==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-NOV-05 2F13 . COMPND 2 MOLECULE: SIALIDASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.M.G.CHAVAS,R.KATO,M.C.MANN,R.J.THOMSON,J.C.DYASON,M.VON . 351 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14412.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 222 63.2 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 . 143 40.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.9 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-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 29 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 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 . 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 4 0 2 2 4 3 3 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 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 3 A S 0 0 104 0, 0.0 305,-0.1 0, 0.0 306,-0.0 0.000 360.0 360.0 360.0 161.9 63.5 34.8 4.6 2 4 A L - 0 0 30 303,-1.7 2,-0.2 1,-0.1 349,-0.1 -0.214 360.0-120.2 -53.9 124.6 60.1 33.4 5.8 3 5 A P - 0 0 96 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.508 39.4-175.9 -70.4 131.1 57.3 35.9 6.2 4 6 A V - 0 0 37 -2,-0.2 342,-0.2 342,-0.1 3,-0.1 -0.724 39.4-113.4-124.0 172.1 56.1 36.0 9.9 5 7 A L S S+ 0 0 30 340,-1.7 2,-0.3 1,-0.3 341,-0.2 0.845 96.9 1.3 -74.6 -31.8 53.4 37.7 11.9 6 8 A Q E -A 345 0A 7 339,-1.6 339,-2.2 52,-0.1 2,-0.3 -0.988 48.2-178.5-161.0 146.3 55.9 39.7 13.9 7 9 A K E +A 344 0A 122 -2,-0.3 2,-0.4 337,-0.2 337,-0.2 -0.877 25.8 157.6-146.9 106.5 59.6 40.4 14.3 8 10 A E E -A 343 0A 69 335,-2.6 335,-3.6 -2,-0.3 2,-0.5 -0.996 42.1-124.3-139.6 137.7 60.7 42.8 17.1 9 11 A S E +A 342 0A 48 -2,-0.4 333,-0.2 333,-0.3 3,-0.1 -0.677 30.5 173.2 -77.1 121.3 63.8 43.4 19.1 10 12 A V E + 0 0 3 331,-2.4 2,-0.3 -2,-0.5 332,-0.2 0.549 66.7 29.7-106.6 -12.1 62.8 43.1 22.8 11 13 A F E +A 341 0A 3 330,-1.4 330,-2.5 7,-0.1 2,-0.3 -0.990 69.0 166.6-145.3 138.5 66.3 43.4 24.4 12 14 A Q E -A 340 0A 124 -2,-0.3 4,-0.3 328,-0.3 328,-0.2 -0.996 42.3 -83.7-154.1 154.5 69.3 45.3 23.1 13 15 A S + 0 0 58 326,-2.3 4,-0.2 -2,-0.3 2,-0.1 -0.313 67.9 120.5 -59.3 134.8 72.8 46.5 24.2 14 16 A G S S- 0 0 66 2,-2.5 -1,-0.1 -2,-0.0 3,-0.0 -0.293 88.2 -11.6-155.5-113.5 72.6 49.8 26.0 15 17 A A S S+ 0 0 98 -2,-0.1 2,-0.3 2,-0.0 -2,-0.1 0.811 141.4 22.7 -70.6 -27.4 73.8 50.4 29.6 16 18 A H S S- 0 0 66 -4,-0.3 -2,-2.5 2,-0.0 2,-0.3 -0.804 81.7-116.6-131.4 172.1 74.0 46.6 29.7 17 19 A A E -D 39 0B 34 22,-2.3 22,-3.0 23,-0.3 2,-0.4 -0.834 25.0-147.3-110.2 149.4 74.3 43.6 27.4 18 20 A Y E +D 38 0B 18 320,-0.4 2,-0.3 -2,-0.3 20,-0.2 -0.969 27.4 144.9-125.5 133.3 71.6 41.0 27.1 19 21 A R E +D 37 0B 41 18,-1.3 18,-3.1 -2,-0.4 322,-0.1 -0.940 40.0 53.3-151.8 171.2 72.0 37.2 26.3 20 22 A I E - 0 0 6 -2,-0.3 -1,-0.2 16,-0.2 127,-0.1 0.996 66.7-153.6 61.8 74.2 70.5 33.8 27.1 21 23 A P E - 0 0 1 0, 0.0 2,-0.3 0, 0.0 15,-0.2 -0.340 16.5-176.0 -77.2 157.4 66.7 34.1 26.3 22 24 A A E -D 35 0B 0 13,-1.5 13,-3.0 125,-0.1 2,-0.4 -0.953 8.7-159.5-151.6 131.1 63.9 32.1 27.8 23 25 A L E -D 34 0B 0 -2,-0.3 2,-0.4 11,-0.2 125,-0.2 -0.938 6.6-173.2-120.0 140.7 60.3 32.5 26.7 24 26 A L E -D 33 0B 6 9,-1.9 9,-2.8 -2,-0.4 2,-0.4 -0.980 9.8-154.0-137.2 125.3 57.2 31.5 28.6 25 27 A Y E -D 32 0B 37 -2,-0.4 7,-0.2 7,-0.2 59,-0.1 -0.786 3.6-155.6 -97.5 137.9 53.6 31.5 27.4 26 28 A L E >>> -D 31 0B 5 5,-3.1 3,-2.3 -2,-0.4 5,-1.2 -0.844 11.9-158.4-114.3 90.5 50.7 31.8 29.9 27 29 A P G >45S+ 0 0 56 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.815 85.2 41.2 -32.3 -70.0 47.7 30.2 28.1 28 30 A G G 345S+ 0 0 70 1,-0.2 -2,-0.0 2,-0.1 0, 0.0 0.396 114.3 55.9 -70.2 6.8 44.7 31.8 29.8 29 31 A Q G <45S- 0 0 82 -3,-2.3 -1,-0.2 2,-0.2 23,-0.1 0.445 94.9-134.4-115.3 -3.2 46.4 35.2 29.8 30 32 A Q T <<5S+ 0 0 128 -3,-1.6 22,-3.4 -4,-0.6 2,-0.3 0.867 70.4 123.5 50.4 34.8 47.0 35.5 26.1 31 33 A S E < -DE 26 51B 0 -5,-1.2 -5,-3.1 20,-0.2 2,-0.3 -0.913 51.5-154.3-132.4 156.6 50.4 36.6 27.4 32 34 A L E -DE 25 50B 0 18,-3.1 18,-3.0 -2,-0.3 2,-0.5 -0.927 8.2-148.3-126.4 150.4 54.2 35.9 27.2 33 35 A L E -DE 24 49B 1 -9,-2.8 -9,-1.9 -2,-0.3 2,-0.6 -0.983 12.0-161.2-120.4 121.3 57.1 36.4 29.6 34 36 A A E -DE 23 48B 0 14,-2.9 14,-1.8 -2,-0.5 2,-0.3 -0.920 11.6-173.4-106.7 118.1 60.5 37.1 28.0 35 37 A F E +DE 22 47B 0 -13,-3.0 -13,-1.5 -2,-0.6 2,-0.3 -0.761 9.6 161.5-109.0 156.0 63.5 36.5 30.3 36 38 A A E - E 0 46B 0 10,-1.6 10,-2.4 -2,-0.3 2,-0.4 -0.972 40.7 -98.3-163.2 163.3 67.2 37.3 29.6 37 39 A E E -DE 19 45B 1 -18,-3.1 -18,-1.3 -2,-0.3 2,-0.7 -0.746 28.6-146.0 -89.2 137.9 70.4 37.7 31.5 38 40 A Q E -DE 18 44B 18 6,-4.0 6,-2.0 -2,-0.4 5,-0.6 -0.928 22.5-167.8-106.2 111.5 71.5 41.4 32.1 39 41 A R E D 17 0B 80 -22,-3.0 -22,-2.3 -2,-0.7 6,-0.0 -0.755 360.0 360.0-103.3 147.9 75.3 41.5 31.9 40 42 A A 0 0 105 -2,-0.3 -23,-0.3 -24,-0.2 -1,-0.2 0.902 360.0 360.0 -71.9 360.0 77.5 44.4 33.0 41 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 42 49 A A 0 0 18 0, 0.0 35,-0.4 0, 0.0 -3,-0.2 0.000 360.0 360.0 360.0 114.8 75.5 37.2 34.2 43 50 A E - 0 0 93 -5,-0.6 34,-1.8 33,-0.2 2,-0.3 0.996 360.0 -10.3 -64.0 -67.4 74.7 39.9 36.8 44 51 A L E -E 38 0B 40 -6,-2.0 -6,-4.0 32,-0.2 