==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 06-SEP-12 4GZQ . COMPND 2 MOLECULE: NUERAMINIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR X.ZHU,I.A.WILSON . 388 1 9 9 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15224.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 58.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 134 34.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 2.1 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 . 35 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 1 3 3 6 3 1 1 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 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 82 A A 0 0 124 0, 0.0 2,-0.3 0, 0.0 105,-0.1 0.000 360.0 360.0 360.0 123.7 2.6 43.4 45.8 2 83 A E - 0 0 167 103,-0.1 2,-0.2 1,-0.0 151,-0.0 -0.738 360.0 -92.7-114.0 158.1 2.9 39.7 46.7 3 84 A Y - 0 0 52 -2,-0.3 102,-0.3 150,-0.1 2,-0.2 -0.507 41.9-114.3 -68.4 134.5 4.1 36.5 44.9 4 85 A R + 0 0 21 100,-2.3 149,-2.2 -2,-0.2 150,-0.6 -0.462 36.1 171.4 -62.8 135.9 1.4 34.5 43.1 5 86 A N - 0 0 56 147,-0.3 -1,-0.1 -2,-0.2 198,-0.0 0.587 28.7-147.0-117.0 -28.3 0.9 31.0 44.7 6 87 A W + 0 0 8 1,-0.2 2,-1.8 197,-0.1 197,-0.4 0.753 37.5 160.3 59.8 28.6 -2.1 29.9 42.7 7 88 A S + 0 0 75 195,-0.1 -1,-0.2 329,-0.1 195,-0.0 -0.126 34.9 105.1 -78.7 43.6 -3.2 28.0 45.8 8 89 A K S S- 0 0 60 -2,-1.8 195,-0.2 -3,-0.0 328,-0.2 -0.910 76.4-105.4-120.1 150.5 -6.8 27.8 44.7 9 90 A P - 0 0 97 0, 0.0 328,-1.8 0, 0.0 2,-0.3 -0.296 49.2 -89.5 -67.3 160.0 -8.8 24.8 43.3 10 91 A Q B -a 337 0A 45 326,-0.2 328,-0.2 1,-0.1 3,-0.1 -0.561 46.2-108.4 -77.1 131.3 -9.5 24.8 39.5 11 92 A a - 0 0 19 326,-1.9 2,-0.2 -2,-0.3 -1,-0.1 -0.153 37.8 -96.1 -56.0 149.0 -12.7 26.5 38.4 12 93 A D - 0 0 126 355,-0.1 2,-0.4 326,-0.0 -1,-0.1 -0.484 43.2-159.6 -61.5 128.5 -15.6 24.3 37.2 13 94 A I + 0 0 12 -2,-0.2 356,-0.2 1,-0.1 3,-0.1 -0.959 31.3 164.8-117.0 134.1 -15.5 24.1 33.4 14 95 A T S S- 0 0 56 354,-2.6 2,-0.3 1,-0.5 355,-0.1 0.235 75.1 -64.4-117.9 3.4 -18.5 23.2 31.2 15 96 A G E -B 368 0A 0 353,-0.6 353,-1.8 281,-0.1 -1,-0.5 -0.971 69.4 -54.4 142.5-157.1 -16.7 24.6 28.1 16 97 A F E -B 367 0A 1 -2,-0.3 351,-0.2 351,-0.2 324,-0.1 -0.937 29.1-156.2-132.1 142.1 -15.4 27.9 26.8 17 98 A A E -B 366 0A 32 349,-2.8 349,-2.4 -2,-0.4 355,-0.1 -0.834 40.3 -89.5-110.6 147.7 -16.7 31.4 26.1 18 99 A P E +B 365 0A 85 0, 0.0 347,-0.2 0, 0.0 3,-0.1 -0.272 47.9 164.1 -53.7 142.4 -15.3 33.9 23.7 19 100 A F E - 0 0 103 345,-2.6 2,-0.3 1,-0.3 346,-0.2 0.642 53.1 -5.9-124.7 -49.2 -12.6 36.2 25.2 20 101 A S E +B 364 0A 22 344,-1.7 344,-2.3 63,-0.0 -1,-0.3 -0.999 41.0 178.6-160.7 147.5 -10.6 38.0 22.5 21 102 A K E -B 363 0A 55 -2,-0.3 342,-0.2 342,-0.2 340,-0.0 -0.920 7.8-169.6-154.3 125.7 -9.8 38.4 18.8 22 103 A D - 0 0 6 340,-1.1 5,-0.2 -2,-0.3 341,-0.1 0.583 19.5-149.9 -97.2 -10.6 -7.4 40.9 17.1 23 104 A N >> + 0 0 56 339,-0.6 4,-2.4 1,-0.1 3,-0.9 0.745 35.3 165.2 49.8 21.0 -8.3 40.5 13.4 24 105 A S H 3> + 0 0 1 1,-0.3 4,-1.0 2,-0.2 337,-0.1 0.760 66.9 44.8 -33.3 -52.0 -4.6 41.3 12.9 25 106 A I H 34 S+ 0 0 0 2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.819 110.9 52.2 -74.2 -36.3 -4.5 40.2 9.2 26 107 A R H X4 S+ 0 0 144 -3,-0.9 3,-1.1 353,-0.3 -2,-0.2 0.899 111.4 49.1 -61.8 -42.4 -7.7 41.9 8.2 27 108 A L H >< S+ 0 0 76 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.774 99.0 68.1 -65.9 -27.7 -6.3 45.1 9.7 28 109 A S T 3< S+ 0 0 1 -4,-1.0 3,-0.3 -5,-0.3 -1,-0.2 0.342 83.2 72.6 -82.1 8.5 -3.0 44.7 7.8 29 110 A A T < S+ 0 0 56 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.533 117.5 17.2 -94.2 -12.4 -4.7 45.3 4.5 30 111 A G S < S+ 0 0 73 -3,-1.4 -1,-0.3 -4,-0.2 2,-0.2 -0.551 126.1 38.8-156.9 81.2 -5.1 49.0 5.4 31 112 A G S S- 0 0 39 -3,-0.3 2,-1.1 -2,-0.1 29,-0.4 -0.717 89.4 -84.1 145.2 156.8 -2.7 49.7 8.2 32 113 A D + 0 0 89 -2,-0.2 2,-0.4 27,-0.1 56,-0.4 -0.746 54.7 162.7-101.5 93.0 0.7 48.9 9.5 33 114 A I - 0 0 11 -2,-1.1 26,-1.9 54,-0.1 54,-0.2 -0.876 39.3-104.1-111.4 140.9 0.5 45.6 11.4 34 115 A W E -E 58 0B 22 52,-2.7 2,-0.5 -2,-0.4 24,-0.3 -0.195 23.2-127.7 -54.7 144.2 3.4 43.3 12.3 35 116 A V E + 0 0 0 22,-2.2 20,-1.5 324,-0.1 22,-0.3 -0.887 51.3 153.8 -89.6 128.1 4.0 40.0 10.5 36 117 A T E -E 54 0B 2 -2,-0.5 2,-0.3 18,-0.2 18,-0.2 -0.865 27.7-176.9-147.2 176.3 4.2 37.4 13.3 37 118 A R E +E 53 0B 28 16,-1.8 16,-2.4 -2,-0.3 323,-0.1 -0.960 59.8 49.8-164.0-179.2 3.8 33.8 14.4 38 119 A E E S- 0 0 12 -2,-0.3 -1,-0.1 14,-0.2 15,-0.1 0.927 75.6-179.9 47.7 58.1 4.0 31.5 17.5 39 120 A P E + 0 0 1 0, 0.0 13,-0.3 0, 0.0 2,-0.3 -0.335 10.5 174.9 -85.6 170.7 1.8 33.8 19.5 40 121 A Y E -E 51 0B 1 11,-3.8 11,-3.9 107,-0.1 2,-0.4 -0.979 23.3-129.0-166.0 175.2 0.6 33.5 23.1 41 122 A V E +E 50 0B 0 -2,-0.3 107,-0.4 9,-0.3 2,-0.3 -1.000 26.3 160.6-137.7 127.8 -1.3 35.1 26.0 42 123 A S E -E 49 0B 0 7,-1.6 7,-3.2 -2,-0.4 2,-0.3 -0.920 20.4-150.5-138.8 160.4 -0.3 35.5 29.6 43 124 A b E -E 48 0B 4 -2,-0.3 60,-0.4 5,-0.3 5,-0.3 -0.974 8.7-136.2-136.3 149.4 -1.6 37.9 32.2 44 125 A D - 0 0 19 3,-2.4 64,-0.0 -2,-0.3 60,-0.0 -0.392 52.7 -82.7 -86.2 174.7 -0.4 39.7 35.2 45 126 A P S S+ 0 0 75 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.761 129.9 36.1 -46.4 -32.1 -2.6 39.9 38.4 46 127 A D S S- 0 0 145 1,-0.2 2,-0.3 0, 0.0 -3,-0.0 0.881 123.9 -8.3 -93.2 -43.7 -4.5 42.8 36.9 47 128 A K - 0 0 79 0, 0.0 -3,-2.4 0, 0.0 2,-0.3 -0.928 64.1 -96.0-159.2 168.5 -4.9 42.1 33.2 48 129 A b E -E 43 0B 21 -5,-0.3 34,-3.1 -2,-0.3 2,-0.3 -0.720 24.2-163.8-108.3 150.0 -3.9 40.1 30.1 49 130 A Y E -EF 42 81B 33 -7,-3.2 -7,-1.6 32,-0.3 2,-0.5 -0.904 13.7-137.4-127.7 149.5 -1.3 40.5 27.3 50 131 A Q E -EF 41 80B 0 30,-2.0 30,-1.8 -2,-0.3 2,-0.3 -0.940 22.3-171.8-111.7 127.9 -0.8 39.0 23.9 51 132 A F E +EF 40 79B 0 -11,-3.9 -11,-3.8 -2,-0.5 2,-0.3 -0.866 11.0 161.1-112.8 147.6 2.6 38.0 22.8 52 133 A A E - F 0 78B 0 26,-1.0 26,-3.6 -2,-0.3 2,-0.5 -0.955 41.2-105.9-150.6 166.8 4.0 36.8 19.5 53 134 A L E -EF 37 77B 0 -16,-2.4 -16,-1.8 -2,-0.3 24,-0.2 -0.856 40.1-146.2 -91.8 126.1 7.3 36.5 17.7 54 135 A G E -E 36 0B 0 22,-3.0 -18,-0.2 -2,-0.5 42,-0.1 -0.270 15.7-136.6 -86.8 171.8 7.8 39.2 15.1 55 136 A Q E - 0 0 12 -20,-1.5 20,-0.2 2,-0.5 19,-0.1 0.138 50.6-105.2-113.8 20.8 9.5 39.0 11.7 56 137 A G E S+ 0 0 39 1,-0.2 2,-0.3 -21,-0.2 19,-0.1 0.821 95.6 75.7 63.3 32.8 11.2 42.4 12.1 57 138 A T E S- 0 0 7 -22,-0.3 -22,-2.2 7,-0.1 -2,-0.5 -0.981 75.2-119.5-165.2 159.8 8.7 43.7 9.6 58 139 A T E -E 34 0B 14 -2,-0.3 -24,-0.3 -24,-0.3 3,-0.2 -0.407 36.4-109.4 -98.5-177.9 5.1 44.8 9.0 59 140 A L S S+ 0 0 1 -26,-1.9 2,-1.4 1,-0.3 5,-0.2 0.972 111.6 51.9 -84.2 -58.5 2.8 43.1 6.4 60 141 A N S S+ 0 0 102 -29,-0.4 2,-0.3 -32,-0.2 -1,-0.3 -0.688 96.7 97.3 -76.3 95.1 2.5 45.8 3.7 61 142 A N S > S- 0 0 54 -2,-1.4 3,-1.3 -3,-0.2 4,-0.2 -0.876 83.7-117.0 173.8 137.6 6.3 46.0 3.6 62 143 A V