==== 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 1GZC . COMPND 2 MOLECULE: ERYTHRINA CRISTA-GALLI LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ERYTHRINA CRISTA-GALLI; . AUTHOR C.SVENSSON,U.KRENGEL . 239 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10661.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 61.9 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 . 97 40.6 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 . 17 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 6.3 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 3 2 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 0 100 0, 0.0 2,-0.7 0, 0.0 235,-0.0 0.000 360.0 360.0 360.0 135.0 66.8 8.4 54.3 2 2 A E E +A 237 0A 68 235,-2.7 235,-2.3 56,-0.1 2,-0.3 -0.883 360.0 179.6 -98.9 113.4 68.5 11.7 55.3 3 3 A T E -A 236 0A 81 -2,-0.7 2,-0.4 233,-0.2 233,-0.2 -0.814 20.6-171.6-118.8 155.7 66.4 14.5 53.9 4 4 A I E +A 235 0A 41 231,-1.9 231,-2.3 -2,-0.3 2,-0.3 -0.994 13.7 173.0-142.0 142.1 66.5 18.3 53.9 5 5 A S E +A 234 0A 76 -2,-0.4 2,-0.3 229,-0.2 229,-0.2 -0.985 7.3 166.8-154.8 140.9 63.8 20.6 52.6 6 6 A F E -A 233 0A 14 227,-2.3 227,-2.8 -2,-0.3 2,-0.3 -0.983 8.7-170.4-151.4 155.1 62.9 24.3 52.4 7 7 A S E -A 232 0A 91 -2,-0.3 2,-0.7 225,-0.3 225,-0.3 -0.884 6.4-171.4-153.4 117.4 60.5 26.5 50.6 8 8 A F E -A 231 0A 15 223,-3.0 223,-2.0 -2,-0.3 3,-0.1 -0.937 1.9-177.0-108.2 105.4 60.2 30.3 50.4 9 9 A S S S- 0 0 87 -2,-0.7 2,-0.3 1,-0.2 -1,-0.1 0.742 83.3 -9.1 -71.6 -23.8 57.0 31.3 48.7 10 10 A E S S- 0 0 128 -3,-0.1 2,-0.2 221,-0.1 -1,-0.2 -0.918 83.4-107.9-157.1 168.9 58.3 34.9 49.1 11 11 A F - 0 0 4 19,-2.5 -3,-0.0 -2,-0.3 21,-0.0 -0.695 25.1-161.2-104.0 160.4 61.3 36.3 51.0 12 12 A E > - 0 0 110 -2,-0.2 3,-2.0 17,-0.1 16,-0.1 -0.993 29.0-106.2-142.1 130.7 61.1 38.4 54.2 13 13 A P T 3 S+ 0 0 53 0, 0.0 14,-0.0 0, 0.0 12,-0.0 -0.328 108.0 25.9 -54.5 135.0 63.7 40.7 55.7 14 14 A G T 3 S+ 0 0 74 1,-0.3 4,-0.0 4,-0.1 0, 0.0 0.397 79.7 165.7 91.9 0.3 65.2 39.0 58.8 15 15 A N X - 0 0 29 -3,-2.0 3,-1.2 1,-0.1 -1,-0.3 -0.276 33.8-142.6 -57.2 128.6 64.5 35.4 57.7 16 16 A D T 3 S+ 0 0 151 1,-0.2 -1,-0.1 3,-0.0 -2,-0.0 0.675 91.7 59.5 -60.4 -24.2 66.6 32.9 59.9 17 17 A N T 3 S+ 0 0 57 36,-0.1 37,-2.2 37,-0.0 2,-0.4 0.342 90.7 74.5 -97.7 4.9 67.3 30.6 57.0 18 18 A L E < -H 53 0B 17 -3,-1.2 2,-0.4 35,-0.2 35,-0.2 -0.970 56.2-155.3-127.3 133.9 69.2 32.7 54.5 19 19 A T E -H 52 0B 54 33,-2.7 33,-1.9 -2,-0.4 2,-0.5 -0.870 17.4-152.1 -96.1 134.9 72.7 34.1 54.5 20 20 A L E -H 51 0B 79 -2,-0.4 2,-0.3 31,-0.2 31,-0.2 -0.939 15.1-173.9-114.0 130.2 73.1 37.3 52.4 21 