==== 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 22-JAN-08 3C17 . COMPND 2 MOLECULE: L-ASPARAGINASE PRECURSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.MICHALSKA,A.HERNANDEZ-SANTOYO,M.JASKOLSKI . 611 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20824.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 429 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 128 20.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 8 1.3 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-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 . 13 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 28.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.9 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 2 0 2 0 0 0 6 4 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 0 0 PARALLEL BRIDGES PER LADDER . 2 6 4 0 4 4 2 2 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 . 2 0 0 0 2 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 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 2 A G 0 0 102 0, 0.0 293,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 39.0 -46.6 34.9 59.0 2 3 A K + 0 0 116 1,-0.2 175,-0.1 292,-0.1 177,-0.0 0.330 360.0 158.6 61.0 9.4 -46.3 34.2 55.3 3 4 A A + 0 0 2 291,-0.1 291,-2.7 290,-0.1 2,-0.3 -0.375 18.3 169.6 -62.0 141.1 -49.6 35.6 53.8 4 5 A V E -AB 177 293A 0 173,-2.0 173,-2.6 289,-0.3 2,-0.4 -0.992 23.3-158.6-155.5 149.8 -49.1 36.2 50.1 5 6 A I E -AB 176 292A 0 287,-2.0 287,-2.3 -2,-0.3 2,-0.3 -0.979 5.2-175.0-130.3 145.4 -51.0 37.1 47.0 6 7 A A E -AB 175 291A 0 169,-2.4 169,-2.7 -2,-0.4 2,-0.3 -0.989 8.2-175.5-132.4 147.9 -50.4 36.7 43.3 7 8 A I E -AB 174 290A 0 283,-2.9 283,-1.9 -2,-0.3 2,-0.3 -0.916 5.6-166.0-136.1 159.0 -52.5 38.0 40.4 8 9 A H E -AB 173 289A 0 165,-2.5 165,-2.3 -2,-0.3 281,-0.3 -0.977 15.6-169.3-141.2 160.3 -52.5 37.8 36.6 9 10 A G E - 0 0 0 279,-2.0 57,-0.4 1,-0.5 163,-0.1 0.087 65.2 -60.5-135.1 21.4 -54.2 39.5 33.7 10 11 A G E - B 0 288A 0 278,-0.5 278,-2.7 160,-0.2 -1,-0.5 -0.362 46.8-111.7 116.1 165.2 -53.4 37.3 30.8 11 12 A A E + B 0 287A 0 158,-2.0 2,-0.3 276,-0.3 276,-0.2 -0.827 41.6 120.9-131.1 163.1 -50.4 36.0 28.8 12 13 A G E - B 0 286A 0 274,-2.1 274,-2.4 -2,-0.3 153,-0.2 -0.986 55.0 -41.1 166.5-174.9 -49.0 36.5 25.3 13 14 A A E -I 164 0B 22 151,-2.3 151,-3.0 -2,-0.3 2,-0.3 -0.527 64.4-101.1 -81.2 148.8 -46.3 37.6 22.9 14 15 A I