==== 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 HYDROLASE (O-GLYCOSYL) 07-JUL-95 1ING . COMPND 2 MOLECULE: INFLUENZA A SUBTYPE N2 NEURAMINIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR M.J.JEDRZEJAS,M.LUO . 776 2 18 18 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25956.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 472 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 258 33.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 18 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 78 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 2.3 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 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 RESIDUES PER ALPHA HELIX . 4 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 . 6 0 4 2 16 6 6 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 8 4 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 82 A V 0 0 144 0, 0.0 2,-0.3 0, 0.0 105,-0.1 0.000 360.0 360.0 360.0 164.5 15.5 9.5 -8.6 2 83 A E - 0 0 169 103,-0.3 2,-0.1 1,-0.0 3,-0.0 -0.774 360.0 -91.5-128.0 173.5 14.8 12.6 -10.7 3 84 A Y - 0 0 76 -2,-0.3 2,-0.5 150,-0.1 102,-0.3 -0.473 39.7-102.5 -87.6 162.3 17.1 14.7 -12.8 4 85 A R + 0 0 22 100,-2.8 149,-2.3 1,-0.1 150,-0.3 -0.740 41.9 170.0 -81.7 126.1 19.0 17.7 -11.6 5 86 A N - 0 0 65 -2,-0.5 -1,-0.1 147,-0.2 147,-0.1 0.219 30.3-147.0-116.9 2.3 17.0 20.7 -13.0 6 87 A W + 0 0 7 1,-0.2 2,-3.0 145,-0.1 197,-0.3 0.468 36.7 158.7 38.4 22.2 19.0 23.2 -10.9 7 88 A S + 0 0 54 195,-0.1 -1,-0.2 329,-0.1 195,-0.0 -0.116 33.6 111.0 -66.2 50.8 16.0 25.6 -10.5 8 89 A K S S- 0 0 66 -2,-3.0 329,-0.3 3,-0.0 195,-0.2 -0.964 74.7-103.9-129.5 142.7 17.3 27.4 -7.4 9 90 A P - 0 0 97 0, 0.0 328,-1.2 0, 0.0 2,-0.1 -0.322 45.1-105.6 -60.1 137.6 18.6 30.9 -6.9 10 91 A Q B -a 337 0A 43 326,-0.2 328,-0.2 1,-0.1 192,-0.0 -0.477 45.8-100.3 -63.1 137.2 22.4 31.0 -6.7 11 92 A a - 0 0 18 326,-1.5 2,-1.3 -2,-0.1 -1,-0.1 -0.205 27.0-117.9 -58.8 154.5 23.5 31.6 -3.1 12 93 A Q - 0 0 122 -3,-0.1 2,-0.2 355,-0.0 -1,-0.1 -0.724 42.4-161.3 -96.6 85.0 24.5 35.1 -2.1 13 94 A I - 0 0 9 -2,-1.3 356,-0.3 1,-0.1 3,-0.1 -0.448 27.9-166.0 -75.4 148.2 28.1 34.5 -1.1 14 95 A T - 0 0 60 354,-2.2 2,-0.3 1,-0.3 355,-0.2 0.516 68.3 -61.7-100.9 -18.0 30.3 36.7 1.1 15 96 A G E -B 368 0A 0 353,-1.3 353,-1.8 356,-0.1 