==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 22-APR-05 1ZGS . COMPND 2 MOLECULE: MANNOSE/GLUCOSE-SPECIFIC LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PARKIA PLATYCEPHALA; . AUTHOR F.GALLEGO DEL SOL,B.S.CAVADA,J.J.CALVETE . 884 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36271.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 624 70.6 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 . 443 50.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 14 1.6 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 . 100 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 0.7 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+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 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 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 . 5 10 6 8 7 11 6 3 3 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 8 10 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 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 3 A K 0 0 157 0, 0.0 295,-0.1 0, 0.0 293,-0.0 0.000 360.0 360.0 360.0 -55.8 42.5 -5.2 18.7 2 4 A G + 0 0 20 293,-0.3 2,-0.3 290,-0.1 292,-0.1 0.043 360.0 178.7 -29.6 136.2 40.7 -6.0 15.2 3 5 A M - 0 0 41 290,-0.2 2,-0.4 288,-0.1 142,-0.2 -0.958 27.4-114.1-147.1 157.2 42.3 -4.4 12.1 4 6 A I E -A 144 0A 0 140,-3.0 140,-2.9 -2,-0.3 2,-0.5 -0.824 22.8-138.3-100.9 138.2 41.6 -4.5 8.4 5 7 A S E -AB 143 268A 18 263,-2.8 263,-1.7 -2,-0.4 2,-0.4 -0.839 17.1-167.6 -92.6 127.6 44.0 -6.2 5.9 6 8 A V E -AB 142 267A 0 136,-3.1 136,-1.8 -2,-0.5 261,-0.2 -0.956 40.1 -51.5-116.3 137.1 44.7 -4.3 2.6 7 9 A G E - 0 0 10 259,-2.7 134,-0.2 -2,-0.4 2,-0.1 -0.635 24.3-142.9 86.0-149.7 46.4 -6.1 -0.3 8 10 A P E - 0 0 60 0, 0.0 2,-0.4 0, 0.0 133,-0.3 0.623 27.8-162.1 -84.3 174.0 48.9 -7.5 -0.6 9 11 A W E +A 140 0A 30 131,-2.9 131,-2.0 -2,-0.1 2,-0.3 -0.929 47.3 47.0-115.6 143.6 50.2 -6.5 -4.0 10 12 A G E S-A 139 0A 24 -2,-0.4 129,-0.3 129,-0.2 82,-0.2 -0.914 89.1 -24.3 128.2-154.2 52.8 -8.4 -5.9 11 13 A G - 0 0 8 127,-2.2 121,-0.1 80,-0.4 81,-0.1 -0.231 48.1-121.2 -96.5-177.7 53.4 -12.0 -6.9 12 14 A S S S+ 0 0 110 -2,-0.1 127,-0.1 80,-0.0 -1,-0.1 0.384 76.6 100.6-111.1 1.6 52.3 -15.2 -5.3 13 15 A G + 0 0 32 78,-0.4 126,-0.1 125,-0.1 125,-0.0 -0.062 59.1 43.9 -73.8-178.2 55.7 -16.8 -4.6 14 16 A G S S- 0 0 30 118,-0.1 2,-0.4 124,-0.1 120,-0.3 -0.135 93.0 -59.8 75.6-173.7 57.5 -16.8 -1.2 15 17 A N E -C 133 0A 47 118,-2.9 118,-2.0 1,-0.0 475,-0.1 -0.882 52.1-105.5-110.2 141.5 56.1 -17.5 2.2 16 18 A Y E +C 132 0A 70 -2,-0.4 475,-2.8 116,-0.2 2,-0.3 -0.331 45.0 169.0 -60.6 139.9 53.3 -15.6 4.0 17 19 A W E -C 131 0A 1 114,-2.3 114,-2.3 473,-0.2 2,-0.3 -0.977 12.3-172.3-145.7 157.7 54.4 -13.3 6.8 18 20 A S E -C 130 0A 38 473,-0.4 2,-0.4 -2,-0.3 112,-0.3 -0.990 9.1-160.6-147.2 151.9 52.8 -10.6 8.9 19 21 A F E -C 129 0A 30 110,-4.1 110,-2.4 -2,-0.3 