==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LECTIN 03-NOV-95 1AFA . COMPND 2 MOLECULE: MANNOSE-BINDING PROTEIN-A; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR A.R.KOLATKAR,W.I.WEIS . 462 3 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22190.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 292 63.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 83 18.0 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 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.3 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 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 RESIDUES PER ALPHA HELIX . 6 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 . 3 5 3 4 0 1 2 0 0 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 . 0 0 0 0 0 0 0 3 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 73 1 A > 0 0 94 0, 0.0 4,-2.8 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -62.6 -12.3 28.6 41.8 2 74 1 I H > + 0 0 36 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.856 360.0 43.3 -48.9 -49.2 -10.5 25.5 43.0 3 75 1 E H > S+ 0 0 131 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.863 114.3 49.3 -69.4 -35.8 -11.7 23.3 40.1 4 76 1 V H > S+ 0 0 110 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.906 112.5 50.2 -68.5 -39.4 -11.1 25.9 37.4 5 77 1 K H X S+ 0 0 88 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.900 110.0 49.5 -64.5 -43.0 -7.6 26.4 38.9 6 78 1 L H X S+ 0 0 3 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.878 111.3 49.5 -62.9 -41.2 -6.9 22.7 38.8 7 79 1 A H X S+ 0 0 58 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.867 111.9 48.0 -66.8 -39.1 -8.1 22.5 35.2 8 80 1 N H X S+ 0 0 80 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.922 110.3 53.4 -66.5 -40.9 -5.9 25.4 34.2 9 81 1 M H X S+ 0 0 1 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.886 106.4 51.1 -61.2 -40.1 -3.0 23.8 36.1 10 82 1 E H X S+ 0 0 70 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.897 112.3 48.3 -62.7 -39.2 -3.4 20.5 34.1 11 83 1 A H X S+ 0 0 48 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.860 110.2 50.3 -69.0 -36.1 -3.3 22.7 30.9 12 84 1 E H X S+ 0 0 62 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.932 112.3 48.3 -66.3 -44.9 -0.2 24.5 32.1 13 85 1 I H X S+ 0 0 4 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.917 112.0 48.4 -60.9 -46.4 1.5 21.2 32.8 14 86 1 N H X S+ 0 0 89 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.913 111.0 49.7 -63.5 -41.5 0.5 19.7 29.5 15 87 1 T H X S+ 0 0 69 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.899 110.9 51.4 -65.3 -35.6 1.7 22.8 27.6 16 88 1 L H X S+ 0 0 9 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.885 109.1 49.6 -66.6 -41.0 5.0 22.6 29.5 17 89 1 K H X S+ 0 0 79 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.899 111.4 49.7 -63.4 -42.5 5.4 18.9 28.6 18 90 1 S H X S+ 0 0 78 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.913 112.0 47.4 -61.9 -46.7 4.7 19.7 24.9 