2,-0.5 -0.802 60.9-115.7-132.5 173.0 70.9 39.7 36.9 45 52 A I E -E 37 0B 0 22,-0.3 22,-2.7 -8,-0.3 -8,-0.2 -0.952 31.2-165.7-112.4 124.8 67.9 38.3 35.2 46 53 A V E -EF 36 66B 0 -10,-2.4 -10,-1.6 -2,-0.5 2,-0.3 -0.660 0.9-157.2-106.5 166.1 65.4 40.8 33.6 47 54 A L E -EF 35 65B 3 18,-2.6 18,-2.5 -2,-0.2 2,-0.4 -0.996 11.3-166.5-146.6 147.8 61.9 40.3 32.3 48 55 A R E -E 34 0B 43 -14,-1.8 -14,-2.9 -2,-0.3 2,-0.4 -0.998 16.6-144.1-135.2 130.0 59.4 41.7 29.9 49 56 A R E -E 33 0B 18 14,-0.4 13,-3.3 -2,-0.4 2,-0.4 -0.750 17.5-167.7 -93.9 138.4 55.7 40.9 29.8 50 57 A G E -EG 32 61B 0 -18,-3.0 -18,-3.1 -2,-0.4 2,-0.5 -0.993 12.0-152.3-132.7 134.7 53.9 40.8 26.5 51 58 A D E -EG 31 60B 68 9,-2.1 9,-2.7 -2,-0.4 2,-0.6 -0.911 17.3-140.9-106.7 125.3 50.1 40.6 25.7 52 59 A Y E - G 0 59B 23 -22,-3.4 2,-0.7 -2,-0.5 7,-0.3 -0.744 13.5-169.9 -91.2 120.1 49.1 38.9 22.4 53 60 A D E > - G 0 58B 76 5,-3.0 5,-2.1 -2,-0.6 4,-0.4 -0.923 3.8-167.0-109.2 109.1 46.3 40.4 20.4 54 61 A A T > 5S+ 0 0 40 -2,-0.7 3,-2.1 1,-0.2 -1,-0.2 0.937 83.0 60.4 -61.0 -50.7 45.3 38.1 17.6 55 62 A P T 3 5S+ 0 0 105 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.831 115.8 35.5 -47.1 -37.3 43.2 40.6 15.6 56 63 A T T 3 5S- 0 0 80 -3,-0.3 -2,-0.2 2,-0.2 3,-0.1 0.417 104.9-131.8 -96.7 -0.8 46.3 42.7 15.1 57 64 A H T < 5 + 0 0 82 -3,-2.1 2,-0.3 -4,-0.4 -3,-0.2 0.866 68.4 115.3 52.4 39.6 48.6 39.7 14.9 58 65 A Q E < -G 53 0B 78 -5,-2.1 -5,-3.0 -52,-0.1 2,-0.5 -0.991 61.3-142.9-144.3 148.8 50.9 41.4 17.4 59 66 A V E -G 52 0B 3 -2,-0.3 2,-0.7 -7,-0.3 -7,-0.3 -0.919 21.4-147.6-105.6 130.9 52.3 41.0 20.9 60 67 A Q E -G 51 0B 158 -9,-2.7 -9,-2.1 -2,-0.5 2,-0.4 -0.898 15.0-147.4-102.5 115.7 52.6 44.3 22.8 61 68 A W E -G 50 0B 22 -2,-0.7 -11,-0.2 -11,-0.2 3,-0.1 -0.675 6.1-145.6 -90.1 136.2 55.6 44.3 25.1 62 69 A Q - 0 0 79 -13,-3.3 -1,-0.1 -2,-0.4 0, 0.0 -0.277 42.1 -58.9 -88.3 176.3 55.6 46.2 28.4 63 70 A A - 0 0 82 1,-0.1 -14,-0.4 -15,-0.1 -1,-0.2 -0.211 58.4-103.7 -60.5 144.2 58.6 47.9 30.1 64 71 A Q - 0 0 76 -16,-0.1 2,-0.3 -3,-0.1 -16,-0.2 -0.412 42.6-176.4 -67.8 138.4 61.7 45.8 31.1 65 72 A E E -F 47 0B 91 -18,-2.5 -18,-2.6 -2,-0.1 2,-0.2 -1.000 25.7-117.6-143.3 141.3 62.0 45.0 34.8 66 73 A V E -F 46 0B 63 -2,-0.3 2,-1.6 -20,-0.2 -20,-0.2 -0.516 23.0-128.2 -74.7 138.1 64.6 43.2 36.9 67 74 A V > - 0 0 0 -22,-2.7 3,-1.2 -2,-0.2 -22,-0.3 -0.697 31.8-172.8 -86.3 85.9 63.5 40.0 38.7 68 75 A A T 3 S+ 0 0 58 -2,-1.6 -1,-0.2 1,-0.3 52,-0.0 0.841 75.8 50.1 -49.1 -47.3 64.8 41.3 42.1 69 76 A Q T 3 S+ 0 0 80 1,-0.2 2,-2.5 -3,-0.1 -1,-0.3 0.684 85.7 91.2 -69.8 -20.3 64.3 38.1 44.0 