==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 23-JUL-05 2AEP . COMPND 2 MOLECULE: NEURAMINIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR L.VENKATRAMANI,E.BOCHKAREVA,J.T.LEE,U.GULATI,W.G.LAVER,A.BOC . 660 8 11 11 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27340.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 391 59.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 225 34.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.5 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 . 61 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 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 RESIDUES PER ALPHA HELIX . 1 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 3 5 4 5 12 3 0 2 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 6 2 0 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 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 82 A A 0 0 113 0, 0.0 2,-0.3 0, 0.0 105,-0.1 0.000 360.0 360.0 360.0 146.3 147.1 68.2 69.5 2 83 A E - 0 0 166 103,-0.2 2,-0.1 1,-0.0 152,-0.1 -0.819 360.0 -98.5-116.0 155.6 144.2 65.9 70.3 3 84 A Y - 0 0 67 -2,-0.3 102,-0.3 102,-0.1 2,-0.2 -0.480 42.4-115.4 -65.3 136.0 142.4 63.2 68.4 4 85 A R + 0 0 22 100,-2.1 149,-2.1 -2,-0.1 150,-0.6 -0.564 32.5 176.2 -68.1 140.2 139.1 64.3 66.8 5 86 A N - 0 0 60 147,-0.2 -1,-0.1 -2,-0.2 3,-0.1 0.475 28.7-143.8-118.0 -12.7 136.0 62.6 68.1 6 87 A W + 0 0 8 1,-0.2 2,-1.4 196,-0.1 197,-0.5 0.828 42.8 155.6 54.5 28.5 133.4 64.5 66.1 7 88 A S + 0 0 58 195,-0.1 -1,-0.2 197,-0.1 145,-0.0 -0.511 33.7 99.9 -89.9 63.4 131.2 64.4 69.2 8 89 A K S S- 0 0 69 -2,-1.4 195,-0.2 -3,-0.1 328,-0.2 -0.936 80.3 -95.3-133.3 155.0 129.1 67.5 68.3 9 90 A P - 0 0 92 0, 0.0 328,-2.7 0, 0.0 2,-0.1 -0.260 46.1 -88.4 -67.2 162.3 125.6 67.3 66.8 10 91 A Q B -a 337 0A 52 326,-0.2 328,-0.2 1,-0.1 3,-0.1 -0.464 51.9-107.9 -64.3 134.2 125.0 67.6 63.1 11 92 A a - 0 0 16 326,-2.4 2,-0.2 -2,-0.1 -1,-0.1 -0.278 36.9 -96.4 -58.9 148.8 124.5 71.2 62.0 12 93 A K - 0 0 148 -3,-0.1 2,-0.5 355,-0.1 -1,-0.1 -0.523 45.8-156.1 -58.9 133.8 121.1 72.4 61.1 13 94 A I + 0 0 4 -2,-0.2 356,-0.2 356,-0.1 3,-0.1 -0.970 33.3 162.9-126.2 116.5 120.9 72.2 57.2 14 95 A T S S- 0 0 34 354,-3.1 2,-0.3 -2,-0.5 355,-0.1 0.401 76.0 -66.1-100.4 -0.2 118.5 74.2 55.0 15 96 A G E -B 368 0A 0 353,-0.8 353,-2.1 281,-0.1 -1,-0.4 -0.971 69.0 -56.7 