==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (NUCLEIC ACID,RNA) 27-AUG-85 1RSM . COMPND 2 MOLECULE: RIBONUCLEASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR P.C.WEBER,S.SHERIFF,D.H.OHLENDORF,B.C.FINZEL,F.R.SALEMME . 124 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7034.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 76 61.3 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 . 34 27.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 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 . 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 . 10 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.4 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 1 0 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 0 252 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -53.4 4.9 -2.9 28.2 2 2 A E - 0 0 84 4,-0.0 2,-0.1 3,-0.0 0, 0.0 -0.870 360.0-138.3 -92.5 123.4 4.9 -1.7 24.6 3 3 A T > - 0 0 89 -2,-0.6 4,-2.1 1,-0.1 5,-0.2 -0.307 21.2-109.2 -75.3 165.4 4.8 -4.8 22.4 4 4 A A H > S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.897 121.4 53.9 -61.8 -38.2 6.9 -5.2 19.2 5 5 A A H > S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.870 109.0 46.2 -60.9 -45.5 3.7 -4.9 17.3 6 6 A A H > S+ 0 0 38 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.827 110.2 53.3 -67.3 -39.6 2.7 -1.6 18.9 7 7 A K H X S+ 0 0 64 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.865 105.1 56.2 -63.9 -42.1 6.2 -0.1 18.5 8 8 A F H X>S+ 0 0 6 -4,-2.1 4,-2.4 109,-0.2 5,-0.5 0.940 109.5 46.0 -52.9 -49.2 5.9 -1.0 14.7 9 9 A E H X5S+ 0 0 78 -4,-1.8 4,-1.7 3,-0.2 -2,-0.2 0.946 114.3 47.7 -63.0 -43.0 2.7 1.1 14.5 10 10 A R H <5S+ 0 0 71 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.922 119.5 37.9 -64.3 -43.9 4.2 4.0 16.5 11 11 A Q H <5S+ 0 0 37 -4,-3.0 -1,-0.2 1,-0.1 -2,-0.2 0.806 132.7 16.8 -77.4 -35.2 7.4 4.1 14.5 12 12 A H H <5S+ 0 0 11 -4,-2.4 35,-3.5 -5,-0.3 2,-0.5 0.622 94.1 94.8-117.2 -22.4 6.1 3.4 11.0 13 13 A M B << +a 47 0A 12 -4,-1.7 35,-0.2 -5,-0.5 2,-0.1 -0.704 26.9 159.0 -93.0 131.9 2.4 3.8 10.5 14 14 A D > + 0 0 8 33,-2.6 3,-0.9 -2,-0.5 36,-0.1 -0.541 6.1 157.1-143.1 76.2 0.8 7.0 9.2 15 15 A S T 3 + 0 0 68 1,-0.2 33,-0.1 33,-0.2 -1,-0.1 0.454 60.6 83.1 -76.6 -8.6 -2.7 6.2 7.8 16 16 A S T 3 S+ 0 0 99 -3,-0.1 2,-0.3 33,-0.0 -1,-0.2 0.512 95.4 34.5 -75.3 -13.0 -3.9 9.8 8.2 17 17 A T < - 0 0 45 -3,-0.9 3,-0.1 32,-0.1 -3,-0.1 -0.930 66.8-136.2-139.1 159.1 -2.3 11.0 5.0 18 18 A S S S- 0 0 102 -2,-0.3 2,-0.3 1,-0.3 30,-0.2 0.608 91.5 -12.9 -83.3 -25.5 -1.7 9.7 1.5 19 19 A A S S- 0 0 28 28,-0.1 -1,-0.3 82,-0.1 2,-0.1 -0.949 96.8 -59.9-164.9 168.4 1.8 11.2 1.4 20 20 A A - 0 0 3 -2,-0.3 81,-0.1 61,-0.2 3,-0.1 -0.432 42.2-150.8 -64.8 134.9 4.0 13.6 3.4 21 21 A S - 0 0 90 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.893 65.8 -1.0 -72.6 -47.5 2.4 17.1 3.4 22 22 A S S > S- 0 0 49 1,-0.0 3,-2.0 0, 0.0 4,-0.3 -0.858 76.2 -94.5-140.2 175.2 5.5 19.3 3.7 23 23 A S T 3 S+ 0 0 85 1,-0.3 76,-0.4 -2,-0.3 4,-0.3 0.697 123.5 59.9 -65.3 -17.5 9.3 19.3 4.0 24 24 A N T 3> S+ 0 0 80 1,-0.2 4,-2.3 2,-0.1 -1,-0.3 0.437 74.6 100.3 -90.9 -0.4 8.7 19.5 7.8 25 25 A Y H <> S+ 0 0 6 -3,-2.0 4,-3.0 1,-0.2 