E +I 163 0B 39 149,-0.2 149,-0.2 -2,-0.2 3,-0.1 -0.555 39.4 171.6 -79.3 127.1 -44.2 40.7 23.7 15 16 A S > + 0 0 33 147,-3.3 3,-1.5 -2,-0.3 4,-0.4 -0.099 32.8 129.6-121.9 32.2 -45.2 43.8 21.8 16 17 A R G > + 0 0 138 1,-0.3 3,-2.0 2,-0.2 -1,-0.1 0.847 64.1 66.6 -54.5 -40.2 -43.0 46.3 23.7 17 18 A A G 3 S+ 0 0 92 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.716 104.3 44.5 -58.3 -23.3 -41.5 47.8 20.5 18 19 A Q G < S+ 0 0 154 -3,-1.5 -1,-0.3 143,-0.1 2,-0.3 0.445 103.3 86.7 -96.2 -3.8 -45.0 49.2 19.6 19 20 A M < - 0 0 27 -3,-2.0 2,-0.3 -4,-0.4 3,-0.0 -0.689 66.1-141.9 -97.3 149.2 -45.6 50.5 23.2 20 21 A S > - 0 0 52 -2,-0.3 4,-1.8 1,-0.1 5,-0.1 -0.702 31.6-113.6 -90.5 161.2 -44.7 53.8 24.8 21 22 A L H > S+ 0 0 109 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.907 117.9 58.8 -60.1 -40.2 -43.6 53.7 28.5 22 23 A Q H > S+ 0 0 110 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.904 105.5 49.1 -58.5 -39.7 -46.8 55.7 29.4 23 24 A Q H > S+ 0 0 81 1,-0.2 4,-0.9 2,-0.2 3,-0.4 0.925 111.9 48.1 -62.4 -47.3 -48.9 52.9 27.9 24 25 A E H >X S+ 0 0 10 -4,-1.8 4,-2.3 1,-0.2 3,-0.7 0.902 105.6 59.6 -58.7 -42.3 -47.0 50.2 29.8 25 26 A L H 3X S+ 0 0 50 -4,-2.9 4,-3.0 1,-0.3 -1,-0.2 0.778 96.2 60.9 -61.0 -31.4 -47.4 52.2 33.0 26 27 A R H 3X S+ 0 0 96 -4,-1.2 4,-1.8 -3,-0.4 -1,-0.3 0.903 109.4 42.8 -60.3 -41.3 -51.2 52.1 32.7 27 28 A Y H S+ 0 0 33 -4,-2.4 5,-2.5 1,-0.2 -2,-0.2 0.931 112.2 49.4 -58.4 -45.5 -56.5 43.0 53.0 42 43 A L H ><5S+ 0 0 0 -4,-2.3 3,-2.2 1,-0.2 137,-0.3 0.935 108.8 50.0 -60.0 -47.4 -54.3 40.1 53.9 43 44 A E H 3<5S+ 0 0 99 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.800 106.9 57.6 -65.0 -28.6 -52.2 42.0 56.5 44 45 A A T 3<5S- 0 0 74 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.279 125.5-102.7 -82.4 8.5 -55.5 43.1 58.1 45 46 A G T < 5 + 0 0 41 -3,-2.2 -3,-0.2 1,-0.2 -2,-0.1 0.623 66.7 155.4 83.4 13.9 -56.5 39.5 58.6 46 47 A E < - 0 0 85 -5,-2.5 133,-0.4 -6,-0.2 -1,-0.2 -0.355 47.7 -98.4 -72.4 156.9 -59.0 39.2 55.6 47 48 A S > - 0 0 39 1,-0.1 4,-2.4 131,-0.1 5,-0.1 -0.413 19.0-121.8 -80.3 151.8 -59.6 35.7 54.2 48 49 A A H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.855 114.6 54.4 -52.7 -40.5 -57.9 34.3 51.1 49 50 A L H > S+ 0 0 12 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.955 110.3 43.6 -63.4 -49.4 -61.3 33.8 49.6 50 51 A D H > S+ 0 0 60 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.844 