21 A Q E > -H 50 0B 23 29,-3.0 29,-1.9 -2,-0.5 3,-1.8 -0.906 47.9 -18.7-125.2 150.3 76.5 38.0 50.7 22 22 A G E 3 S-H 49 0B 66 -2,-0.3 27,-0.3 1,-0.3 13,-0.1 -0.335 127.5 -12.7 61.3-130.1 77.9 41.0 48.8 23 23 A A T 3 S+ 0 0 33 25,-2.9 -1,-0.3 11,-0.2 26,-0.2 0.557 99.8 123.3 -81.2 -11.7 75.1 43.2 47.3 24 24 A A < + 0 0 11 -3,-1.8 2,-0.3 24,-0.2 10,-0.2 -0.197 31.2 162.1 -61.5 140.9 72.2 40.9 48.0 25 25 A L E -B 33 0A 80 8,-1.7 8,-2.8 10,-0.1 2,-0.5 -0.980 35.2-123.8-153.4 159.4 69.2 42.0 50.0 26 26 A I E -B 32 0A 21 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.933 27.8-140.7-106.0 129.1 65.6 41.2 50.7 27 27 A T > - 0 0 22 4,-2.7 3,-1.9 -2,-0.5 -16,-0.1 -0.481 22.5-116.5 -85.6 160.5 63.0 43.9 50.2 28 28 A Q T 3 S+ 0 0 172 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.832 117.0 63.1 -62.9 -27.6 60.0 44.6 52.4 29 29 A S T 3 S- 0 0 104 2,-0.1 -1,-0.3 1,-0.1 -17,-0.1 0.497 124.2-103.6 -75.3 -4.2 57.8 43.7 49.3 30 30 A G S < S+ 0 0 7 -3,-1.9 -19,-2.5 1,-0.3 2,-0.4 0.589 75.4 132.3 95.9 15.3 59.4 40.1 49.5 31 31 A V - 0 0 21 -21,-0.2 -4,-2.7 196,-0.0 2,-0.9 -0.803 51.2-140.2-104.6 134.2 61.9 40.1 46.7 32 32 A L E -BC 26 228A 0 196,-2.8 196,-2.6 -2,-0.4 2,-0.9 -0.828 18.5-161.7 -89.2 110.2 65.5 38.9 46.9 33 33 A Q E -BC 25 227A 38 -8,-2.8 -8,-1.7 -2,-0.9 194,-0.2 -0.830 6.2-172.2 -94.6 105.6 67.4 41.5 44.8 34 34 A L S S+ 0 0 1 192,-2.4 2,-0.3 -2,-0.9 180,-0.3 0.844 70.3 36.3 -67.0 -35.7 70.7 39.7 44.1 35 35 A T S S- 0 0 0 191,-0.3 191,-0.3 -3,-0.1 -10,-0.1 -0.900 103.8 -80.3-121.9 153.6 72.4 42.7 42.6 36 36 A K - 0 0 116 -2,-0.3 8,-2.8 7,-0.1 2,-0.6 -0.156 32.2-160.1 -59.2 132.8 72.0 46.4 43.5 37 37 A I B -N 43 0C 36 6,-0.2 -1,-0.1 -4,-0.1 5,-0.1 -0.971 24.5-132.0-110.6 118.0 69.0 48.4 42.4 38 38 A N > - 0 0 52 4,-3.2 3,-2.4 -2,-0.6 -1,-0.0 -0.049 27.7 -94.7 -65.3 170.6 69.8 52.2 42.6 39 39 A Q T 3 S+ 0 0 199 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.888 125.2 58.0 -52.4 -43.7 67.7 54.8 44.1 40 40 A N T 3 S- 0 0 118 1,-0.1 -1,-0.3 2,-0.1 -2,-0.1 0.402 121.7-106.6 -68.8 0.4 66.1 55.6 40.7 41 41 A G S < S+ 0 0 47 -3,-2.4 -2,-0.1 1,-0.3 -1,-0.1 0.468 81.9 128.2 86.5 1.5 65.0 52.0 40.4 42 42 A M - 0 0 59 1,-0.1 -4,-3.2 -5,-0.1 -1,-0.3 -0.674 65.7-106.2 -93.2 143.8 67.7 51.3 37.8 43 43 A P B -N 37 0C 2 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.461 32.9-130.4 -72.4 139.8 70.1 48.3 38.2 44 44 A A - 0 0 11 -8,-2.8 3,-0.3 -2,-0.2 180,-0.3 -0.662 13.8-132.1 -88.1 140.6 73.7 49.2 39.1 45 45 A W S S+ 0 0 91 -2,-0.3 173,-0.1 1,-0.2 178,-0.1 -0.259 86.0 39.9 -79.2 172.0 76.7 47.9 37.2 46 46 A D S S+ 0 0 88 171,-2.5 2,-0.4 