==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(ENDORIBONUCLEASE) 03-AUG-93 1SSB . COMPND 2 MOLECULE: RIBONUCLEASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR V.S.J.DEMEL,M.S.DOSCHER,M.A.GLINN,P.D.MARTIN,M.L.RAM, . 124 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6748.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 72 58.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 28.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 7 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 0 1 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 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 2 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A K 0 0 225 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 13.9 23.6 0.9 22.2 2 2 A E - 0 0 87 4,-0.0 5,-0.0 2,-0.0 0, 0.0 0.942 360.0-119.4 39.5 117.3 24.9 4.3 23.4 3 3 A T > - 0 0 94 1,-0.1 4,-2.0 4,-0.0 5,-0.1 -0.358 23.6-115.3 -70.6 162.7 25.6 4.8 27.1 4 4 A A H > S+ 0 0 42 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.837 118.7 56.8 -66.5 -33.7 23.7 7.6 28.8 5 5 A A H > S+ 0 0 21 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.935 109.8 44.5 -59.0 -47.0 27.1 9.3 29.4 6 6 A A H > S+ 0 0 28 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.823 108.8 55.6 -65.1 -39.7 27.7 9.2 25.7 7 7 A K H X S+ 0 0 80 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.861 105.9 53.6 -65.1 -36.4 24.2 10.4 24.9 8 8 A F H X S+ 0 0 4 -4,-1.9 4,-3.0 2,-0.2 5,-0.5 0.915 109.8 47.3 -63.2 -46.8 24.8 13.5 27.2 9 9 A E H X S+ 0 0 73 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.960 111.8 49.3 -61.6 -48.5 28.0 14.3 25.2 10 10 A R H < S+ 0 0 64 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.924 119.6 38.0 -58.3 -40.1 26.3 14.0 21.8 11 11 A Q H < S+ 0 0 26 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.859 130.9 18.7 -80.7 -37.4 23.4 16.2 22.9 12 12 A H H < S+ 0 0 13 -4,-3.0 35,-3.8 -5,-0.2 2,-0.7 0.512 92.2 99.5-116.5 -3.7 24.9 18.9 25.0 13 13 A M B < +a 47 0A 16 -4,-1.9 2,-0.2 -5,-0.5 35,-0.2 -0.785 26.7 154.7 -99.1 121.0 28.7 19.1 24.4 14 14 A D > + 0 0 5 33,-2.8 3,-0.6 -2,-0.7 -1,-0.1 -0.677 8.8 153.3-137.0 76.8 29.9 21.9 22.1 15 15 A S T 3 + 0 0 69 1,-0.2 33,-0.1 -2,-0.2 -1,-0.1 0.294 60.3 72.1 -84.9 0.9 33.5 22.5 23.2 16 16 A S T 3 S+ 0 0 103 1,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.226 