G > S+ 0 0 125 1,-0.3 3,-1.2 -2,-0.3 -5,-0.0 0.766 108.7 67.0 -71.7 -23.6 8.9 44.4 1.2 63 144 A H G 3 S+ 0 0 129 1,-0.2 -1,-0.3 -7,-0.1 -3,-0.1 0.331 79.7 80.7 -79.4 9.1 10.5 42.5 4.1 64 145 A S G X + 0 0 11 -3,-1.3 3,-1.5 -5,-0.2 294,-0.4 0.683 67.1 106.9 -86.1 -19.9 7.4 40.4 4.5 65 146 A N T < S+ 0 0 92 -3,-1.2 292,-0.2 1,-0.3 291,-0.0 -0.384 89.4 8.0 -57.6 129.0 8.5 38.2 1.6 66 147 A N T > S+ 0 0 73 290,-1.5 3,-1.2 1,-0.1 -1,-0.3 0.684 77.2 142.0 69.1 23.3 9.8 34.8 2.7 67 148 A T T < + 0 0 13 -3,-1.5 -1,-0.1 289,-0.3 290,-0.1 0.264 45.5 99.3 -77.6 15.2 8.7 35.2 6.4 68 149 A V T 3 + 0 0 49 288,-0.3 -1,-0.3 282,-0.0 2,-0.1 0.632 60.9 101.5 -66.8 -18.6 7.8 31.5 6.2 69 150 A R < - 0 0 146 -3,-1.2 3,-0.1 1,-0.1 289,-0.1 -0.398 65.7-149.4 -71.7 149.1 11.2 30.9 7.9 70 151 A D S S+ 0 0 79 1,-0.2 2,-0.5 -2,-0.1 -1,-0.1 0.768 77.5 42.9 -92.8 -31.9 11.3 30.2 11.7 71 152 A R + 0 0 79 43,-0.0 -1,-0.2 3,-0.0 46,-0.1 -0.931 60.9 144.3-127.7 109.1 14.6 31.7 12.8 72 153 A T > - 0 0 26 -2,-0.5 3,-1.1 -3,-0.1 43,-0.1 -0.910 55.0-118.1-125.0 162.1 16.0 35.0 11.7 73 154 A P T 3 S+ 0 0 92 0, 0.0 23,-0.1 0, 0.0 -17,-0.1 0.694 110.7 66.2 -66.9 -17.6 18.1 37.6 13.6 74 155 A Y T 3 S+ 0 0 162 -19,-0.1 2,-0.4 21,-0.1 -20,-0.0 0.356 75.1 109.4 -89.4 5.4 15.2 40.1 13.1 75 156 A R < + 0 0 1 -3,-1.1 21,-2.1 -20,-0.2 2,-0.3 -0.686 42.6 176.1 -89.1 134.5 12.6 38.3 15.2 76 157 A T E - G 0 95B 17 -2,-0.4 -22,-3.0 19,-0.3 2,-0.6 -0.954 37.7-105.4-132.7 150.8 11.5 39.8 18.5 77 158 A L E -FG 53 94B 0 17,-2.2 16,-2.7 -2,-0.3 17,-0.7 -0.699 40.2-154.1 -72.5 116.6 9.0 38.9 21.2 78 159 A L E -FG 52 92B 0 -26,-3.6 -26,-1.0 -2,-0.6 2,-0.4 -0.679 10.4-168.6 -90.3 147.5 6.2 41.4 20.8 79 160 A M E +FG 51 91B 24 12,-1.6 12,-0.9 -2,-0.3 2,-0.3 -0.929 16.7 151.1-147.9 117.1 4.0 42.4 23.8 80 161 A N E -F 50 0B 16 -30,-1.8 -30,-2.0 -2,-0.4 2,-0.2 -0.850 53.1 -88.8-128.3 164.4 0.7 44.3 23.8 81 162 A E E > -F 49 0B 97 -2,-0.3 3,-2.1 -32,-0.3 -32,-0.3 -0.544 65.9 -83.3 -68.2 146.7 -2.3 44.3 26.2 82 163 A L T 3 S+ 0 0 35 -34,-3.1 -34,-0.1 1,-0.2 -1,-0.1 -0.351 118.9 29.4 -59.2 124.4 -4.8 41.7 25.0 83 164 A G T 3 S+ 0 0 38 1,-0.4 -1,-0.2 -2,-0.1 -34,-0.1 -0.018 90.1 106.9 114.6 -28.5 -7.0 43.2 22.2 84 165 A V < - 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