176,-0.4 -1,-0.2 0.824 86.6 135.7 57.6 40.4 79.7 46.4 39.0 47 47 A S + 0 0 10 -3,-0.3 169,-3.0 170,-0.1 2,-0.3 -0.916 29.5 177.1-122.4 142.1 77.5 44.5 41.5 48 48 A T E + I 0 215B 36 -2,-0.4 -25,-2.9 167,-0.2 2,-0.3 -0.992 9.9 163.3-140.4 135.5 77.7 40.9 42.8 49 49 A G E -HI 22 214B 0 165,-2.2 165,-2.5 -2,-0.3 2,-0.3 -0.997 9.0-176.8-152.8 153.0 75.4 39.4 45.4 50 50 A R E -HI 21 213B 4 -29,-1.9 -29,-3.0 -2,-0.3 2,-0.4 -0.958 13.8-151.4-144.4 160.7 74.5 35.9 46.6 51 51 A T E -HI 20 212B 0 161,-2.6 161,-2.0 -2,-0.3 2,-0.4 -0.984 11.9-167.4-129.5 147.8 72.3 34.1 49.1 52 52 A L E -HI 19 211B 7 -33,-1.9 -33,-2.7 -2,-0.4 159,-0.2 -0.982 28.5-115.7-128.6 142.9 73.0 30.7 50.7 53 53 A Y E -H 18 0B 22 157,-2.4 157,-0.3 -2,-0.4 -35,-0.2 -0.569 32.6-125.3 -70.7 147.9 70.5 28.5 52.6 54 54 A T S S+ 0 0 46 -37,-2.2 -1,-0.1 -2,-0.2 -36,-0.1 0.668 86.9 65.6 -76.4 -14.6 71.8 28.4 56.2 55 55 A K S S- 0 0 111 -38,-0.3 155,-0.3 155,-0.1 -2,-0.1 -0.879 82.6-122.4-108.7 140.1 72.1 24.6 56.6 56 56 A P - 0 0 53 0, 0.0 2,-0.4 0, 0.0 153,-0.2 -0.384 23.3-129.6 -75.2 159.2 74.5 22.4 54.6 57 57 A V E -O 208 0D 1 151,-2.9 151,-2.1 -2,-0.1 2,-1.0 -0.906 9.4-131.6-115.7 131.8 73.1 19.5 52.5 58 58 A H E +O 207 0D 22 -2,-0.4 149,-0.2 149,-0.2 3,-0.1 -0.743 30.7 171.7 -87.8 106.9 74.4 15.9 52.6 59 59 A M + 0 0 0 147,-2.1 9,-2.9 -2,-1.0 2,-0.3 0.636 63.0 2.6 -90.2 -23.3 75.0 14.9 49.0 60 60 A W B S-P 67 0E 46 146,-1.4 2,-0.6 7,-0.2 -1,-0.3 -0.955 70.6-115.2-160.6 150.8 76.8 11.6 49.4 61 61 A D > - 0 0 37 5,-2.2 4,-2.1 -2,-0.3 5,-0.1 -0.798 13.4-156.5 -94.0 120.0 77.9 9.3 52.3 62 62 A S T 4 S+ 0 0 84 -2,-0.6 -1,-0.1 1,-0.2 144,-0.0 0.695 93.4 42.3 -67.8 -15.8 81.6 9.0 52.6 63 63 A T T 4 S+ 0 0 128 3,-0.0 -1,-0.2 1,-0.0 -2,-0.0 0.894 125.9 24.9 -96.8 -48.3 81.2 5.6 54.4 64 64 A T T 4 S- 0 0 91 2,-0.1 -2,-0.2 0, 0.0 -1,-0.0 0.640 93.1-127.2 -93.0 -17.0 78.4 3.8 52.5 65 65 A G < + 0 0 26 -4,-2.1 -3,-0.1 1,-0.2 136,-0.1 0.558 54.2 150.0 83.3 3.6 78.8 5.4 49.1 66 66 A T - 0 0 34 172,-0.1 -5,-2.2 -5,-0.1 2,-0.4 -0.338 32.2-150.2 -67.6 157.9 75.1 6.4 48.8 67 67 A V B -P 60 0E 31 -7,-0.2 -7,-0.2 169,-0.1 107,-0.1 -0.995 9.7-120.7-134.8 138.2 74.3 9.5 46.7 68 68 A A - 0 0 0 -9,-2.9 2,-0.3 -2,-0.4 169,-0.2 -0.404 11.2-150.5 -80.4 151.7 71.5 12.1 47.1 69 69 A S E -D 236 0A 33 167,-2.0 167,-2.3 104,-0.1 2,-0.3 -0.812 25.9-179.5-108.3 154.8 68.9 13.1 44.5 70 70 A F E -DE 235 172A 9 102,-2.0 102,-3.1 -2,-0.3 2,-0.3 -0.978 21.5-157.0-153.6 164.8 67.5 16.6 44.7 71 71 A E E -DE 234 171A 34 163,-2.4 163,-2.4 -2,-0.3 2,-0.4 -0.991 10.1-178.0-142.4 137.4 65.1 19.1 43.2 72 72 A T E -DE 233 170A 0 98,-2.7 