141.5-158.0 120.5 73.4 51.9 16 97 A F E -B 367 0A 1 -2,-0.3 351,-0.2 351,-0.2 324,-0.1 -0.892 31.9-153.6-130.7 145.8 124.0 74.2 50.6 17 98 A A E -B 366 0A 30 349,-3.1 349,-2.6 -2,-0.3 2,-0.1 -0.906 37.8 -89.7-116.5 148.2 126.1 77.3 49.8 18 99 A P E +B 365 0A 79 0, 0.0 347,-0.2 0, 0.0 3,-0.1 -0.351 47.8 163.3 -56.8 136.7 128.9 77.7 47.4 19 100 A F E - 0 0 102 345,-2.5 2,-0.3 1,-0.3 346,-0.2 0.697 53.7 -12.0-124.6 -43.0 132.3 76.9 48.9 20 101 A S E -B 364 0A 26 344,-2.3 344,-2.7 63,-0.0 -1,-0.3 -0.987 41.7-178.7-162.6 157.7 135.0 76.4 46.2 21 102 A K E -B 363 0A 50 -2,-0.3 342,-0.2 342,-0.2 358,-0.0 -0.976 9.9-163.3-157.8 139.1 135.7 75.8 42.5 22 103 A D - 0 0 7 340,-1.7 5,-0.1 -2,-0.3 341,-0.1 0.638 14.7-151.9-106.5 -15.2 139.0 75.3 40.8 23 104 A N > + 0 0 61 339,-0.5 4,-1.9 1,-0.1 5,-0.2 0.757 36.2 158.8 55.3 35.6 138.3 75.9 37.1 24 105 A S H > + 0 0 3 1,-0.2 4,-1.9 2,-0.2 337,-0.1 0.787 60.6 50.3 -70.5 -32.4 141.1 73.6 36.3 25 106 A I H > S+ 0 0 1 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.928 111.2 50.9 -71.1 -43.3 140.4 72.5 32.7 26 107 A R H >4 S+ 0 0 147 353,-0.3 3,-1.0 1,-0.2 -2,-0.2 0.920 112.7 46.9 -54.0 -42.9 140.0 76.1 31.7 27 108 A L H >< S+ 0 0 78 -4,-1.9 3,-2.4 1,-0.2 -2,-0.2 0.875 101.1 66.5 -67.3 -34.6 143.4 76.9 33.3 28 109 A S H >< S+ 0 0 1 -4,-1.9 3,-0.6 1,-0.3 -1,-0.2 0.631 90.1 63.4 -67.2 -15.4 145.0 73.9 31.7 29 110 A A T << S+ 0 0 45 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.494 117.6 28.9 -82.1 -8.6 144.5 75.5 28.2 30 111 A G T < S+ 0 0 73 -3,-2.4 2,-0.2 -4,-0.1 -1,-0.2 -0.272 126.5 22.8-145.6 58.3 146.9 78.3 29.4 31 112 A G S < S- 0 0 35 -3,-0.6 2,-0.9 2,-0.1 29,-0.3 -0.877 89.8 -74.9 157.7 165.4 149.2 76.6 32.0 32 113 A D + 0 0 96 -2,-0.2 56,-0.5 27,-0.1 2,-0.4 -0.778 57.2 162.6-100.9 102.7 150.6 73.3 33.2 33 114 A I - 0 0 12 -2,-0.9 26,-2.1 -5,-0.2 27,-0.2 -0.968 38.3-107.7-123.8 132.5 147.9 71.5 35.1 34 115 A W E -E 58 0B 19 52,-2.8 2,-0.5 -2,-0.4 24,-0.3 -0.266 25.9-121.8 -53.9 139.5 147.7 67.8 36.0 35 116 A V E + 0 0 0 22,-2.8 20,-1.6 324,-0.1 22,-0.4 -0.787 49.9 167.3 -76.6 128.1 145.4 65.4 34.3 36 117 A T E +E 54 0B 2 -2,-0.5 2,-0.3 18,-0.2 18,-0.2 -0.801 27.7 176.1-132.3 168.4 143.1 64.0 37.0 37 118 A R E +E 53 0B 25 16,-0.9 16,-2.2 -2,-0.2 323,-0.1 -0.903 63.3 44.9-155.4-179.3 140.0 62.1 37.9 38 119 A E E S+ 0 0 7 -2,-0.3 61,-0.1 14,-0.2 -1,-0.1 0.904 