97.7 50.1-102.5 9.2 34.8 23.8 19.8 17 17 A T < - 0 0 47 -3,-0.6 3,-0.1 32,-0.1 -3,-0.1 -0.957 66.7-149.7-144.0 136.9 32.9 27.1 20.0 18 18 A S S S- 0 0 101 -2,-0.3 2,-0.3 1,-0.2 30,-0.2 0.486 82.7 -4.4 -85.0 -10.9 32.9 29.6 22.9 19 19 A A S S- 0 0 32 28,-0.1 2,-0.4 61,-0.1 -1,-0.2 -0.951 96.5 -60.6-171.6 166.1 29.4 30.7 22.0 20 20 A A - 0 0 19 -2,-0.3 81,-0.1 61,-0.2 3,-0.0 -0.478 44.5-150.2 -62.6 115.1 26.5 30.4 19.5 21 21 A S - 0 0 93 -2,-0.4 2,-0.2 1,-0.0 -1,-0.1 0.937 60.9 -30.1 -50.7 -66.7 27.9 31.5 16.2 22 22 A S S > S- 0 0 61 0, 0.0 3,-1.3 0, 0.0 4,-0.3 -0.672 75.3 -73.8-143.2-168.0 24.7 32.8 14.6 23 23 A S T 3 S+ 0 0 106 1,-0.3 4,-0.3 -2,-0.2 3,-0.3 0.654 126.2 58.5 -68.4 -27.9 20.9 32.5 14.4 24 24 A N T 3> S+ 0 0 64 1,-0.2 4,-2.1 2,-0.1 -1,-0.3 0.346 77.5 98.2 -86.0 -2.3 21.4 29.3 12.4 25 25 A Y H <> S+ 0 0 8 -3,-1.3 4,-2.6 2,-0.2 5,-0.2 0.898 85.5 42.7 -56.9 -52.5 23.4 27.6 15.2 26 26 A a H > S+ 0 0 0 -4,-0.3 4,-3.1 -3,-0.3 5,-0.3 0.947 112.7 55.5 -59.4 -42.9 20.6 25.6 16.7 27 27 A N H > S+ 0 0 46 70,-0.3 4,-1.2 -4,-0.3 -1,-0.2 0.894 114.6 38.5 -52.1 -51.8 19.4 24.7 13.3 28 28 A Q H X S+ 0 0 84 -4,-2.1 4,-3.5 2,-0.2 -1,-0.2 0.905 117.8 46.8 -61.2 -58.3 22.8 23.3 12.3 29 29 A M H X S+ 0 0 22 -4,-2.6 4,-2.2 2,-0.2 6,-0.2 0.827 106.7 55.4 -63.3 -38.3 23.6 21.6 15.6 30 30 A M H <>S+ 0 0 0 -4,-3.1 5,-3.4 -5,-0.2 6,-0.3 0.940 116.3 41.1 -65.1 -40.8 20.3 19.9 16.2 31 31 A K H ><5S+ 0 0 134 -4,-1.2 3,-2.0 -5,-0.3 5,-0.3 0.947 114.2 51.2 -64.4 -56.0 20.8 18.3 12.8 32 32 A S H 3<5S+ 0 0 79 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.808 108.4 50.3 -49.1 -44.8 24.5 17.6 13.2 33 33 A R T 3<5S- 0 0 60 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.257 118.3-113.4 -83.0 11.1 24.1 15.8 16.5 34 34 A N T < 5S+ 0 0 101 -3,-2.0 3,-0.4 1,-0.1 -3,-0.2 0.797 76.2 135.5 60.3 37.6 21.4 13.7 14.9 35 35 A L < + 0 0 13 -5,-3.4 6,-1.7 -6,-0.2 -4,-0.2 0.270 68.1 49.2 -96.0 7.0 18.6 15.3 17.1 36 36 A T S S+ 0 0 16 -6,-0.3 -1,-0.2 -5,-0.3 59,-0.1 0.108 77.7 108.7-126.7 14.1 16.2 15.8 14.2 37 37 A K S S+ 0 0 70 -3,-0.4 -2,-0.1 1,-0.1 3,-0.1 0.859 97.0 1.5 -65.4 -42.1 16.3 12.3 12.7 38 38 A D S S+ 0 0 144 1,-0.3 2,-0.2 -3,-0.0 -1,-0.1 0.724 138.0 6.8-109.8 -49.7 12.9 10.9 13.6 39 39 A R S S- 0 0 161 -4,-0.1 2,-0.7 54,-0.0 -1,-0.3 -0.601 83.9 -98.7-120.9 177.1 11.1 13.7 15.5 40 40 A b - 0 0 11 -2,-0.2 -4,-0.2 -3,-0.1 52,-0.1 -0.955 35.8-135.9-103.2 104.5 12.1 17.3 16.1 41 41 A K - 0 0 34 -6,-1.7 3,-0.1 -2,-0.7 -6,-0.1 -0.557 19.4-150.7 -60.7 125.3 13.6 17.3 19.6 42 42 A P + 0 0 56 0, 0.0 44,-3.9 0, 0.0 2,-0.4 0.780 67.8 21.3 -72.3 -35.6 11.8 20.4 20.9 43 43 A V E + B 0 85A 58 42,-0.2 2,-0.3 54,-0.1 42,-0.2 -0.994 66.2 155.7-137.4 137.1 14.2 21.8 23.4 44 44 A N E - B 0 84A 4 40,-1.8 40,-2.7 -2,-0.4 2,-0.4 -0.976 25.2-141.4-158.0 150.8 18.0 21.2 23.9 45 45 A T E - B 0 83A 9 -2,-0.3 2,-0.4 38,-0.2 38,-0.2 -0.970 5.8-162.7-122.6 137.2 21.0 22.8 25.5 46 46 A F E - B 0 82A 0 36,-2.4 36,-1.7 -2,-0.4 2,-0.4 -0.889 12.3-150.6-109.5 130.5 24.6 22.9 24.2 47 47 A V E -aB 13 81A 0 -35,-3.8 -33,-2.8 -2,-0.4 2,-0.7 -0.913 4.2-152.6-103.0 133.9 27.4 23.9 26.7 48 48 A H + 0 0 10 32,-3.4 32,-0.3 -2,-0.4 2,-0.3 -0.710 60.9 101.4-102.5 62.6 30.5 25.6 25.3 49 49 A E S S- 0 0 50 -2,-0.7 -35,-0.2 30,-0.1 -2,-0.1 -0.882 81.7 -84.2-138.6 165.6 33.0 24.4 28.0 50 50 A S > - 0 0 53 -2,-0.3 4,-1.4 1,-0.1 5,-0.2 -0.302 38.6-116.8 -69.6 163.7 35.6 21.7 28.0 51 51 A L H > S+ 0 0 64 1,-0.2 4,-4.3 2,-0.2 5,-0.3 0.913 115.2 58.1 -62.8 -43.1 34.3 18.2 28.8 52 52 A A H > S+ 0 0 62 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.939 105.3 48.5 -53.7 -45.3 36.5 18.2 31.9 53 53 A D H 4 S+ 0 0 83 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.846 113.9 45.7 -65.9 -37.9 34.8 21.3 33.3 54 54 A V H >X S+ 0 0 0 -4,-1.4 3,-2.0 2,-0.2 4,-0.6 0.925 112.4 51.9 -72.0 -48.4 31.3 19.9 32.7 55 55 A Q H >< S+ 0 0 68 -4,-4.3 3,-1.5 1,-0.3 -2,-0.2 0.942 103.1 60.5 -53.9 -39.6 32.4 16.5 34.2 56 56 A A G >< S+ 0 0 38 -4,-2.8 3,-2.1 -5,-0.3 -1,-0.3 0.741 85.5 75.5 -60.0 -20.8 33.7 18.5 37.3 57 57 A V G X4 S+ 0 0 0 -3,-2.0 3,-2.9 -4,-0.4 -1,-0.2 0.850 80.4 71.8 -59.4 -34.8 30.2 19.8 38.0 58 58 A c G << S+ 0 0 6 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.543 99.6 47.6 -56.2 -11.1 29.4 16.3 39.4 59 59 A S G < S+ 0 0 95 -3,-2.1 -1,-0.3 -4,-0.2 -2,-0.2 0.140 104.3 77.9-119.7 19.9 31.6 17.3 42.3 60 60 A Q S < S- 0 0 44 -3,-2.9 2,-0.6 1,-0.2 15,-0.2 0.310 94.5 -12.2-101.9-137.4 30.0 20.7 42.9 61 61 A K E -D 74 0B 71 13,-1.8 13,-2.7 1,-0.1 2,-0.4 -0.611 62.6-141.6 -77.3 114.4 26.8 21.9 44.5 62 62 A N E +D 73 0B 91 -2,-0.6 2,-0.3 11,-0.2 11,-0.2 -0.535 33.8 159.1 -79.3 130.5 24.3 19.0 45.2 63 63 A V E -D 72 0B 43 9,-2.6 9,-1.3 -2,-0.4 2,-0.0 -0.938 44.7 -87.3-143.6 159.1 20.7 20.0 44.6 64 64 A A - 0 0 64 -2,-0.3 6,-0.2 7,-0.1 2,-0.2 -0.381 40.5-128.3 -67.6 152.6 17.5 18.2 43.9 65 65 A d > - 0 0 9 4,-2.9 3,-1.6 7,-0.1 7,-0.1 -0.566 31.2-101.5 -92.1 167.1 16.6 17.4 40.3 66 66 A K T 3 S+ 0 0 155 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.1 0.698 123.4 57.4 -57.7 -31.6 13.3 18.5 38.9 67 67 A N T 3 S- 0 0 98 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.323 121.8-105.4 -85.6 1.0 12.1 14.9 39.3 68 68 A G S < S+ 0 0 57 -3,-1.6 -2,-0.1 1,-0.3 -4,-0.0 0.251 79.2 131.0 91.7 -10.2 12.8 14.9 43.0 69 69 A Q - 0 0 96 1,-0.1 -4,-2.9 -5,-0.1 -1,-0.3 -0.299 54.3-140.4 -67.5 162.7 16.0 12.7 42.8 70 70 A T S S+ 0 0 103 -6,-0.2 -6,-0.1 1,-0.1 -1,-0.1 -0.089 76.5 97.2-117.0 30.7 19.0 14.1 44.6 71 71 A N + 0 0 30 -9,-0.1 39,-2.5 2,-0.0 2,-0.3 -0.052 58.2 114.9-106.9 30.0 21.8 13.3 42.1 72 72 A d E -DE 63 109B 0 -9,-1.3 -9,-2.6 37,-0.2 2,-0.4 -0.739 45.3-166.0-104.1 148.6 21.7 16.8 40.6 73 73 A Y E -DE 62 108B 35 35,-2.2 35,-2.3 -2,-0.3 2,-0.4 -0.999 9.8-147.4-139.8 137.8 24.6 19.2 40.8 74 74 A Q E -DE 61 107B 33 -13,-2.7 -13,-1.8 -2,-0.4 33,-0.2 -0.856 27.7-113.5-101.2 133.6 24.8 22.9 40.0 75 75 A S - 0 0 0 31,-2.8 4,-0.1 -2,-0.4 -18,-0.1 -0.338 15.5-141.7 -67.4 142.5 28.0 24.4 38.6 76 76 A Y S S+ 0 0 148 2,-0.1 2,-0.2 29,-0.1 -1,-0.2 0.853 87.9 45.9 -70.2 -32.2 29.6 26.8 41.2 77 77 A S S S- 0 0 82 27,-0.1 29,-0.4 29,-0.0 2,-0.2 -0.635 95.8-101.0-106.6 162.5 30.4 29.1 38.2 78 78 A T - 0 0 67 -2,-0.2 2,-0.3 27,-0.2 27,-0.3 -0.635 38.0-159.3 -83.6 143.5 28.5 30.3 35.2 79 79 A M E - C 0 104A 13 25,-3.3 25,-1.8 -2,-0.2 2,-0.4 -0.825 25.3-102.4-120.5 162.5 29.2 28.4 31.9 80 80 A S E + C 0 103A 9 -32,-0.3 -32,-3.4 -2,-0.3 2,-0.3 -0.792 53.2 165.0 -84.9 125.0 28.6 29.5 28.3 81 81 A I E -BC 47 102A 0 21,-3.1 21,-2.4 -2,-0.4 2,-0.4 -0.870 31.4-145.1-137.0 167.2 25.5 27.7 26.9 82 82 A T E -BC 46 101A 0 -36,-1.7 -36,-2.4 -2,-0.3 2,-0.5 -0.987 13.7-149.0-133.9 120.4 23.0 27.9 24.0 83 83 A D E -BC 45 100A 44 17,-2.9 17,-2.4 -2,-0.4 2,-0.5 -0.775 10.2-161.1 -89.8 132.0 19.3 27.1 24.4 84 84 A a E +BC 44 99A 0 -40,-2.7 -40,-1.8 -2,-0.5 2,-0.4 -0.923 11.6 179.0-113.5 128.3 17.6 25.6 21.3 85 85 A R E -BC 43 98A 156 13,-2.0 13,-1.9 -2,-0.5 -42,-0.2 -0.952 31.2-116.8-136.6 120.6 13.8 25.8 21.2 86 86 A E E - 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