-0.6 85,-2.6 -2,-0.4 2,-0.5 -0.995 7.1-172.1-126.5 121.5 65.0 39.8 34.7 79 79 A E - 0 0 89 -2,-0.5 146,-2.0 83,-0.2 83,-0.1 -0.980 7.5-165.9-116.0 127.8 64.4 43.3 33.3 80 80 A Q + 0 0 42 -2,-0.5 144,-0.1 144,-0.2 82,-0.1 -0.868 16.8 167.9-113.7 93.4 66.9 44.8 31.0 81 81 A P + 0 0 46 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.577 44.2 88.4 -87.9 -9.2 66.0 48.5 30.8 82 82 A Y - 0 0 49 141,-0.5 141,-0.0 139,-0.2 139,-0.0 -0.692 58.6-154.8 -93.2 143.6 69.0 50.0 29.1 83 83 A T S S+ 0 0 149 1,-0.3 -1,-0.1 -2,-0.3 -3,-0.0 0.828 75.1 64.1 -80.0 -30.7 69.3 50.3 25.3 84 84 A R S S+ 0 0 218 2,-0.1 -1,-0.3 -3,-0.1 2,-0.2 -0.981 86.3 24.4-148.2 147.5 73.1 50.4 25.6 85 85 A P S S- 0 0 38 0, 0.0 138,-0.2 0, 0.0 -3,-0.1 0.621 96.2 -85.4 -81.1-161.8 75.4 48.8 26.5 86 86 A L - 0 0 122 -2,-0.2 -2,-0.1 136,-0.1 -3,-0.1 -0.407 51.3-109.5 -64.7 142.4 74.5 45.0 26.3 87 87 A P - 0 0 30 0, 0.0 2,-0.3 0, 0.0 135,-0.1 -0.291 46.8-127.1 -70.9 157.8 72.8 43.7 29.5 88 88 A A - 0 0 2 43,-0.1 129,-0.7 129,-0.1 136,-0.2 -0.953 33.5 -18.6-164.7 160.7 74.7 41.4 31.9 89 89 A D E -J 216 0B 7 127,-0.4 41,-1.7 -2,-0.3 42,-0.8 -0.921 54.0-141.2-119.0 -25.5 75.3 39.0 33.6 90 90 A G E -JK 215 129B 0 125,-1.6 125,-2.1 39,-0.2 2,-0.3 -0.817 15.8 -93.1 134.1-177.0 72.6 36.6 34.8 91 91 A L E -JK 214 128B 2 37,-2.0 37,-2.8 -2,-0.3 2,-0.3 -0.942 30.1-167.6-138.4 167.0 71.5 34.5 37.8 92 92 A V E -JK 213 127B 1 121,-2.4 121,-2.1 -2,-0.3 2,-0.5 -0.996 23.4-134.0-158.1 147.5 72.0 30.9 38.8 93 93 A F E -JK 212 126B 4 33,-2.5 33,-2.6 -2,-0.3 2,-0.4 -0.916 40.2-175.7 -99.6 133.9 70.9 28.2 41.2 94 94 A F E -JK 211 125B 4 117,-2.7 117,-2.3 -2,-0.5 2,-0.4 -0.972 26.9-165.7-140.0 156.1 73.9 26.4 42.7 95 95 A M E +JK 210 124B 1 29,-2.8 29,-2.5 -2,-0.4 115,-0.2 -0.999 37.0 122.3-134.6 126.9 74.9 23.6 45.0 96 96 A G E -J 209 0B 2 113,-1.9 113,-2.2 -2,-0.4 27,-0.2 -0.896 56.6 -20.1-163.8-167.2 78.4 23.3 46.4 97 97 A P - 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