19 91 1 K H X S+ 0 0 85 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.876 111.4 50.4 -64.3 -39.4 7.3 22.5 24.9 20 92 1 L H X S+ 0 0 10 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.910 108.9 51.8 -68.3 -38.2 9.9 20.4 26.6 21 93 1 E H X S+ 0 0 108 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.896 111.1 48.6 -62.9 -38.8 9.4 17.6 24.1 22 94 1 L H X S+ 0 0 50 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.928 109.7 51.6 -66.2 -43.3 9.9 20.2 21.4 23 95 1 T H X S+ 0 0 11 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.950 110.2 49.6 -56.8 -48.3 13.1 21.4 23.1 24 96 1 N H X S+ 0 0 56 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.887 110.3 49.8 -59.4 -40.5 14.4 17.9 23.2 25 97 1 K H X S+ 0 0 75 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.927 112.6 46.9 -63.9 -46.9 13.7 17.3 19.5 26 98 1 L H X S+ 0 0 26 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.906 111.9 51.0 -60.7 -44.7 15.4 20.6 18.6 27 99 1 H H X S+ 0 0 7 -4,-2.8 4,-1.5 -5,-0.2 -2,-0.2 0.925 110.4 48.3 -60.2 -45.5 18.4 19.7 20.8 28 100 1 A H ><>S+ 0 0 13 -4,-2.4 5,-2.4 2,-0.2 3,-0.6 0.953 111.7 50.9 -60.4 -47.1 18.8 16.2 19.3 29 101 1 F H ><5S+ 0 0 9 -4,-2.5 3,-2.0 1,-0.3 -2,-0.2 0.939 110.6 47.9 -53.6 -52.2 18.6 17.8 15.8 30 102 1 S H 3<5S+ 0 0 11 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.737 107.4 57.2 -64.1 -23.5 21.3 20.3 16.6 31 103 1 M T <<5S- 0 0 38 -4,-1.5 -1,-0.3 -3,-0.6 -2,-0.2 0.373 127.7 -97.1 -88.2 5.2 23.4 17.5 18.0 32 104 1 G T < 5 + 0 0 17 -3,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.623 61.9 164.1 93.9 14.2 23.3 15.7 14.7 33 105 1 K < - 0 0 35 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.2 -0.513 29.3-142.8 -66.8 128.5 20.5 13.2 15.2 34 106 1 K > - 0 0 76 4,-0.3 3,-2.6 -2,-0.3 -1,-0.0 -0.689 37.6 -77.5 -92.0 146.4 19.5 11.9 11.8 35 107 1 S T 3 S- 0 0 60 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 -0.142 112.2 -7.8 -47.2 121.2 15.8 11.2 11.1 36 108 1 G T 3 S+ 0 0 61 118,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.531 109.9 116.9 68.3 6.9 14.7 7.9 12.7 37 109 1 K S < S- 0 0 90 -3,-2.6 -1,-0.2 117,-0.1 2,-0.1 -0.796 71.2-112.5-107.4 149.7 18.3 7.0 13.6 38 110 1 K - 0 0 48 -2,-0.3 2,-0.4 -3,-0.1 -4,-0.3 -0.417 41.5-138.4 -71.0 150.6 19.8 6.5 17.1 39 111 1 F E -A 152 0A 18 113,-1.9 113,-2.3 114,-0.2 2,-0.3 -0.925 10.7-146.3-125.2 154.5 22.2 9.3 17.9 40 112 1 F E -A 151 0A 11 -2,-0.4 2,-0.3 111,-0.2 111,-0.2 -0.853 15.8-179.9-114.3 142.8 25.6 9.6 19.5 41 113 1 V E -A 150 0A 8 109,-2.2 109,-2.9 -2,-0.3 2,-0.3 -0.998 2.5-177.3-142.5 148.3 27.0 12.4 21.6 42 114 1 T E -A 149 0A 9 -2,-0.3 300,-0.2 107,-0.2 107,-0.2 -0.971 29.2-153.7-144.7 152.0 30.3 13.2 23.4 43 115 1 N E - 0 0 2 105,-0.6 3,-0.1 -2,-0.3 106,-0.1 0.291 54.6-115.7-101.0 2.9 31.7 15.9 25.6 44 116 1 H E + 0 0 102 104,-0.5 2,-0.4 1,-0.3 105,-0.1 0.723 69.2 141.2 68.9 25.5 35.2 14.8 24.3 45 117 1 E E - 0 0 37 103,-0.3 103,-2.3 298,-0.1 2,-0.4 -0.799 44.1-141.1-101.3 142.8 36.3 13.7 27.7 