2,-0.4 -0.989 69.4 -48.8 162.6-158.3 33.5 34.9 0.1 16 97 A F E -B 367 0A 1 -2,-0.3 351,-0.2 351,-0.2 324,-0.1 -0.939 35.7-170.0-122.0 133.6 35.3 31.6 0.2 17 98 A A E -B 366 0A 26 349,-2.6 349,-3.0 -2,-0.4 355,-0.1 -0.780 36.9 -89.4-111.7 155.9 35.9 29.1 3.0 18 99 A P E +B 365 0A 77 0, 0.0 347,-0.2 0, 0.0 -1,-0.1 -0.248 46.4 159.8 -62.5 148.7 38.1 26.0 3.0 19 100 A F E - 0 0 106 345,-1.7 2,-0.3 1,-0.5 346,-0.2 0.622 54.1 -6.7-137.8 -49.4 36.7 22.6 1.9 20 101 A S E +B 364 0A 28 344,-1.9 344,-2.3 63,-0.0 -1,-0.5 -0.939 43.0 172.3-149.8 170.9 39.2 19.9 0.9 21 102 A K E -B 363 0A 58 -2,-0.3 342,-0.2 342,-0.2 358,-0.0 -0.801 12.2-163.6-176.0 142.2 42.9 19.3 0.3 22 103 A D - 0 0 7 340,-1.0 5,-0.2 -2,-0.3 341,-0.1 0.424 18.3-145.2-121.2 -0.3 44.6 16.0 -0.4 23 104 A N > + 0 0 54 339,-0.4 4,-2.5 1,-0.1 5,-0.4 0.614 39.7 158.8 46.0 18.0 48.4 16.6 0.1 24 105 A S H > S+ 0 0 2 1,-0.3 4,-2.0 2,-0.2 -1,-0.1 0.785 70.1 46.1 -38.7 -47.8 49.0 14.1 -2.7 25 106 A I H > S+ 0 0 0 2,-0.2 4,-0.7 1,-0.2 3,-0.3 0.976 111.8 51.9 -65.8 -48.0 52.5 15.3 -3.4 26 107 A R H >4 S+ 0 0 146 353,-0.3 3,-1.2 1,-0.3 -2,-0.2 0.930 114.0 43.4 -51.1 -49.0 53.4 15.3 0.3 27 108 A L H >< S+ 0 0 77 -4,-2.5 3,-2.8 1,-0.2 -1,-0.3 0.818 99.2 75.2 -65.5 -32.0 52.2 11.7 0.6 28 109 A S H 3< S+ 0 0 1 -4,-2.0 3,-0.5 -5,-0.4 -1,-0.2 0.683 88.2 58.8 -55.7 -23.1 53.9 10.8 -2.7 29 110 A A T << S+ 0 0 45 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.383 121.1 27.3 -88.2 4.9 57.3 10.8 -1.0 30 111 A G S < S+ 0 0 74 -3,-2.8 2,-0.3 1,-0.2 -2,-0.2 0.044 120.0 37.7-156.3 39.5 56.0 8.2 1.3 31 112 A G S S- 0 0 30 -3,-0.5 2,-1.9 2,-0.1 -1,-0.2 -0.925 87.1 -88.2 176.6 154.1 53.2 6.2 -0.4 32 113 A D + 0 0 61 -2,-0.3 56,-1.2 26,-0.1 2,-0.4 -0.573 63.6 159.0 -77.4 83.8 52.1 4.6 -3.7 33 114 A I B -E 87 0B 14 -2,-1.9 26,-1.3 -5,-0.2 27,-0.3 -0.877 38.7-110.7-110.2 145.7 50.3 7.7 -5.0 34 115 A W B -F 58 0C 2 52,-3.2 2,-0.5 -2,-0.4 24,-0.2 -0.074 17.8-124.0 -68.5 170.0 49.5 8.4 -8.6 35 116 A V + 0 0 0 22,-1.7 20,-1.8 23,-0.1 22,-0.2 -0.831 47.1 162.2-119.9 89.2 51.0 11.1 -10.9 36 117 A T - 0 0 3 -2,-0.5 2,-0.3 324,-0.3 18,-0.2 -0.186 20.0-172.8 -99.6-173.1 48.2 13.1 -12.3 37 118 A R + 0 0 34 16,-0.3 16,-2.1 1,-0.2 323,-0.0 -0.933 60.9 36.3-172.7 162.8 47.5 16.5 -13.9 38 119 A E S S- 0 0 10 -2,-0.3 15,-0.6 14,-0.2 -1,-0.2 0.963 