==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ENDONUCLEASE 18-AUG-99 1QL0 . COMPND 2 MOLECULE: NUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SERATIA MARCESCENS; . AUTHOR M.PERBANDT,A.M.MIKHAILOV,C.H.BETZEL . 482 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18707.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 288 59.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 17.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 2 0.4 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 . 29 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 4 2 0 0 4 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 5 2 0 2 4 0 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 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 5 A S 0 0 176 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -19.7 20.2 3.2 51.5 2 6 A I - 0 0 56 18,-0.0 2,-0.7 2,-0.0 19,-0.0 -0.819 360.0-160.4 -89.3 127.7 18.9 5.6 54.1 3 7 A D + 0 0 88 -2,-0.6 37,-0.0 1,-0.1 17,-0.0 -0.891 22.4 164.2-113.6 101.7 16.7 8.2 52.6 4 8 A N S S+ 0 0 8 -2,-0.7 136,-0.2 1,-0.1 21,-0.1 0.378 76.9 46.1 -92.3 4.4 16.3 11.3 54.9 5 9 A a S S- 0 0 6 34,-0.1 2,-2.2 134,-0.1 -1,-0.1 0.655 72.1-164.2-121.1 -30.2 14.9 13.5 52.1 6 10 A A S S+ 0 0 34 1,-0.2 3,-0.1 169,-0.1 -1,-0.0 -0.203 87.0 44.8 71.0 -45.2 12.2 11.6 50.2 7 11 A V S S- 0 0 18 -2,-2.2 210,-2.2 1,-0.2 211,-0.4 -0.065 131.5 -62.8-120.8 26.9 12.2 14.0 47.2 8 12 A G - 0 0 29 208,-0.2 208,-0.8 209,-0.2 207,-0.4 0.519 54.5-101.1 97.6 123.1 15.9 14.4 46.7 9 13 A a - 0 0 44 206,-0.2 207,-0.2 1,-0.1 204,-0.0 -0.285 57.5 -77.7 -67.6 158.8 18.4 15.9 49.0 10 14 A P - 0 0 10 0, 0.0 3,-0.3 0, 0.0 2,-0.2 -0.219 42.1-148.5 -61.7 146.8 19.5 19.4 48.3 11 15 A T B +A 213 0A 69 202,-2.2 202,-2.1 1,-0.1 5,-0.0 -0.675 69.8 56.5-100.7 163.9 22.0 20.3 45.6 12 16 A G + 0 0 54 1,-0.3 -1,-0.1 -2,-0.2 4,-0.1 0.397 65.4 144.2 100.4 -3.4 24.4 23.1 45.6 13 17 A G - 0 0 7 -3,-0.3 -1,-0.3 2,-0.2 15,-0.1 -0.288 60.6-116.7 -67.5 155.5 26.3 22.3 48.9 14 18 A S S S+ 0 0 64 13,-0.2 2,-0.4 2,-0.1 -1,-0.1 0.758 98.7 67.5 -66.0 -26.5 30.0 23.1 49.0 15 19 A S - 0 0 36 13,-0.3 -2,-0.2 1,-0.1 -3,-0.1 -0.830 69.5-152.1 -98.4 136.1 30.8 19.4 49.5 16 20 A K S S+ 0 0 171 -2,-0.4 2,-0.4 -4,-0.1 -1,-0.1 0.710 85.2 54.0 -76.2 -19.0 30.2 16.9 46.7 17 21 A V S S- 0 0 118 11,-0.1 11,-0.4 -3,-0.0 2,-0.3 -0.914 73.2-156.0-115.6 139.7 