==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 12-APR-10 3MIT . COMPND 2 MOLECULE: LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUSA ACUMINATA; . AUTHOR A.SHARMA,M.VIJAYAN . 276 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11970.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 217 78.6 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 . 161 58.3 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 . 33 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 1.8 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+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 . 0 2 2 0 2 7 1 4 0 2 0 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 4 2 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 4 A A 0 0 89 0, 0.0 2,-0.5 0, 0.0 136,-0.1 0.000 360.0 360.0 360.0 139.6 16.2 23.9 69.6 2 5 A I E +A 136 0A 11 134,-0.6 134,-2.5 254,-0.1 2,-0.5 -0.979 360.0 176.3-116.8 115.7 18.4 23.9 66.4 3 6 A K E -AB 135 255A 39 252,-2.0 252,-1.9 -2,-0.5 251,-1.3 -0.988 6.0-173.8-124.7 122.8 20.7 20.9 66.1 4 7 A V E -AB 134 253A 0 130,-2.6 130,-2.9 -2,-0.5 2,-0.2 -0.936 41.5 -23.5-117.6 145.9 22.9 20.3 63.1 5 8 A G E - 0 0 6 247,-2.7 249,-0.3 -2,-0.4 128,-0.2 -0.678 21.1-150.3 96.5-160.7 25.0 17.2 62.5 6 9 A A E - 0 0 38 126,-0.3 2,-0.5 -2,-0.2 127,-0.3 0.500 30.9-168.4 -84.9 154.7 26.3 15.0 63.8 7 10 A W E +A 132 0A 6 125,-2.8 125,-2.4 -3,-0.2 2,-0.3 -0.917 50.5 48.2-104.3 132.5 29.2 14.4 61.4 8 11 A G E S-A 131 0A 22 -2,-0.5 123,-0.3 123,-0.3 77,-0.2 -0.948 88.8 -39.0 139.0-158.0 31.2 11.2 61.9 9 12 A G - 0 0 6 121,-2.4 77,-0.1 75,-0.8 115,-0.1 -0.384 43.3-112.9-102.7-179.9 30.3 7.6 62.4 10 13 A N S S+ 0 0 155 -2,-0.1 121,-0.1 75,-0.0 75,-0.1 0.377 81.2 99.5 -95.3 0.5 27.8 5.5 64.3 11 14 A G + 0 0 30 73,-0.4 120,-0.1 119,-0.1 119,-0.1 0.045 60.4 40.7 -75.1-171.1 30.2 3.9 66.8 12 15 A G S S- 0 0 39 112,-0.1 2,-0.3 118,-0.1 114,-0.3 -0.138 95.9 -65.9 64.9-164.6 30.8 4.9 70.4 13 16 A S E -C 125 0A 82 112,-2.7 112,-2.6 1,-0.0 117,-0.1 -0.916 55.2 -93.2-123.0 153.0 28.0 6.0 72.7 14 17 A A E -C 124 0A 75 -2,-0.3 2,-0.3 110,-0.2 110,-0.3 -0.343 38.7-175.1 -69.8 136.7 25.7 9.1 72.5 15 18 A F E +C 123 0A 26 108,-2.9 108,-2.2 -2,-0.1 2,-0.2 -0.938 8.3 173.4-126.6 157.0 26.5 12.3 74.3 16 19 A D E +C 122 0A 83 -2,-0.3 106,-0.2 106,-0.3 -2,-0.0 -0.774 13.6 178.8-163.8 108.4 24.6 15.5 74.5 17 20 A M E - 0 0 24 104,-2.2 105,-0.1 -2,-0.2 -1,-0.1 