46 118 1 R E +A 147 0A 103 -2,-0.4 101,-0.2 101,-0.2 99,-0.1 -0.820 35.1 142.9-103.9 137.0 38.4 10.6 28.4 47 119 1 M E -A 146 0A 9 99,-2.3 99,-2.1 -2,-0.4 2,-0.1 -0.973 51.7 -71.9-162.8 166.1 37.7 8.4 31.4 48 120 1 P E >> -A 145 0A 32 0, 0.0 3,-1.9 0, 0.0 4,-1.5 -0.409 52.0-106.1 -67.3 152.2 37.6 4.7 32.6 49 121 1 F H 3> S+ 0 0 5 93,-1.6 4,-2.7 95,-0.5 5,-0.2 0.816 118.2 58.4 -44.9 -47.5 34.8 2.5 31.4 50 122 1 S H 3> S+ 0 0 80 92,-0.5 4,-1.9 1,-0.2 -1,-0.3 0.796 107.0 49.7 -55.6 -33.0 32.9 2.5 34.7 51 123 1 K H <> S+ 0 0 120 -3,-1.9 4,-3.3 2,-0.2 -1,-0.2 0.881 108.5 50.2 -73.7 -44.7 32.7 6.4 34.5 52 124 1 V H X S+ 0 0 0 -4,-1.5 4,-3.2 2,-0.2 5,-0.4 0.963 112.5 49.2 -58.1 -49.7 31.4 6.4 30.9 53 125 1 K H X S+ 0 0 82 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.920 114.1 44.6 -53.5 -51.5 28.8 3.9 32.0 54 126 1 A H X S+ 0 0 59 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.950 115.8 48.0 -59.7 -48.1 27.8 6.0 35.1 55 127 1 L H X S+ 0 0 21 -4,-3.3 4,-1.4 2,-0.2 -2,-0.2 0.946 114.0 43.6 -58.6 -57.5 27.8 9.2 33.0 56 128 1 a H <>S+ 0 0 0 -4,-3.2 5,-3.3 1,-0.2 4,-0.3 0.877 112.3 55.3 -59.3 -36.2 25.7 8.0 30.1 57 129 1 S H ><5S+ 0 0 72 -4,-2.1 3,-1.4 -5,-0.4 -1,-0.2 0.902 104.5 53.0 -63.0 -40.5 23.4 6.3 32.6 58 130 1 E H 3<5S+ 0 0 95 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.816 108.8 50.4 -64.9 -27.0 22.9 9.7 34.3 59 131 1 L T 3<5S- 0 0 10 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.463 118.9-113.7 -90.1 1.6 22.0 11.1 30.9 60 132 1 R T < 5S+ 0 0 157 -3,-1.4 -3,-0.2 -4,-0.3 2,-0.2 0.828 85.1 107.1 66.7 33.7 19.5 8.2 30.4 61 133 1 G < - 0 0 12 -5,-3.3 2,-0.3 -6,-0.1 -1,-0.3 -0.529 63.6-125.5-122.6-168.7 21.6 7.0 27.6 62 134 1 T E -B 151 0A 48 89,-1.6 89,-3.1 -2,-0.2 2,-0.3 -0.894 38.4 -82.5-138.8 162.4 24.0 4.0 27.2 63 135 1 V E -B 150 0A 3 -2,-0.3 23,-0.3 87,-0.2 87,-0.2 -0.581 69.3 -88.2 -67.8 132.2 27.6 3.6 26.1 64 136 1 A - 0 0 0 85,-2.3 22,-2.7 -2,-0.3 -1,-0.1 -0.022 47.2-172.6 -45.6 136.0 27.6 3.7 22.3 65 137 1 I - 0 0 0 20,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.970 14.4-146.6-136.7 114.0 27.1 0.4 20.6 66 138 1 P + 0 0 0 0, 0.0 40,-0.2 0, 0.0 3,-0.1 -0.707 16.1 179.1 -81.4 133.5 27.5 -0.0 16.8 67 139 1 R + 0 0 82 -2,-0.4 2,-0.3 1,-0.2 40,-0.1 0.400 68.2 2.5-110.3 -5.0 25.1 -2.7 15.4 68 140 1 N S > S- 0 0 60 38,-0.1 4,-2.4 1,-0.1 -1,-0.2 -0.945 90.0 -79.3-164.7 178.5 26.1 -2.3 11.8 69 141 1 A H > S+ 0 0 69 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.864 122.5 53.3 -57.9 -44.7 28.5 -0.4 9.5 70 142 1 E H > S+ 0 0 98 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.935 112.7 42.5 -59.6 -50.8 26.4 2.8 9.4 71 143 1 E H > S+ 0 0 28 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.920 111.9 54.2 -64.0 -42.7 26.2 3.1 13.2 72 144 1 N H X S+ 0 0 5 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.881 111.0 47.9 -57.5 -38.1 29.9 2.2 13.6 73 145 1 K H X S+ 0 0 97 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.907 109.9 51.8 -68.4 -44.6 30.7 5.0 11.2 74 