72.8 178.3 48.5 58.3 138.4 60.8 41.2 39 120 A P E + 0 0 1 0, 0.0 2,-0.3 0, 0.0 13,-0.3 -0.297 6.9 165.4 -78.4 167.0 138.9 64.0 43.2 40 121 A Y E -E 51 0B 0 11,-2.0 11,-3.3 107,-0.1 2,-0.3 -0.957 25.7-124.3-169.3 176.6 137.7 64.6 46.7 41 122 A V E +E 50 0B 0 -2,-0.3 107,-0.5 9,-0.2 2,-0.3 -0.962 22.8 168.3-133.2 147.3 138.1 67.0 49.7 42 123 A S E -E 49 0B 0 7,-1.9 7,-2.5 -2,-0.3 2,-0.4 -0.950 19.8-145.4-154.6 149.2 139.1 66.4 53.3 43 124 A b E -E 48 0B 6 287,-0.4 60,-0.3 -2,-0.3 5,-0.3 -0.927 3.3-146.0-122.4 138.4 140.0 69.0 55.9 44 125 A D - 0 0 27 3,-2.7 62,-0.0 -2,-0.4 5,-0.0 -0.277 55.7 -76.8 -81.5-177.3 142.5 68.9 58.8 45 126 A P S S+ 0 0 72 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.698 130.9 29.1 -59.4 -20.9 141.5 70.9 62.0 46 127 A D S S+ 0 0 151 1,-0.3 2,-0.3 0, 0.0 -3,-0.0 0.780 123.8 6.8-106.3 -31.5 142.3 74.2 60.4 47 128 A K - 0 0 90 -5,-0.0 -3,-2.7 34,-0.0 -1,-0.3 -0.966 63.8-107.4-157.2 163.0 141.8 74.0 56.6 48 129 A b E -E 43 0B 20 -2,-0.3 34,-2.3 -5,-0.3 2,-0.4 -0.586 23.0-159.5 -98.8 153.9 140.6 72.0 53.6 49 130 A Y E -EF 42 81B 40 -7,-2.5 -7,-1.9 32,-0.3 2,-0.4 -0.960 11.0-138.6-133.6 143.7 142.5 70.2 51.0 50 131 A Q E -EF 41 80B 0 30,-2.8 30,-2.5 -2,-0.4 2,-0.3 -0.885 23.4-172.2-102.6 144.7 141.6 69.0 47.6 51 132 A F E +EF 40 79B 1 -11,-3.3 -11,-2.0 -2,-0.4 2,-0.3 -0.843 10.3 160.1-131.0 155.2 142.8 65.6 46.4 52 133 A A E - F 0 78B 0 26,-1.5 26,-3.7 -2,-0.3 2,-0.8 -0.956 41.9-101.8-167.6 162.0 142.7 63.7 43.1 53 134 A L E -EF 37 77B 0 -16,-2.2 -16,-0.9 -2,-0.3 24,-0.2 -0.805 39.0-146.4 -90.1 109.9 144.4 60.9 41.3 54 135 A G E -E 36 0B 0 22,-2.8 -18,-0.2 -2,-0.8 22,-0.1 -0.116 11.6-141.5 -60.4 162.6 146.9 62.1 38.7 55 136 A Q E - 0 0 16 -20,-1.6 20,-0.2 2,-0.5 -19,-0.1 0.075 51.4-102.7-108.3 19.0 147.5 60.4 35.4 56 137 A G E S+ 0 0 36 -21,-0.3 2,-0.3 1,-0.2 19,-0.1 0.816 95.6 72.6 67.9 26.2 151.2 61.1 35.6 57 138 A T E S- 0 0 8 -22,-0.4 -22,-2.8 7,-0.1 -2,-0.5 -0.981 77.8-116.3-158.9 157.4 151.0 63.9 33.1 58 139 A T E -E 34 0B 15 -24,-0.3 -24,-0.3 -2,-0.3 3,-0.2 -0.539 37.2-114.0 -87.2 170.5 149.7 67.5 32.6 59 140 A L S S+ 0 0 1 -26,-2.1 2,-1.9 1,-0.2 5,-0.2 0.908 109.9 57.6 -77.8 -50.5 147.0 68.0 30.1 60 141 A N S S+ 0 0 91 -29,-0.3 2,-0.3 -27,-0.2 -1,-0.2 -0.603 92.8 96.0 -80.2 75.0 148.8 70.1 27.5 61 142 A N S > S- 0 0 58 -2,-1.9 3,-2.3 -3,-0.2 4,-0.2 -0.935 85.1-119.2-166.4 