70 77 A A S < S+ 0 0 1 -3,-1.2 2,-0.3 -25,-0.2 -25,-0.2 -0.334 77.4 76.1 -77.3 61.5 66.1 36.0 41.5 71 78 A R - 0 0 94 -2,-2.5 2,-0.4 -27,-0.1 5,-0.1 -0.986 66.0-136.0-164.8 155.9 69.5 36.3 43.1 72 79 A L > - 0 0 33 -2,-0.3 3,-2.0 3,-0.1 26,-0.1 -0.971 48.5 -93.2-116.9 132.9 71.7 35.2 46.0 73 80 A D T 3 S+ 0 0 138 -2,-0.4 3,-0.1 1,-0.3 27,-0.1 -0.159 111.6 9.1 -47.3 126.0 73.7 37.9 47.9 74 81 A G T 3 S+ 0 0 48 1,-0.3 26,-2.9 25,-0.1 2,-0.3 0.686 111.3 105.1 75.4 18.8 77.1 38.2 46.4 75 82 A H E < -H 99 0C 48 -3,-2.0 2,-0.4 24,-0.3 -1,-0.3 -0.908 67.8-123.9-130.4 157.9 76.3 35.9 43.4 76 83 A R E -H 98 0C 58 22,-3.5 22,-2.2 -2,-0.3 2,-0.4 -0.816 26.2-141.0 -97.3 139.7 75.6 36.4 39.7 77 84 A S E +H 97 0C 0 -34,-1.8 2,-0.3 -35,-0.4 20,-0.2 -0.830 32.1 156.0-101.7 140.4 72.3 34.9 38.5 78 85 A M E +H 96 0C 29 18,-2.4 18,-3.2 -2,-0.4 -33,-0.1 -0.964 36.6 46.2-155.6 170.8 72.2 33.2 35.1 79 86 A N E - 0 0 16 -2,-0.3 2,-0.2 16,-0.2 -1,-0.2 0.973 64.0-151.4 58.1 62.8 70.4 30.6 32.9 80 87 A P E - 0 0 0 0, 0.0 67,-1.9 0, 0.0 15,-0.2 -0.492 16.2-177.3 -66.1 130.2 66.7 31.7 33.5 81 88 A C E -H 94 0C 0 13,-2.5 13,-2.7 -2,-0.2 67,-0.2 -0.859 8.4-165.8-132.4 96.4 64.5 28.6 33.0 82 89 A P E -H 93 0C 0 0, 0.0 67,-2.6 0, 0.0 2,-0.3 -0.452 8.5-177.6 -86.1 156.7 60.8 29.3 33.4 83 90 A L E -H 92 0C 7 9,-2.1 9,-3.0 65,-0.2 2,-0.6 -0.981 17.3-147.4-153.1 138.0 57.8 27.0 33.9 84 91 A Y E -H 91 0C 72 -2,-0.3 2,-0.8 7,-0.2 7,-0.2 -0.936 13.9-147.7-110.5 116.4 54.1 27.4 34.1 85 92 A D E >> -H 90 0C 0 5,-2.7 4,-2.4 -2,-0.6 5,-0.5 -0.743 9.2-169.9 -85.7 112.4 52.2 24.9 36.4 86 93 A A T 45S+ 0 0 51 -2,-0.8 -1,-0.2 1,-0.2 71,-0.0 0.686 84.1 60.8 -73.5 -18.2 48.8 24.3 34.9 87 94 A Q T 45S+ 0 0 111 70,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.902 123.4 13.2 -74.9 -45.0 47.8 22.5 38.1 88 95 A T T 45S- 0 0 76 2,-0.2 -2,-0.2 -3,-0.0 3,-0.1 0.649 94.1-120.7-107.1 -22.1 48.3 25.3 40.5 89 96 A G T <5 + 0 0 30 -4,-2.4 2,-0.4 1,-0.3 28,-0.4 0.727 65.5 145.7 83.1 21.7 48.6 28.4 38.3 90 97 A T E < -H 85 0C 28 -5,-0.5 -5,-2.7 26,-0.1 2,-0.4 -0.777 43.6-141.2 -97.8 138.7 52.1 28.9 39.8 91 98 A L E -HI 84 114C 4 23,-2.8 23,-1.9 -2,-0.4 2,-0.4 -0.827 16.0-161.4 -99.9 134.4 55.0 30.3 37.8 92 99 A F E -HI 83 113C 7 -9,-3.0 -9,-2.1 -2,-0.4 2,-0.4 -0.923 9.8-171.8-117.1 141.7 58.5 28.9 38.4 93 100 A L E -HI 82 112C 0 19,-2.2 19,-1.7 -2,-0.4 2,-0.3 -0.907 8.3-171.0-134.3 104.7 61.8 30.5 37.5 94 101 A F E +HI 81 111C 2 -13,-2.7 -13,-2.5 -2,-0.4 2,-0.3 -0.695 16.8 158.0 -93.2 148.8 64.9 28.3 38.0 95 102 A F E - 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