114.5 52.9 -60.0 -36.2 -62.3 37.4 50.1 51 52 A V H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.936 111.7 41.9 -70.2 -47.6 -58.9 38.5 48.8 52 53 A V H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 5,-0.2 0.835 114.7 53.6 -69.7 -33.2 -59.0 36.5 45.6 53 54 A T H X S+ 0 0 7 -4,-2.2 4,-2.3 -5,-0.3 -2,-0.2 0.947 112.7 42.0 -63.4 -47.8 -62.6 37.5 45.0 54 55 A E H X S+ 0 0 54 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.892 113.8 52.1 -66.5 -40.6 -61.9 41.2 45.4 55 56 A A H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.956 113.1 44.0 -63.4 -48.0 -58.7 41.1 43.4 56 57 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.882 111.2 55.3 -65.4 -38.0 -60.6 39.3 40.5 57 58 A R H X S+ 0 0 64 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.940 109.9 46.3 -54.8 -46.6 -63.5 41.8 40.9 58 59 A L H X S+ 0 0 40 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.875 111.5 51.6 -66.4 -35.7 -61.0 44.7 40.5 59 60 A L H < S+ 0 0 0 -4,-2.2 6,-0.4 2,-0.2 -1,-0.2 0.835 107.8 52.2 -70.6 -35.3 -59.4 42.9 37.5 60 61 A E H < S+ 0 0 0 -4,-2.4 9,-0.5 1,-0.2 7,-0.2 0.948 109.6 50.5 -58.9 -48.8 -62.9 42.5 35.9 61 62 A E H < S+ 0 0 50 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.798 90.7 89.1 -61.2 -29.6 -63.4 46.2 36.4 62 63 A C S >< S- 0 0 18 -4,-1.4 3,-1.3 1,-0.2 5,-0.2 -0.613 70.7-150.8 -76.8 120.0 -60.1 47.1 34.7 63 64 A P T 3 S+ 0 0 67 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.616 87.1 72.7 -68.6 -10.1 -60.8 47.5 31.0 64 65 A L T 3 S+ 0 0 42 -38,-0.1 2,-0.3 2,-0.1 6,-0.1 0.748 90.5 66.0 -73.3 -21.7 -57.3 46.5 30.1 65 66 A F S < S- 0 0 0 -3,-1.3 2,-2.1 -6,-0.4 -55,-0.1 -0.799 89.4-111.3-114.6 142.3 -57.8 42.8 31.0 66 67 A N S S+ 0 0 0 -57,-0.4 124,-1.2 -2,-0.3 125,-0.4 -0.440 85.7 82.7 -74.0 76.7 -60.1 40.2 29.3 67 68 A A S S- 0 0 0 -2,-2.1 -2,-0.2 2,-0.4 123,-0.1 -0.861 98.8 -24.0-171.4 142.5 -62.7 39.7 32.1 68 69 A G S > S+ 0 0 0 -2,-0.3 3,-2.1 121,-0.2 2,-0.2 -0.200 130.0 27.5 47.8-131.1 -65.8 41.8 32.8 69 70 A I T 3 S+ 0 0 23 -9,-0.5 -2,-0.4 1,-0.3 -4,-0.3 -0.439 131.7 31.3 -58.1 122.8 -65.3 45.3 31.5 70 71 A G T 3 S+ 0 0 0 73,-2.4 -1,-0.3 1,-0.3 74,-0.1 0.484 86.2 160.1 97.0 9.5 -62.9 44.8 28.6 71 72 A A < - 0 0 0 -3,-2.1 74,-0.3 72,-0.3 -1,-0.3 -0.333 43.3-109.7 -60.6 142.0 -64.1 41.3 27.7 72 73 A V - 0 0 1 8,-0.1 2,-0.3 1,-0.1 8,-0.3 -0.201 36.1-106.4 -60.6 162.3 -63.3 40.1 