135.7 151.4 67.3 27.1 62 143 A R G > S+ 0 0 213 1,-0.3 3,-1.3 -2,-0.3 -3,-0.0 0.778 111.5 68.2 -65.5 -20.1 151.5 64.4 24.5 63 144 A H G 3 S+ 0 0 146 1,-0.2 -1,-0.3 -5,-0.1 -4,-0.1 0.514 80.6 77.5 -70.6 -8.8 151.2 62.0 27.4 64 145 A S G X + 0 0 2 -3,-2.3 3,-0.9 -5,-0.2 294,-0.3 0.570 67.2 115.9 -74.6 -9.8 147.6 63.2 28.0 65 146 A N T < S- 0 0 73 -3,-1.3 292,-0.2 1,-0.3 293,-0.0 -0.406 86.4 -0.2 -66.8 126.5 146.5 61.1 25.0 66 147 A D T 3 S+ 0 0 39 290,-2.3 3,-0.5 -2,-0.2 -1,-0.3 0.917 75.7 152.7 60.2 55.6 144.2 58.3 26.1 67 148 A T < + 0 0 9 -3,-0.9 -1,-0.1 289,-0.4 290,-0.1 0.131 40.2 105.2-101.8 21.7 144.1 59.1 29.9 68 149 A V + 0 0 49 288,-0.2 -1,-0.2 289,-0.0 2,-0.1 0.670 51.8 103.5 -70.1 -18.5 140.6 57.5 30.2 69 150 A H - 0 0 23 -3,-0.5 3,-0.1 1,-0.1 289,-0.1 -0.395 63.6-145.8 -77.7 142.8 141.9 54.3 31.9 70 151 A D S S+ 0 0 68 1,-0.2 2,-0.5 -2,-0.1 -1,-0.1 0.796 78.3 44.1 -75.4 -29.4 141.4 54.0 35.7 71 152 A R + 0 0 44 43,-0.0 -1,-0.2 3,-0.0 46,-0.1 -0.955 60.1 138.1-133.7 111.4 144.5 52.2 36.6 72 153 A T > - 0 0 18 -2,-0.5 3,-1.1 -3,-0.1 373,-0.1 -0.945 57.9-111.8-138.5 168.7 148.1 52.7 35.5 73 154 A P T 3 S+ 0 0 70 0, 0.0 372,-0.1 0, 0.0 -17,-0.0 0.520 113.1 63.3 -76.1 -5.9 151.5 52.7 37.4 74 155 A Y T 3 S+ 0 0 159 -19,-0.1 2,-0.2 21,-0.1 -18,-0.2 0.492 75.4 110.2 -98.9 -2.8 151.7 56.4 36.8 75 156 A R < + 0 0 1 -3,-1.1 21,-1.7 -20,-0.2 2,-0.3 -0.502 43.3 174.1 -77.8 137.9 148.7 57.4 38.8 76 157 A T E - G 0 95B 15 19,-0.3 -22,-2.8 -2,-0.2 2,-0.6 -0.947 36.6-107.0-139.7 152.0 149.5 59.3 42.1 77 158 A L E -FG 53 94B 0 17,-2.3 16,-2.3 -2,-0.3 17,-0.6 -0.750 35.7-156.8 -83.1 122.9 147.4 60.9 44.8 78 159 A L E -FG 52 92B 0 -26,-3.7 -26,-1.5 -2,-0.6 2,-0.3 -0.743 9.9-172.3-101.4 149.2 147.7 64.7 44.5 79 160 A M E +FG 51 91B 25 12,-1.4 12,-0.8 -2,-0.3 2,-0.3 -0.961 15.0 149.0-148.3 118.8 147.0 67.0 47.5 80 161 A N E -F 50 0B 18 -30,-2.5 -30,-2.8 -2,-0.3 3,-0.1 -0.942 54.9 -76.4-138.0 167.3 146.8 70.7 47.6 81 162 A E E > -F 49 0B 90 -2,-0.3 3,-2.1 -32,-0.3 -32,-0.3 -0.334 67.3 -88.6 -58.9 140.1 145.0 73.3 49.7 82 163 A L T 3 S+ 0 0 30 -34,-2.3 -1,-0.1 1,-0.3 -34,-0.1 -0.360 117.3 25.8 -54.4 132.4 141.4 73.5 48.5 83 164 A G T 3 S+ 0 0 36 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.218 92.4 110.9 92.6 -12.1 141.1 76.1 45.7 84 165 A V < - 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