77.7-177.9 44.3 73.1 44.6 18.7 -15.0 39 120 A P E +G 52 0D 0 0, 0.0 2,-0.3 0, 0.0 13,-0.3 -0.350 13.5 169.0 -89.5 179.5 42.4 17.8 -12.0 40 121 A Y E -G 51 0D 0 11,-1.8 11,-3.0 -2,-0.1 2,-0.3 -0.950 22.7-129.3-177.9 166.7 38.8 18.8 -11.1 41 122 A V E +G 50 0D 0 287,-0.3 2,-0.3 -2,-0.3 107,-0.3 -0.968 22.3 170.4-134.4 151.7 36.0 18.0 -8.7 42 123 A S E -G 49 0D 0 7,-2.1 7,-3.2 -2,-0.3 2,-0.3 -0.956 15.0-148.8-150.4 165.3 32.3 17.2 -9.2 43 124 A b E -G 48 0D 5 -2,-0.3 60,-0.3 5,-0.3 5,-0.3 -0.966 8.7-143.9-144.0 148.6 29.5 15.9 -7.1 44 125 A D - 0 0 10 3,-2.8 60,-0.1 -2,-0.3 64,-0.0 -0.634 57.2 -81.9 -98.4 169.6 26.4 13.9 -7.5 45 126 A P S S+ 0 0 91 0, 0.0 3,-0.1 0, 0.0 287,-0.0 0.867 129.0 38.7 -42.0 -50.3 23.5 15.0 -5.2 46 127 A V S S- 0 0 114 1,-0.1 2,-0.3 -3,-0.0 -3,-0.0 0.910 123.6 -4.6 -72.3 -44.3 24.8 13.1 -2.2 47 128 A K - 0 0 79 -3,-0.0 -3,-2.8 34,-0.0 2,-0.2 -0.941 60.6-111.5-149.0 172.6 28.6 13.5 -2.4 48 129 A b E -G 43 0D 17 -2,-0.3 34,-2.5 -5,-0.3 2,-0.3 -0.685 20.5-169.9-105.7 159.4 31.7 14.9 -4.2 49 130 A Y E -GH 42 81D 46 -7,-3.2 -7,-2.1 32,-0.3 2,-0.4 -0.892 18.8-128.3-139.7 162.4 34.6 13.1 -5.9 50 131 A Q E -GH 41 80D 2 30,-2.5 30,-2.2 -2,-0.3 -9,-0.3 -0.969 20.3-157.9-121.6 129.2 37.8 14.4 -7.3 51 132 A F E +GH 40 79D 1 -11,-3.0 -11,-1.8 -2,-0.4 2,-0.2 -0.630 16.0 164.2-105.2 160.1 39.0 13.7 -10.9 52 133 A A E -GH 39 78D 0 26,-1.0 26,-3.0 -13,-0.3 2,-1.2 -0.840 39.1-121.9-173.9 138.3 42.5 13.8 -12.4 53 134 A L E - H 0 77D 0 -16,-2.1 -16,-0.3 -15,-0.6 24,-0.2 -0.775 39.1-157.5 -87.1 94.1 44.2 12.5 -15.5 54 135 A G - 0 0 0 22,-1.8 22,-0.5 -2,-1.2 -18,-0.3 -0.209 22.8-120.5 -68.3 167.1 47.0 10.3 -14.1 55 136 A Q - 0 0 5 -20,-1.8 20,-0.2 2,-0.4 19,-0.1 0.091 50.5-103.0 -96.8 26.2 50.1 9.4 -16.0 56 137 A G S S+ 0 0 0 1,-0.2 2,-0.3 20,-0.2 19,-0.1 0.809 97.5 68.1 58.9 28.6 49.4 5.7 -15.9 57 138 A T S S- 0 0 0 -22,-0.2 -22,-1.7 358,-0.1 -2,-0.4 -0.947 77.8-108.9-162.1 177.9 52.1 5.6 -13.1 58 139 A T B > -F 34 0C 1 -2,-0.3 3,-0.6 -24,-0.2 -24,-0.2 -0.720 36.9-109.7-112.9 161.8 53.2 6.5 -9.6 59 140 A L T 3 S+ 0 0 1 -26,-1.3 5,-0.2 -2,-0.2 -25,-0.1 0.776 118.6 51.7 -62.7 -34.4 55.9 9.1 -8.6 60 141 A D T 3 S+ 0 0 95 -27,-0.3 -1,-0.2 359,-0.2 2,-0.2 0.625 87.7 98.8 -78.1 -15.3 58.3 6.4 -7.5 61 142 A N S X S- 0 0 0 -3,-0.6 3,-1.8 358,-0.2 4,-0.3 -0.545 78.7-135.6 -70.7 138.5 58.0 4.6 -10.8 62 143 A K G > S+ 0 0 129 1,-0.3 3,-1.5 356,-0.2 -1,-0.2 0.708 104.1 81.0 -65.3 -14.8 60.9 5.4 -13.1 63 144 A H G 3 S+ 0 0 12 1,-0.3 -1,-0.3 352,-0.2 -2,-0.1 0.346 74.3 74.2 -69.3 2.4 57.9 5.7 -15.4 64 145 A S G X + 0 0 0 -3,-1.8 3,-2.0 -5,-0.2 294,-0.3 0.782 66.9 106.0 -85.2 -31.5 57.5 9.1 -13.9 65 146 A N T < S+ 0 0 73 -3,-1.5 292,-0.2 1,-0.3 291,-0.0 -0.277 88.9 19.2 -52.6 127.2 60.5 10.5 -15.8 66 147 A D T > S+ 0 0 79 290,-1.9 3,-1.4 1,-0.0 -1,-0.3 0.551 74.1 145.5 82.7 20.9 59.0 12.7 -18.6 67 148 A T T < + 0 0 8 -3,-2.0 290,-0.1 289,-0.6 -2,-0.1 0.478 53.7 86.6 -65.8 1.7 55.6 13.1 -17.0 68 149 A V T 3 + 0 0 46 288,-0.3 -1,-0.3 2,-0.0 289,-0.1 0.931 61.6 102.4 -69.2 -44.3 55.6 16.6 -18.5 69 150 A H < - 0 0 103 -3,-1.4 3,-0.1 1,-0.1 0, 0.0 -0.063 68.4-142.9 -43.0 134.0 54.1 15.4 -21.8 70 151 A D S S+ 0 0 85 1,-0.2 2,-0.4 5,-0.0 -1,-0.1 0.764 76.8 32.1 -75.3 -31.2 50.4 16.2 -22.1 71 152 A R + 0 0 82 -16,-0.0 -1,-0.2 3,-0.0 46,-0.1 -0.925 58.2 154.6-138.5 112.3 49.1 13.2 -23.9 72 153 A I > - 0 0 30 -2,-0.4 3,-2.3 -3,-0.1 24,-0.1 -0.963 54.8-110.9-127.7 152.1 50.2 9.6 -23.7 73 154 A P T 3 S+ 0 0 43 0, 0.0 -17,-0.1 0, 0.0 23,-0.1 0.721 114.7 64.6 -55.1 -16.2 48.1 6.5 -24.4 74 155 A H T 3 + 0 0 11 -19,-0.1 2,-0.5 21,-0.1 -18,-0.1 0.495 66.8 114.5 -87.4 -5.8 48.4 5.7 -20.7 75 156 A R < + 0 0 3 -3,-2.3 21,-2.2 -20,-0.2 2,-0.3 -0.557 44.4 178.9 -71.5 118.9 46.6 8.8 -19.3 76 157 A T E - I 0 95D 0 -22,-0.5 -22,-1.8 -2,-0.5 2,-0.7 -0.895 33.3-109.2-120.3 147.5 43.5 7.4 -17.6 77 158 A L E -H 53 0D 0 17,-2.3 16,-1.5 -2,-0.3 17,-0.4 -0.737 34.9-157.9 -83.3 112.8 40.7 9.4 -15.7 78 159 A L E -HI 52 92D 0 -26,-3.0 -26,-1.0 -2,-0.7 2,-0.3 -0.590 6.5-166.2 -87.5 154.5 41.0 8.6 -11.9 79 160 A M E +HI 51 91D 15 12,-1.1 12,-0.5 -2,-0.2 2,-0.3 -0.865 13.3 162.9-148.8 104.8 38.1 9.2 -9.6 80 161 A N E -H 50 0D 16 -30,-2.2 -30,-2.5 -2,-0.3 2,-0.1 -0.749 46.6 -91.4-116.1 168.7 38.1 9.3 -5.8 81 162 A E E > -H 49 0D 105 -32,-0.3 3,-1.9 -2,-0.3 2,-0.6 -0.438 66.1 -82.4 -70.7 149.3 35.7 10.5 -3.2 82 163 A L T 3 S+ 0 0 30 -34,-2.5 -1,-0.1 1,-0.2 -34,-0.1 -0.420 118.8 24.2 -59.2 106.9 36.6 14.1 -2.4 83 164 A G T 3 S+ 0 0 39 -2,-0.6 -1,-0.2 1,-0.3 -34,-0.1 0.297 92.2 102.3 125.4 -13.7 39.4 13.9 0.1 84 165 A V < - 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