24.2 73 74 A F - 0 0 11 75,-0.4 121,-2.3 6,-0.1 122,-0.6 -0.765 22.9-132.1 -96.3 143.8 -66.1 39.7 21.6 74 75 A T B > -j 195 0C 1 4,-2.7 3,-2.0 -2,-0.3 122,-0.2 -0.244 39.7 -93.0 -75.4 174.0 -67.7 36.5 20.4 75 76 A R T 3 S+ 0 0 120 120,-3.1 121,-0.1 1,-0.3 -1,-0.1 0.735 129.4 55.8 -60.6 -23.1 -68.2 35.8 16.7 76 77 A D T 3 S- 0 0 113 119,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.207 121.1-109.3 -94.9 11.0 -71.8 37.2 17.1 77 78 A E S < S+ 0 0 82 -3,-2.0 2,-0.2 1,-0.2 -2,-0.1 0.831 83.7 115.1 61.8 39.7 -70.3 40.5 18.5 78 79 A T - 0 0 46 2,-0.0 -4,-2.7 66,-0.0 2,-0.4 -0.595 65.5-113.6-122.7 178.2 -71.6 39.7 21.9 79 80 A H - 0 0 2 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.1 -0.992 23.5-179.1-121.5 133.2 -69.9 39.0 25.3 80 81 A E - 0 0 30 110,-0.5 2,-0.3 -2,-0.4 20,-0.2 -0.989 17.4-163.0-129.1 117.9 -70.1 35.7 27.1 81 82 A L E -C 99 0A 0 18,-2.7 18,-2.3 -2,-0.4 17,-0.5 -0.771 8.7-170.4-109.6 146.5 -68.2 35.7 30.4 82 83 A D E + D 0 189A 1 107,-2.5 107,-3.0 -2,-0.3 2,-0.3 -0.981 7.9 170.4-133.5 151.5 -67.0 32.9 32.7 83 84 A A E -CD 96 188A 0 13,-2.5 13,-2.3 -2,-0.3 2,-0.3 -0.996 10.5-168.1-156.5 156.1 -65.6 32.7 36.2 84 85 A C E -CD 95 187A 0 103,-2.7 103,-2.2 -2,-0.3 2,-0.3 -0.985 1.1-173.8-142.4 149.2 -64.6 30.4 39.0 85 86 A V E -CD 94 186A 0 9,-2.4 9,-2.2 -2,-0.3 2,-0.4 -0.990 5.3-168.4-141.9 146.1 -63.7 30.6 42.6 86 87 A M E -CD 93 185A 0 99,-2.7 99,-1.8 -2,-0.3 2,-0.7 -0.996 14.5-150.3-139.9 134.6 -62.4 27.9 45.1 87 88 A D E >> - D 0 184A 24 5,-2.6 4,-2.4 -2,-0.4 3,-0.8 -0.908 7.0-162.0-104.0 109.9 -61.9 27.9 48.9 88 89 A G T 34 S+ 0 0 3 95,-2.4 126,-2.7 -2,-0.7 127,-0.3 0.570 86.3 63.4 -72.2 -9.4 -59.1 25.5 49.7 89 90 A N T 34 S+ 0 0 91 94,-0.3 -1,-0.2 124,-0.2 95,-0.1 0.783 123.5 13.7 -82.7 -35.0 -60.3 25.3 53.3 90 91 A T T <4 S- 0 0 56 -3,-0.8 -2,-0.2 2,-0.2 3,-0.1 0.537 95.6-128.0-114.5 -13.6 -63.7 23.7 52.5 91 92 A L < + 0 0 31 -4,-2.4 -3,-0.2 1,-0.3 2,-0.1 0.543 59.2 147.1 65.2 13.8 -62.9 22.7 49.0 92 93 A K - 0 0 78 -5,-0.4 -5,-2.6 -6,-0.0 2,-0.3 -0.408 25.4-173.3 -72.1 154.5 -66.1 24.4 47.9 93 94 A A E -C 86 0A 2 -7,-0.2 2,-0.3 25,-0.1 -7,-0.2 -0.974 14.2-161.4-146.6 152.9 -66.1 26.0 44.6 94 95 A G E +C 85 0A 0 -9,-2.2 -9,-2.4 -2,-0.3 2,-0.3 -0.993 16.2 171.5-135.2 145.2 -68.5 28.2 42.6 95 96 A A E -Ce 84 120A 1 24,-1.4 26,-2.4 -2,-0.3 2,-0.4 -0.997 15.7-168.5-156.1 144.6 -68.5 28.9 38.8 96 97 A V E -Ce 83 121A 1 -13,-2.3 -13,-2.5 -2,-0.3 2,-0.4 -0.974 9.2-175.2-129.8 146.2 -70.6 30.5 36.1 97 98 A A E + e 0 122A 0 24,-1.4 26,-2.5 -2,-0.4 -15,-0.2 -0.998 62.9 20.2-140.3 143.5 -70.1 30.2 32.3 98 99 A G E S+ 0 0 13 -17,-0.5 2,-0.4 -2,-0.4 -16,-0.2 0.772 76.9 152.3 79.3 29.1 -71.8 31.8 29.5 99 100 A V E +C 81 0A 0 -18,-2.3 -18,-2.7 1,-0.1 -1,-0.2 -0.791 17.8 165.5 -98.3 138.3 -73.2 34.8 31.3 100 101 A S S S+ 0 0 22 -2,-0.4 -1,-0.1 -20,-0.2 -21,-0.1 0.443 70.3 55.6-119.3 -8.1 -73.9 38.2 29.6 101 102 A H S S+ 0 0 39 38,-0.1 37,-2.1 39,-0.1 2,-0.4 0.121 84.7 86.3-122.6 19.4 -76.0 40.2 32.0 102 103 A L - 0 0 0 35,-0.2 35,-0.1 1,-0.1 -34,-0.1 -0.992 62.8-149.8-121.8 126.0 -73.9 40.2 35.2 103 104 A R S S+ 0 0 96 33,-0.4 -34,-0.2 -2,-0.4 -1,-0.1 0.872 89.6 31.5 -61.7 -42.0 -71.3 42.9 35.7 104 105 A N >> - 0 0 19 1,-0.1 4,-1.4 -36,-0.1 3,-1.3 -0.816 62.7-174.5-125.4 89.1 -68.9 40.8 37.8 105 106 A P H 3> S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.822 85.0 60.9 -48.9 -37.7 -68.9 37.1 37.0 106 107 A V H 3> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.828 103.6 50.3 -65.1 -28.8 -66.6 36.3 39.9 107 108 A L H <> S+ 0 0 55 -3,-1.3 4,-1.3 2,-0.2 -1,-0.2 0.843 111.7 48.3 -76.8 -32.2 -69.2 37.7 42.4 108 109 A A H X S+ 0 0 2 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.902 109.8 51.7 -67.1 -43.7 -71.8 35.5 40.7 109 110 A A H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.935 110.4 49.9 -58.3 -44.5 -69.4 32.5 40.9 110 111 A R H X S+ 0 0 31 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.842 107.7 52.9 -62.0 -35.0 -69.1 33.3 44.6 111 112 A L H X S+ 0 0 32 -4,-1.3 4,-3.1 2,-0.2 -2,-0.2 0.913 106.2 53.1 -68.2 -43.5 -72.9 33.5 45.0 112 113 A V H X S+ 0 0 1 -4,-2.6 4,-0.7 1,-0.2 6,-0.4 0.942 113.5 46.0 -53.6 -45.1 -73.1 30.0 43.4 113 114 A M H < S+ 0 0 2 -4,-2.3 -2,-0.2 -5,-0.2 3,-0.2 0.960 126.2 24.2 -60.6 -54.7 -70.6 28.8 46.1 114 115 A E H < S+ 0 0 88 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.726 127.2 41.9 -92.2 -25.1 -72.1 30.5 49.2 115 116 A Q H < S+ 0 0 112 -4,-3.1 -1,-0.2 -5,-0.3 -3,-0.2 0.227 112.3 43.6-116.1 15.7 -75.8 30.9 48.3 116 117 A S S < S- 0 0 14 -4,-0.7 -1,-0.0 2,-0.2 0, 0.0 -0.980 76.2-120.8-148.0 159.3 -76.6 27.6 46.5 117 118 A P S S+ 0 0 105 0, 0.0 2,-0.2 0, 0.0 418,-0.1 0.329 87.6 93.2 -76.7 8.9 -75.9 23.9 47.1 118 119 A H - 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