98,-3.0 -2,-0.3 2,-0.3 -0.997 1.1-175.5-137.4 144.7 65.1 22.9 43.3 73 73 A R E +DE 232 169A 113 159,-2.0 159,-2.7 -2,-0.4 2,-0.3 -0.990 10.0 162.7-133.4 143.1 62.6 25.4 41.9 74 74 A F E -DE 231 168A 4 94,-1.6 94,-2.9 -2,-0.3 2,-0.4 -0.990 27.3-137.9-156.4 159.2 62.7 29.2 41.8 75 75 A S E +DE 230 167A 21 155,-1.5 154,-2.5 -2,-0.3 155,-0.9 -0.960 31.2 165.2-119.4 133.4 61.1 32.2 40.0 76 76 A F E -DE 228 166A 0 90,-2.1 90,-3.3 -2,-0.4 2,-0.4 -0.934 23.3-148.3-141.4 164.7 63.2 35.1 38.9 77 77 A S E -DE 227 165A 4 150,-2.6 150,-2.2 -2,-0.3 2,-0.5 -0.999 3.0-166.1-135.3 143.5 63.1 38.1 36.6 78 78 A I - 0 0 0 86,-0.6 85,-2.5 -2,-0.4 2,-0.5 -0.997 7.6-171.8-124.0 121.1 65.8 39.9 34.7 79 79 A E - 0 0 40 -2,-0.5 146,-2.2 83,-0.2 83,-0.1 -0.981 6.3-165.3-115.1 126.1 65.0 43.4 33.3 80 80 A Q + 0 0 42 -2,-0.5 144,-0.1 144,-0.2 82,-0.1 -0.837 16.2 169.8-112.1 91.8 67.6 44.9 30.9 81 81 A P + 0 0 50 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.614 43.7 88.1 -84.7 -8.4 66.7 48.6 30.7 82 82 A Y - 0 0 48 141,-0.4 141,-0.0 139,-0.2 139,-0.0 -0.699 59.8-152.8 -97.0 140.8 69.6 50.2 28.9 83 83 A T S S+ 0 0 144 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.813 76.0 59.9 -76.8 -29.4 69.7 50.5 25.2 84 84 A R S S+ 0 0 197 2,-0.1 -1,-0.3 -3,-0.1 2,-0.2 -0.984 84.9 27.2-154.2 152.6 73.5 50.5 25.4 85 85 A P S S- 0 0 38 0, 0.0 138,-0.2 0, 0.0 -3,-0.1 0.613 96.0 -87.1 -75.5-165.4 76.0 49.0 26.3 86 86 A L - 0 0 127 -2,-0.2 -2,-0.1 136,-0.1 -3,-0.1 -0.434 49.8-107.8 -68.9 146.4 75.2 45.3 26.1 87 87 A P - 0 0 29 0, 0.0 2,-0.3 0, 0.0 135,-0.1 -0.262 46.2-125.1 -71.3 161.2 73.6 43.9 29.4 88 88 A A - 0 0 2 43,-0.1 129,-0.6 133,-0.1 136,-0.2 -0.961 32.9 -20.9-169.7 161.0 75.5 41.6 31.8 89 89 A D E -J 216 0B 6 127,-0.4 41,-1.6 -2,-0.3 42,-0.8 -0.930 54.7-138.7-117.3 -25.3 76.2 39.3 33.4 90 90 A G E -JK 215 129B 0 125,-1.6 125,-2.3 39,-0.3 2,-0.3 -0.795 14.7 -94.6 137.7-178.1 73.6 36.8 34.7 91 91 A L E -JK 214 128B 2 37,-2.1 37,-3.0 -2,-0.2 2,-0.3 -0.920 31.3-169.5-138.1 166.9 72.4 34.7 37.7 92 92 A V E -JK 213 127B 1 121,-2.4 121,-2.4 -2,-0.3 2,-0.4 -0.998 24.1-133.7-161.1 146.1 73.0 31.2 38.7 93 93 A F E -JK 212 126B 2 33,-2.5 33,-2.6 -2,-0.3 2,-0.3 -0.894 39.7-179.3 -98.7 137.0 72.0 28.4 41.1 94 94 A F E -JK 211 125B 5 117,-2.6 117,-2.4 -2,-0.4 2,-0.4 -0.988 26.3-166.3-145.0 154.6 75.0 26.7 42.6 95 95 A M E +JK 210 124B 0 29,-2.6 29,-2.5 -2,-0.3 115,-0.2 -0.999 36.9 118.4-134.8 132.4 76.1 23.9 45.0 96 96 A G E -J 209 0B 3 113,-1.9 113,-2.3 -2,-0.4 27,-0.2 -0.927 57.8 -11.6-170.3-166.6 79.6 23.6 46.3 97 97 A P - 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