2,-0.7 -0.959 2.7-171.2-134.2 121.1 53.9 -8.1 11.5 20 22 A K E -C 128 0A 107 -2,-0.4 108,-0.2 108,-0.2 2,-0.0 -0.920 25.8-134.1-111.1 106.1 51.5 -6.4 13.9 21 23 A A - 0 0 20 106,-1.6 4,-0.1 -2,-0.7 3,-0.1 -0.288 8.4-153.2 -64.9 138.4 53.2 -3.6 15.8 22 24 A N S S+ 0 0 112 2,-0.1 2,-0.3 1,-0.0 -1,-0.1 0.639 86.2 18.9 -83.9 -15.1 52.8 -3.3 19.5 23 25 A H S S- 0 0 87 104,-0.1 3,-0.1 24,-0.1 -1,-0.0 -0.917 113.7 -57.0-144.1 164.3 53.4 0.4 19.4 24 26 A A - 0 0 31 -2,-0.3 20,-2.5 19,-0.1 2,-0.5 -0.121 59.5-109.6 -43.4 139.3 53.3 3.0 16.5 25 27 A I E +E 43 0B 5 101,-0.5 52,-0.4 18,-0.2 18,-0.3 -0.660 44.6 167.5 -75.2 120.9 55.5 2.1 13.6 26 28 A T E + 0 0 27 16,-2.8 44,-3.0 -2,-0.5 2,-0.3 0.514 56.7 35.0-117.5 -12.1 58.4 4.6 13.6 27 29 A E E -EF 42 69B 13 15,-1.9 15,-2.2 42,-0.2 2,-0.4 -0.993 51.2-166.7-146.9 139.6 60.9 3.1 11.1 28 30 A I E -EF 41 68B 0 40,-2.6 40,-3.1 -2,-0.3 2,-0.5 -0.995 12.4-164.1-119.6 125.6 60.9 1.1 7.9 29 31 A V E +EF 40 67B 14 11,-2.6 11,-2.2 -2,-0.4 2,-0.3 -0.945 13.3 176.5-111.4 128.0 64.2 -0.5 6.8 30 32 A I E -EF 39 66B 0 36,-2.2 36,-2.7 -2,-0.5 2,-0.6 -0.951 26.3-144.6-131.1 147.6 64.5 -1.7 3.2 31 33 A H E +EF 38 65B 49 7,-1.8 6,-2.5 -2,-0.3 7,-1.0 -0.957 36.3 174.7-111.6 117.5 67.3 -3.2 1.1 32 34 A V E +EF 36 64B 10 32,-3.4 32,-2.4 -2,-0.6 4,-0.2 -0.946 30.0 135.7-135.5 144.3 66.9 -1.9 -2.4 33 35 A K S S- 0 0 112 2,-1.7 76,-0.1 -2,-0.4 3,-0.1 0.270 95.8 -23.8-140.1 -75.1 68.6 -1.9 -5.9 34 36 A D S S+ 0 0 84 1,-0.2 76,-1.8 75,-0.1 2,-0.2 0.639 138.1 15.2-113.1 -32.3 66.2 -2.5 -8.8 35 37 A N S S- 0 0 0 74,-0.2 -2,-1.7 -4,-0.0 2,-0.8 -0.690 99.5 -81.2-129.1 178.1 63.5 -4.3 -6.7 36 38 A I E -E 32 0B 0 57,-2.1 101,-2.5 101,-0.2 -4,-0.2 -0.804 38.9-176.6 -92.2 108.4 62.9 -4.6 -2.9 37 39 A K E - 0 0 1 -6,-2.5 17,-2.5 -2,-0.8 2,-0.3 0.872 64.3 -18.7 -70.0 -36.6 65.2 -7.3 -1.6 38 40 A S E -EG 31 53B 5 -7,-1.0 -7,-1.8 15,-0.3 2,-0.3 -0.991 54.1-153.7-167.6 161.3 63.9 -7.1 1.9 39 41 A I E +EG 30 52B 0 13,-2.3 13,-4.1 -2,-0.3 2,-0.3 -0.996 12.1 167.9-147.9 147.3 62.0 -5.2 4.6 40 42 A S E -E 29 0B 6 -11,-2.2 -11,-2.6 -2,-0.3 2,-0.3 -0.953 17.5-142.5-148.6 172.1 61.7 -4.8 8.3 41 43 A F E -E 28 0B 1 9,-0.4 8,-2.2 -2,-0.3 2,-0.3 -0.901 4.8-156.5-137.1 159.9 60.1 -2.4 10.8 42 44 A K E -EH 27 48B 55 -15,-2.2 -16,-2.8 -2,-0.3 -15,-1.9 -0.998 14.7-146.0-136.8 141.7 60.7 -0.7 14.2 43 45 A D E > -E 25 0B 2 4,-2.5 3,-2.5 -2,-0.3 -18,-0.2 -0.516 36.5 -88.2-103.7 174.2 58.1 0.7 16.6 44 46 A A T 3 S+ 0 0 49 -20,-2.5 -19,-0.1 1,-0.3 -1,-0.0 0.694 124.9 46.3 -53.3 -25.7 58.1 3.6 19.1 45 47 A S T 3 S- 0 0 68 -21,-0.2 -1,-0.3 2,-0.1 -21,-0.0 0.237 123.7 -95.5-105.5 18.7 59.6 1.6 21.9 46 48 A G S < S+ 0 0 20 -3,-2.5 2,-0.1 1,-0.3 -2,-0.1 0.424 73.6 145.5 89.2 -2.1 62.4 -0.0 19.9 47 49 A D - 0 0 25 411,-0.1 -4,-2.5 -5,-0.0 2,-0.3 -0.462 32.2-156.7 -68.8 141.5 60.7 -3.3 19.1 48 50 A I B -H 42 0B 13 411,-2.8 413,-0.4 -6,-0.2 -6,-0.2 -0.874 12.1-137.1-118.0 153.7 61.7 -4.7 15.7 49 51 A S - 0 0 3 -8,-2.2 -30,-0.1 -2,-0.3 413,-0.1 -0.533 42.6 -95.0 -84.8 166.0 60.0 -7.1 13.3 50 52 A G - 0 0 3 -2,-0.2 2,-0.5 411,-0.2 -9,-0.4 -0.273 48.1 -89.4 -65.9 177.4 62.2 -9.7 11.8 51 53 A T B -I 494 0C 26 443,-2.3 443,-2.2 445,-0.2 2,-0.6 -0.787 40.5-149.3 -83.1 124.4 63.7 -9.0 8.3 52 54 A F E -G 39 0B 6 -13,-4.1 -13,-2.3 -2,-0.5 2,-0.2 -0.886 61.7 -10.8-101.5 123.9 61.4 -10.2 5.5 53 55 A G E S+G 38 0B 4 -2,-0.6 -15,-0.3 -15,-0.2 83,-0.3 -0.555 73.2 119.1 90.5-157.9 63.1 -11.3 2.4 54 56 A G + 0 0 42 -17,-2.5 82,-0.2 81,-1.4 81,-0.2 0.844 36.2 131.9 67.5 36.4 66.8 -10.8 1.6 55 57 A K + 0 0 76 80,-1.0 80,-0.2 79,-0.5 81,-0.1 0.325 22.1 127.8-104.8 10.9 67.7 -14.5 1.4 56 58 A D - 0 0 18 79,-0.7 5,-0.1 5,-0.2 -19,-0.0 -0.529 50.0-153.4 -64.8 121.3 69.6 -14.3 -1.9 57 59 A P S S+ 0 0 101 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.831 70.6 99.0 -60.6 -32.4 73.0 -16.1 -1.1 58 60 A R > - 0 0 119 1,-0.2 3,-2.0 2,-0.1 4,-0.1 -0.418 67.9-151.7 -66.1 115.3 74.5 -14.0 -3.9 59 61 A E G > S+ 0 0 129 -2,-0.4 3,-1.0 1,-0.3 4,-0.3 0.709 94.6 65.1 -64.8 -23.7 76.3 -11.0 -2.3 60 62 A N G 3 S+ 0 0 108 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.379 100.9 57.1 -76.8 10.3 75.7 -8.8 -5.4 61 63 A E G < S+ 0 0 11 -3,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.360 72.5 96.5-120.9 -1.8 72.0 -9.2 -4.5 62 64 A K S < S- 0 0 151 -3,-1.0 -2,-0.1 -4,-0.1 -25,-0.1 0.854 75.9-153.2 -56.2 -39.8 72.0 -7.8 -0.8 63 65 A G - 0 0 5 -4,-0.3 2,-0.2 -32,-0.1 -30,-0.2 0.199 22.8 -63.5 79.6 157.5 70.9 -4.4 -2.1 64 66 A D E -F 32 0B 90 -32,-2.4 -32,-3.4 -33,-0.1 2,-0.4 -0.557 51.1-119.1 -80.2 142.2 71.5 -0.9 -0.6 65 67 A E E -F 31 0B 94 -34,-0.2 2,-0.4 -2,-0.2 -34,-0.2 -0.640 29.4-178.6 -84.5 130.0 70.0 -0.0 2.8 66 68 A K E -F 30 0B 98 -36,-2.7 -36,-2.2 -2,-0.4 2,-0.6 -0.991 12.2-154.3-126.2 135.3 67.5 2.8 3.2 67 69 A K E -F 29 0B 105 -2,-0.4 2,-0.6 -38,-0.2 -38,-0.2 -0.924 2.8-163.1-112.2 114.3 65.9 3.9 6.5 68 70 A I E -F 28 0B 4 -40,-3.1 -40,-2.6 -2,-0.6 2,-0.4 -0.894 12.4-159.1 -96.4 118.1 62.6 5.6 6.5 69 71 A K E -F 27 0B 101 -2,-0.6 2,-0.6 -42,-0.2 -42,-0.2 -0.855 7.4-150.1-100.2 134.7 61.9 7.4 9.8 70 72 A I - 0 0 7 -44,-3.0 2,-2.7 -2,-0.4 7,-0.1 -0.928 17.8-134.5-106.6 118.1 58.4 8.4 10.9 71 73 A H >> - 0 0 110 -2,-0.6 4,-1.6 2,-0.1 3,-0.7 -0.292 43.4-145.5 -76.1 60.2 58.5 11.5 13.0 72 74 A W T 34 + 0 0 121 -2,-2.7 4,-0.1 1,-0.3 -46,-0.0 -0.390 66.1 23.3 -63.1 141.6 56.2 10.1 15.7 73 75 A P T 34 S+ 0 0 101 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.996 131.2 38.3 -96.2 -5.5 54.1 11.2 17.5 74 76 A T T <4 S+ 0 0 100 -3,-0.7 2,-0.4 1,-0.1 -2,-0.2 0.770 121.5 47.7 -71.7 -26.6 53.3 14.3 15.2 75 77 A E S < S+ 0 0 3 -4,-1.6 2,-0.3 26,-0.1 -1,-0.1 -0.952 71.4 177.3-112.6 137.0 53.7 12.1 12.0 76 78 A Y - 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