146 1 A H X S+ 0 0 34 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.937 112.9 44.1 -57.9 -49.9 28.4 7.4 13.1 75 147 1 I H X S+ 0 0 0 -4,-2.9 4,-3.0 2,-0.2 5,-0.3 0.897 112.2 53.5 -62.3 -43.7 30.2 6.7 16.4 76 148 1 Q H X S+ 0 0 40 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.937 111.6 45.8 -56.3 -46.5 33.6 6.9 14.6 77 149 1 E H < S+ 0 0 118 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.817 115.1 46.4 -67.0 -35.5 32.7 10.3 13.3 78 150 1 V H < S+ 0 0 43 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.940 117.3 41.4 -72.7 -47.5 31.3 11.6 16.6 79 151 1 A H < S- 0 0 1 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.915 73.7-171.3 -67.6 -51.0 34.2 10.3 18.8 80 152 1 K < + 0 0 139 -4,-2.1 2,-0.3 -5,-0.3 -3,-0.1 0.884 67.4 40.9 54.1 46.3 37.2 11.2 16.6 81 153 1 T S S- 0 0 43 -5,-0.2 2,-0.2 50,-0.1 50,-0.1 -0.897 115.2 -41.7 166.4 175.6 39.6 9.3 18.9 82 154 1 S - 0 0 15 -2,-0.3 65,-2.5 50,-0.1 2,-0.4 -0.469 66.0-178.1 -63.7 127.0 39.6 6.0 20.8 83 155 1 A E -Cd 131 147A 0 48,-2.2 48,-2.7 -2,-0.2 65,-0.1 -0.989 27.9-114.0-132.9 139.6 36.2 5.6 22.4 84 156 1 F E -C 130 0A 0 63,-1.2 2,-0.3 -2,-0.4 65,-0.3 -0.381 28.5-154.1 -66.4 145.6 34.7 3.0 24.7 85 157 1 L E - 0 0 0 44,-2.4 2,-1.8 2,-0.3 44,-0.5 -0.813 31.2-104.8-115.1 159.3 31.8 0.9 23.2 86 158 1 G E S+ 0 0 0 -22,-2.7 13,-2.5 -23,-0.3 14,-0.4 -0.241 88.2 104.0 -81.9 55.3 29.1 -0.8 25.3 87 159 1 I E + E 0 98A 0 -2,-1.8 42,-0.6 11,-0.3 2,-0.3 -0.999 39.1 154.1-138.7 128.8 30.7 -4.2 24.8 88 160 1 T E -CE 128 97A 13 9,-2.5 9,-3.1 -2,-0.4 40,-0.2 -0.945 39.2-147.4-147.3 167.6 32.8 -6.3 27.3 89 161 1 D E + 0 0 1 38,-1.7 6,-0.3 -2,-0.3 5,-0.1 -0.140 62.3 119.8-127.3 33.9 33.7 -9.9 28.1 90 162 1 E E S+ 0 0 99 37,-0.4 3,-0.3 1,-0.2 -1,-0.1 0.847 72.1 53.3 -67.1 -37.8 33.9 -9.3 31.9 91 163 1 V E S+ 0 0 129 1,-0.3 2,-0.4 4,-0.2 -1,-0.2 0.946 130.1 6.8 -64.5 -50.4 31.2 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76.2 82.1 138.0 22.7 -7.8 27.5 102 174 1 G S S- 0 0 36 -4,-0.1 -4,-2.7 -3,-0.1 -1,-0.2 -0.034 73.8 -77.6 108.3 148.3 23.3 -10.3 24.7 103 175 1 R B -F 97 0A 196 -6,-0.2 -6,-0.2 1,-0.1 -8,-0.0 -0.438 61.9 -81.1 -78.6 153.7 26.2 -11.7 22.6 104 176 1 L + 0 0 35 -8,-1.7 -1,-0.1 1,-0.1 3,-0.1 -0.291 41.2 175.6 -57.5 134.8 27.7 -9.7 19.8 105 177 1 T S S+ 0 0 119 1,-0.3 2,-0.4 -3,-0.1 -1,-0.1 0.496 74.5 36.5-114.9 -13.4 25.8 -9.9 16.5 106 178 1 Y + 0 0 47 -40,-0.2 -1,-0.3 -38,-0.1 2,-0.3 -0.995 70.0 178.5-140.6 133.4 28.1 -7.4 14.6 107 179 1 S - 0 0 67 -2,-0.4 -40,-0.0 -3,-0.1 0, 0.0 -0.932 20.7-179.1-135.4 157.8 31.8 -7.1 15.1 108 180 1 N + 0 0 51 -2,-0.3 29,-2.3 2,-0.0 2,-0.0 -0.175 24.3 174.2-150.5 46.9 34.6 -5.0 13.5 109 181 1 W B -g 137 0A 56 27,-0.2 29,-0.2 1,-0.1 3,-0.1 -0.269 31.7-121.1 -61.8 139.7 37.7 -6.2 15.2 110 182 1 K > - 0 0 95 27,-2.7 3,-1.8 1,-0.2 -1,-0.1 -0.321 52.2 -74.6 -71.8 161.3 41.1 -4.9 14.1 111 183 1 K T 3 S+ 0 0 173 1,-0.3 -1,-0.2 27,-0.0 25,-0.0 -0.358 121.4 15.6 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