0.637 39.9-140.7 -86.6 -13.6 25.5 18.5 76.7 18 21 A G E -C 121 0A 13 103,-0.8 103,-0.6 2,-0.0 -1,-0.2 -0.207 43.2 -39.1 75.8-178.3 22.5 20.6 75.5 19 22 A P E -C 120 0A 58 0, 0.0 2,-0.3 0, 0.0 101,-0.2 -0.530 59.5-147.7 -80.2 148.8 22.7 24.3 74.9 20 23 A A - 0 0 5 99,-3.0 23,-0.2 -2,-0.2 3,-0.2 -0.732 20.6-129.6-109.3 158.5 24.9 26.5 77.1 21 24 A Y S S- 0 0 177 21,-2.3 2,-0.3 1,-0.3 22,-0.2 0.910 96.9 -4.5 -65.2 -42.6 24.4 30.2 78.1 22 25 A R E -E 42 0B 111 20,-1.0 20,-2.2 97,-0.1 2,-0.6 -0.982 66.0-130.7-154.6 132.0 28.1 30.8 77.1 23 26 A I E -E 41 0B 12 -2,-0.3 18,-0.3 95,-0.2 3,-0.1 -0.812 23.8-179.0 -82.9 123.4 30.9 28.6 75.9 24 27 A I E - 0 0 38 16,-3.0 40,-2.5 -2,-0.6 2,-0.3 0.908 61.9 -12.9 -87.4 -52.3 34.0 29.4 78.0 25 28 A S E -EF 40 63B 10 15,-1.7 15,-2.4 38,-0.2 2,-0.4 -0.990 48.1-153.0-150.6 155.3 36.5 27.1 76.4 26 29 A V E -EF 39 62B 0 36,-2.4 36,-3.3 -2,-0.3 2,-0.5 -1.000 12.3-166.9-128.3 127.2 36.9 24.1 74.1 27 30 A K E -EF 38 61B 67 11,-2.9 11,-2.7 -2,-0.4 2,-0.6 -0.971 5.7-161.2-118.3 116.0 39.9 21.8 74.4 28 31 A I E -EF 37 60B 0 32,-2.7 32,-1.9 -2,-0.5 2,-0.6 -0.890 3.0-156.6-101.8 119.4 40.4 19.4 71.5 29 32 A F E +EF 36 59B 35 7,-2.6 6,-2.1 -2,-0.6 7,-1.6 -0.864 29.0 157.7 -93.8 122.3 42.6 16.4 72.3 30 33 A S E +EF 34 58B 7 28,-2.4 28,-3.2 -2,-0.6 4,-0.2 -0.983 24.3 149.4-145.6 154.4 44.2 15.0 69.1 31 34 A G S S- 0 0 28 2,-2.2 72,-0.5 -2,-0.3 71,-0.1 -0.137 92.5 -17.0-135.6-110.5 47.0 12.9 67.6 32 35 A D S S+ 0 0 89 70,-0.2 71,-0.8 71,-0.1 72,-0.6 0.796 142.0 14.4 -62.2 -31.9 46.4 10.9 64.4 33 36 A V S S- 0 0 3 69,-0.2 -2,-2.2 70,-0.2 2,-0.8 -0.763 98.8 -81.2-138.3 170.6 42.7 11.4 65.1 34 37 A V E +E 30 0B 0 52,-2.8 95,-3.0 -2,-0.2 -4,-0.2 -0.793 45.5 177.1 -83.9 112.1 40.4 13.5 67.2 35 38 A D E - 0 0 14 -6,-2.1 19,-2.6 -2,-0.8 2,-0.3 0.870 53.1 -30.3 -81.3 -40.7 40.4 11.7 70.6 36 39 A A E -EG 29 53B 0 -7,-1.6 -7,-2.6 17,-0.3 2,-0.3 -0.977 45.3-131.0-171.7 167.2 38.2 13.9 72.7 37 40 A V E -EG 28 52B 1 15,-2.5 15,-3.0 -2,-0.3 2,-0.5 -0.996 7.6-157.1-140.4 133.9 36.9 17.3 73.5 38 41 A D E -EG 27 51B 29 -11,-2.7 -11,-2.9 -2,-0.3 2,-0.5 -0.961 14.9-168.6-102.8 128.5 36.6 19.2 76.9 39 42 A V E -EG 26 50B 0 11,-2.7 11,-2.6 -2,-0.5 2,-0.4 -0.982 5.1-168.1-120.8 123.8 33.9 21.9 76.9 40 43 A T E +EG 25 49B 27 -15,-2.4 -16,-3.0 -2,-0.5 -15,-1.7 -0.926 25.1 150.7-109.0 133.9 33.7 24.4 79.7 41 44 A F E -EG 23 48B 4 7,-2.8 7,-3.3 -2,-0.4 2,-0.3 -0.982 42.1-110.4-159.6 157.6 30.5 26.5 79.8 42 45 A T E +EG 22 47B 19 -20,-2.2 -21,-2.3 -2,-0.3 -20,-1.0 -0.740 28.9 178.4-100.5 155.5 28.0 28.4 81.9 43 46 A Y E > - G 0 46B 99 3,-2.4 3,-1.8 -2,-0.3 -23,-0.1 -0.816 66.4 -27.3-164.7 101.7 24.5 27.2 82.5 44 47 A Y T 3 S- 0 0 200 1,-0.3 3,-0.1 -2,-0.3 -24,-0.0 0.805 129.5 -40.4 53.9 37.8 21.8 28.9 84.7 45 48 A G T 3 S+ 0 0 85 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.294 120.4 107.3 98.8 -6.4 24.4 30.6 87.0 46 49 A K E < -G 43 0B 118 -3,-1.8 -3,-2.4 2,-0.0 2,-0.5 -0.778 62.0-139.1-108.2 146.7 26.7 27.5 87.1 47 50 A T E -G 42 0B 94 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.921 30.5-180.0-103.6 128.9 30.0 26.7 85.5 48 51 A E E -G 41 0B 45 -7,-3.3 -7,-2.8 -2,-0.5 2,-0.4 -0.946 19.7-158.1-132.4 146.1 30.3 23.2 84.1 49 52 A T E -G 40 0B 81 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.998 12.0-173.3-124.3 131.5 32.9 21.1 82.3 50 53 A R E -G 39 0B 98 -11,-2.6 -11,-2.7 -2,-0.4 2,-0.5 -0.956 10.5-151.5-119.9 144.1 32.1 18.1 80.1 51 54 A H E -G 38 0B 87 -2,-0.4 2,-0.4 -13,-0.2 -13,-0.2 -0.966 11.7-173.1-113.8 132.1 34.4 15.6 78.5 52 55 A F E +G 37 0B 18 -15,-3.0 -15,-2.5 -2,-0.5 2,-0.2 -0.969 52.0 6.9-123.9 137.1 33.5 13.7 75.3 53 56 A G E S-G 36 0B 21 -2,-0.4 -17,-0.3 -17,-0.2 75,-0.2 -0.570 95.7 -37.1 92.9-158.9 35.6 10.9 73.7 54 57 A G - 0 0 11 -19,-2.6 73,-0.1 73,-0.5 74,-0.1 -0.049 48.9-104.3 -98.5-164.9 38.7 9.2 75.1 55 58 A S S S+ 0 0 121 72,-0.1 -19,-0.1 -19,-0.1 73,-0.1 0.487 83.1 92.9-104.3 -6.4 41.8 10.0 77.1 56 59 A G + 0 0 29 71,-0.4 -21,-0.1 -21,-0.1 -20,-0.1 -0.058 55.7 54.3 -79.3-178.6 44.4 10.0 74.4 57 60 A G S S- 0 0 39 -22,-0.1 -26,-0.2 -28,-0.1 -28,-0.1 0.011 82.0 -72.2 86.4 170.6 45.9 12.8 72.2 58 61 A T E -F 30 0B 89 -28,-3.2 -28,-2.4 -30,-0.0 2,-0.2 -0.901 51.0-116.8-104.2 131.6 47.5 16.2 72.8 59 62 A P E -F 29 0B 67 0, 0.0 2,-0.4 0, 0.0 -30,-0.3 -0.464 25.3-173.7 -72.5 137.3 45.2 19.1 74.0 60 63 A H E -F 28 0B 64 -32,-1.9 -32,-2.7 -2,-0.2 2,-0.3 -0.952 18.4-150.8-129.4 112.4 44.6 22.2 71.9 61 64 A E E -F 27 0B 104 -2,-0.4 2,-0.6 -34,-0.2 -34,-0.2 -0.646 16.4-166.8 -96.2 136.8 42.7 24.9 73.8 62 65 A I E -F 26 0B 0 -36,-3.3 -36,-2.4 -2,-0.3 2,-0.6 -0.972 12.2-170.8-113.8 108.7 40.3 27.5 72.5 63 66 A V E -F 25 0B 81 -2,-0.6 2,-0.5 -38,-0.2 -38,-0.2 -0.923 13.3-145.7-102.5 122.0 39.6 30.1 75.2 64 67 A L - 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