29.7 14.1 49.2 18 22 A S - 0 0 37 -2,-0.4 2,-0.5 9,-0.1 9,-0.2 -0.842 21.9-114.6-111.8 155.0 27.2 14.2 52.1 19 23 A I E -B 26 0B 35 7,-2.9 7,-2.6 -2,-0.3 2,-0.6 -0.799 29.5-156.6 -87.1 124.7 27.3 12.2 55.3 20 24 A V E +B 25 0B 77 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.944 23.4 156.2-112.2 118.0 24.4 9.8 55.6 21 25 A R - 0 0 27 3,-2.5 -17,-0.0 -2,-0.6 -2,-0.0 -0.815 54.8-111.3-124.9 170.1 23.3 8.6 59.0 22 26 A H S S+ 0 0 94 -2,-0.3 19,-0.3 1,-0.2 3,-0.1 0.900 120.3 51.7 -69.1 -35.7 20.1 7.2 60.5 23 27 A A S S- 0 0 0 1,-0.2 18,-0.3 74,-0.1 2,-0.3 0.856 128.0 -38.8 -68.3 -35.3 19.8 10.5 62.4 24 28 A Y - 0 0 0 16,-0.1 -3,-2.5 63,-0.0 2,-0.4 -0.966 48.4-109.9-174.4 167.7 20.2 12.8 59.4 25 29 A T E -BC 20 39B 6 14,-2.5 14,-3.0 -2,-0.3 2,-0.4 -0.980 41.0-171.5-114.3 134.1 22.0 13.4 56.1 26 30 A L E -BC 19 38B 0 -7,-2.6 -7,-2.9 -2,-0.4 2,-0.6 -0.976 22.6-152.9-133.7 144.0 24.4 16.3 56.3 27 31 A N E - C 0 37B 5 10,-2.3 9,-2.5 -2,-0.4 10,-0.9 -0.953 25.7-149.3-115.8 111.4 26.5 18.3 53.8 28 32 A N E - C 0 35B 8 -2,-0.6 2,-0.5 -11,-0.4 -13,-0.3 -0.426 7.7-147.4 -82.2 156.4 29.6 19.8 55.5 29 33 A N > - 0 0 19 5,-0.8 4,-2.2 36,-0.2 5,-0.2 -0.962 4.2-166.1-121.5 110.7 31.5 23.0 54.6 30 34 A S T 4 S+ 0 0 51 -2,-0.5 -1,-0.1 2,-0.2 5,-0.1 0.667 88.2 50.4 -72.2 -14.8 35.2 22.8 55.3 31 35 A T T 4 S+ 0 0 98 3,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.920 119.3 31.2 -84.8 -54.6 35.6 26.6 55.0 32 36 A T T 4 S- 0 0 11 2,-0.2 129,-2.1 128,-0.2 -2,-0.2 0.796 98.7-135.1 -72.1 -26.7 32.8 27.8 57.3 33 37 A K S < S+ 0 0 16 -4,-2.2 34,-0.6 1,-0.3 2,-0.3 0.390 73.1 93.0 80.4 7.2 33.3 24.7 59.6 34 38 A F S S- 0 0 1 -5,-0.2 -5,-0.8 32,-0.1 -1,-0.3 -0.822 85.9 -88.0-124.4 161.6 29.5 24.2 59.8 35 39 A A E -C 28 0B 0 70,-0.6 -7,-0.3 -2,-0.3 3,-0.1 -0.518 21.2-150.1 -71.6 135.1 27.0 22.2 57.8 36 40 A N E S- 0 0 18 -9,-2.5 2,-0.3 1,-0.3 -1,-0.1 0.804 82.4 -7.8 -66.3 -36.9 25.5 23.8 54.7 37 41 A W E -C 27 0B 3 -10,-0.9 -10,-2.3 106,-0.2 2,-0.4 -0.964 57.8-157.4-160.2 152.5 22.3 21.8 55.3 38 42 A V E -CD 26 142B 0 104,-2.4 104,-2.6 -2,-0.3 2,-0.4 -0.991 13.3-164.0-136.5 123.2 21.0 19.0 57.5 39 43 A A E +CD 25 141B 0 -14,-3.0 -14,-2.5 -2,-0.4 2,-0.3 -0.921 14.5 170.9-113.3 137.0 18.1 16.8 56.3 40 44 A Y E - D 0 140B 0 100,-2.6 100,-2.5 -2,-0.4 2,-0.5 -0.944 26.9-139.1-149.6 165.2 16.1 14.5 58.7 41 45 A H E - D 0 139B 41 -18,-0.3 2,-0.4 -2,-0.3 98,-0.2 -0.948 13.6-161.2-134.7 103.3 13.0 12.4 58.9 42 46 A I E + D 0 138B 0 96,-2.8 96,-2.2 -2,-0.5 2,-0.3 -0.727 19.1 165.2 -85.8 134.0 10.9 12.3 62.0 43 47 A T > - 0 0 31 -2,-0.4 3,-1.7 48,-0.3 94,-0.1 -0.854 56.0 -89.4-133.1 176.9 8.5 9.3 62.5 44 48 A K T 3 S+ 0 0 95 92,-0.4 93,-0.1 1,-0.3 -2,-0.0 0.770 127.1 52.4 -60.5 -23.4 6.6 8.0 65.5 45 49 A D T 3 S+ 0 0 143 1,-0.1 -1,-0.3 3,-0.0 -3,-0.0 0.495 96.4 69.1 -90.5 -5.7 9.6 5.9 66.4 46 50 A T S < S+ 0 0 13 -3,-1.7 48,-3.3 45,-0.1 49,-0.4 0.828 72.2 89.5 -89.3 -31.0 12.3 8.7 66.3 47 51 A P + 0 0 42 0, 0.0 2,-0.3 0, 0.0 44,-0.2 -0.353 44.5 168.2 -69.0 147.2 11.6 11.0 69.3 48 52 A A - 0 0 29 42,-1.9 3,-0.4 41,-0.2 45,-0.3 -0.922 20.6-142.1-153.7 133.1 13.2 10.2 72.6 49 53 A S + 0 0 110 -2,-0.3 42,-0.0 1,-0.2 41,-0.0 -0.558 69.3 23.9 -98.2 159.5 13.3 12.5 75.6 50 54 A G S S+ 0 0 77 1,-0.2 -1,-0.2 -2,-0.2 2,-0.0 0.536 71.2 154.0 73.8 13.1 16.0 13.3 78.2 51 55 A K - 0 0 72 -3,-0.4 -1,-0.2 1,-0.1 2,-0.1 -0.363 40.6-118.1 -71.9 153.8 19.1 12.3 76.3 52 56 A T - 0 0 91 1,-0.0 2,-0.5 -2,-0.0 -1,-0.1 -0.363 13.7-122.2 -92.1 171.6 22.4 13.9 77.3 53 57 A R + 0 0 122 -2,-0.1 2,-1.3 2,-0.0 -1,-0.0 -0.708 31.2 168.2-120.9 80.2 24.7 16.2 75.3 54 58 A N - 0 0 126 -2,-0.5 48,-0.1 45,-0.1 -2,-0.0 -0.720 29.8-147.1 -93.4 90.8 28.2 14.9 75.0 55 59 A W + 0 0 68 -2,-1.3 2,-0.3 48,-0.1 48,-0.2 -0.352 26.4 172.6 -57.4 139.1 29.6 17.2 72.3 56 60 A K B -h 103 0C 97 46,-1.6 48,-2.5 44,-0.1 49,-0.3 -0.997 38.9-100.9-149.9 149.4 32.1 15.5 70.1 57 61 A T - 0 0 42 -2,-0.3 11,-0.1 46,-0.2 45,-0.0 -0.435 50.9-104.4 -64.4 137.9 34.1 16.1 66.9 58 62 A D > - 0 0 1 9,-0.4 3,-1.4 1,-0.2 -1,-0.1 -0.558 27.4-154.1 -67.8 119.1 32.4 14.2 64.0 59 63 A P T 3 S+ 0 0 93 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.632 88.4 64.6 -71.1 -14.0 34.7 11.2 63.4 60 64 A A T 3 S+ 0 0 57 2,-0.1 2,-0.3 3,-0.0 -2,-0.1 0.561 96.2 67.7 -86.5 -6.3 33.6 11.0 59.7 61 65 A L S < S- 0 0 29 -3,-1.4 5,-0.1 -42,-0.0 44,-0.0 -0.727 95.4 -98.8-108.2 157.9 35.2 14.4 58.8 62 66 A N > - 0 0 94 -2,-0.3 3,-2.6 1,-0.1 4,-0.2 -0.631 36.8-127.7 -67.9 133.5 38.8 15.5 58.7 63 67 A P G > S+ 0 0 86 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.788 107.9 60.8 -57.1 -25.0 39.3 17.3 62.0 64 68 A A G 3 S+ 0 0 59 1,-0.2 -2,-0.0 3,-0.0 3,-0.0 0.629 101.6 54.7 -75.1 -10.9 40.7 20.4 60.2 65 69 A D G < S+ 0 0 57 -3,-2.6 2,-0.3 2,-0.1 -32,-0.2 0.280 113.0 31.4-107.1 8.7 37.3 20.7 58.4 66 70 A T S < S- 0 0 0 -3,-0.9 2,-0.2 -4,-0.2 -32,-0.1 -0.876 87.4 -88.4-153.8 173.3 35.0 20.9 61.4 67 71 A L - 0 0 0 -34,-0.6 -9,-0.4 -2,-0.3 37,-0.2 -0.603 26.7-149.0 -94.7 160.5 35.0 22.1 65.0 68 72 A A > - 0 0 25 -2,-0.2 3,-1.8 -11,-0.1 4,-0.4 -0.813 35.5-101.5-117.6 159.5 36.1 20.2 68.2 69 73 A P G > S+ 0 0 48 0, 0.0 3,-1.7 0, 0.0 4,-0.2 0.860 119.6 61.9 -52.5 -39.9 34.6 20.8 71.7 70 74 A A G > S+ 0 0 67 1,-0.3 3,-1.7 2,-0.2 -3,-0.0 0.802 90.0 70.1 -55.0 -30.1 37.6 22.9 72.7 71 75 A D G < S+ 0 0 15 -3,-1.8 84,-0.6 1,-0.3 -1,-0.3 0.693 91.7 58.8 -66.0 -19.0 36.7 25.4 70.0 72 76 A Y G X S+ 0 0 5 -3,-1.7 3,-2.3 -4,-0.4 4,-0.5 0.450 72.6 128.9 -88.3 -2.5 33.6 26.5 71.9 73 77 A T T < S+ 0 0 96 -3,-1.7 82,-0.3 1,-0.3 83,-0.1 -0.334 84.2 1.8 -59.7 129.3 35.5 27.6 75.1 74 78 A G T 3> S+ 0 0 39 80,-0.1 4,-1.9 81,-0.1 -1,-0.3 0.432 94.9 121.8 78.0 0.5 34.5 31.1 76.0 75 79 A A H <> S+ 0 0 3 -3,-2.3 4,-2.9 1,-0.2 6,-0.6 0.909 72.2 49.1 -67.5 -43.1 32.0 31.4 73.2 76 80 A N H > S+ 0 0 86 -4,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.943 112.8 48.3 -62.4 -42.4 29.0 32.1 75.4 77 81 A A H 4 S+ 0 0 92 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.852 119.6 38.4 -64.4 -36.0 30.8 34.8 77.3 78 82 A A H < S+ 0 0 61 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.884 135.7 12.3 -81.0 -40.5 32.1 36.5 74.2 79 83 A L H < S- 0 0 27 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.376 89.7-117.9-127.4 1.0 29.1 36.2 71.9 80 84 A K < + 0 0 156 -4,-2.1 32,-2.5 -5,-0.4 33,-0.4 0.881 67.2 143.0 57.2 41.5 26.0 35.1 73.8 81 85 A V E -I 111 0D 5 -6,-0.6 30,-0.3 30,-0.3 2,-0.3 -0.805 38.7-153.8-112.0 151.5 25.8 31.9 71.8 82 86 A D E -I 110 0D 28 28,-3.1 28,-2.2 -2,-0.3 2,-1.3 -0.731 38.5 -96.2-108.3 165.3 24.9 28.3 72.6 83 87 A R E -I 109 0D 87 -2,-0.3 2,-0.5 26,-0.2 28,-0.0 -0.745 57.5-163.2 -78.6 94.1 25.9 25.0 71.0 84 88 A G E -I 108 0D 1 24,-2.7 24,-1.7 -2,-1.3 2,-0.2 -0.755 12.2-128.2 -94.6 131.2 22.7 24.9 68.8 85 89 A H E -I 107 0D 9 -2,-0.5 22,-0.2 22,-0.2 17,-0.1 -0.471 13.7-167.8 -71.4 143.0 21.5 21.8 67.1 86 90 A Q S S+ 0 0 4 20,-2.5 -1,-0.1 1,-0.3 21,-0.1 0.880 90.2 39.0 -85.5 -75.0 20.6 21.8 63.4 87 91 A A S S- 0 0 0 19,-0.2 -1,-0.3 55,-0.1 2,-0.2 -0.620 108.9-113.5 -71.4 130.0 18.9 18.4 63.4 88 92 A P > - 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