5,-0.3 0.923 83.5 44.3 -48.9 -56.0 6.7 16.2 7.9 26 26 A a H > S+ 0 0 0 -4,-0.3 4,-3.2 -3,-0.3 5,-0.4 0.917 112.1 54.0 -59.7 -42.7 9.6 14.1 9.2 27 27 A N H > S+ 0 0 59 -4,-0.3 4,-1.2 70,-0.3 -1,-0.2 0.936 114.6 40.7 -57.2 -48.0 10.5 16.8 11.8 28 28 A Q H X S+ 0 0 111 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.888 118.9 45.5 -65.2 -44.9 7.0 16.9 13.2 29 29 A M H X S+ 0 0 24 -4,-3.0 4,-2.0 2,-0.2 6,-0.2 0.841 108.7 53.2 -70.0 -43.6 6.4 13.1 13.1 30 30 A M H <>S+ 0 0 2 -4,-3.2 5,-2.9 -5,-0.3 6,-0.6 0.902 116.8 41.8 -59.2 -38.4 9.8 12.0 14.6 31 31 A K H ><5S+ 0 0 145 -4,-1.2 3,-1.1 -5,-0.4 -2,-0.2 0.938 113.7 48.2 -75.3 -51.4 9.0 14.3 17.5 32 32 A S H 3<5S+ 0 0 77 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.771 111.3 50.2 -66.5 -26.6 5.3 13.6 18.0 33 33 A R T 3<5S- 0 0 61 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.401 112.4-121.6 -88.5 3.5 5.8 9.8 18.0 34 34 A N T X 5 + 0 0 95 -3,-1.1 3,-0.6 -5,-0.1 -3,-0.2 0.907 67.1 141.5 60.1 41.8 8.6 10.2 20.5 35 35 A L T 3 < + 0 0 8 -5,-2.9 6,-0.4 -6,-0.2 4,-0.2 0.582 67.1 51.2 -88.6 -5.0 11.1 8.6 18.2 36 36 A T T 3 S+ 0 0 15 -6,-0.6 -1,-0.2 -5,-0.2 59,-0.2 0.064 75.3 102.8-119.3 23.4 13.8 11.0 19.2 37 37 A K S < S+ 0 0 92 -3,-0.6 -1,-0.1 1,-0.2 -2,-0.1 0.857 93.1 29.5 -70.0 -39.3 13.7 10.8 23.0 38 38 A D S S- 0 0 153 1,-0.4 2,-0.3 -4,-0.2 -1,-0.2 0.784 135.2 -33.3 -92.1 -32.2 16.8 8.5 23.3 39 39 A R S S- 0 0 144 -4,-0.2 2,-0.8 54,-0.1 -1,-0.4 -0.920 73.2 -78.3-173.8 174.5 18.8 9.6 20.3 40 40 A b - 0 0 15 -2,-0.3 -4,-0.1 -3,-0.1 52,-0.1 -0.850 44.2-136.9 -91.9 112.3 18.3 10.8 16.7 41 41 A K - 0 0 34 -2,-0.8 3,-0.1 -6,-0.4 45,-0.1 -0.480 12.1-137.9 -64.7 135.4 17.5 7.7 14.6 42 42 A P S S+ 0 0 63 0, 0.0 44,-2.3 0, 0.0 2,-0.3 0.850 79.9 8.1 -64.5 -39.6 19.5 8.2 11.4 43 43 A V E + B 0 85A 72 42,-0.2 2,-0.3 54,-0.1 42,-0.2 -0.984 63.7 175.5-139.6 157.2 16.7 7.0 9.1 44 44 A N E - B 0 84A 4 40,-2.2 40,-2.6 -2,-0.3 2,-0.4 -0.961 15.8-148.0-155.5 152.5 13.0 6.1 9.5 45 45 A T E - B 0 83A 14 -2,-0.3 2,-0.4 38,-0.2 38,-0.2 -0.985 6.4-160.6-121.3 138.0 10.2 5.2 7.1 46 46 A F E - B 0 82A 0 36,-2.4 36,-2.4 -2,-0.4 2,-0.5 -0.920 12.2-144.8-114.0 142.5 6.5 6.1 7.5 47 47 A V E -aB 13 81A 0 -35,-3.5 -33,-2.6 -2,-0.4 2,-1.0 -0.935 4.2-158.1-112.0 127.4 3.9 4.1 5.6 48 48 A H + 0 0 7 32,-3.1 32,-0.3 -2,-0.5 2,-0.3 -0.582 57.8 99.7-105.7 61.5 0.8 5.8 4.3 49 49 A E S S- 0 0 54 -2,-1.0 -35,-0.2 30,-0.1 -2,-0.1 -0.926 81.7 -81.4-136.3 165.1 -1.5 2.8 3.9 50 50 A S > - 0 0 50 -2,-0.3 4,-1.8 1,-0.1 3,-0.3 -0.288 38.4-116.9 -67.2 155.4 -4.3 1.4 6.1 51 51 A L H > S+ 0 0 55 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.928 115.7 55.8 -56.6 -43.5 -3.3 -0.8 9.1 52 52 A A H > S+ 0 0 62 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.879 105.5 50.0 -59.7 -38.5 -5.2 -3.7 7.5 53 53 A D H 4 S+ 0 0 84 -3,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.837 114.2 45.8 -70.1 -35.6 -3.2 -3.4 4.2 54 54 A V H >< S+ 0 0 0 -4,-1.8 3,-1.1 2,-0.2 4,-0.4 0.888 111.0 50.7 -70.5 -45.4 0.1 -3.4 6.1 55 55 A Q H >< S+ 0 0 73 -4,-2.7 3,-1.3 1,-0.2 -2,-0.2 0.847 102.7 63.0 -58.5 -35.1 -0.9 -6.3 8.4 56 56 A A G >< S+ 0 0 35 -4,-1.6 3,-2.4 1,-0.3 -1,-0.2 0.731 81.7 80.2 -65.9 -19.9 -1.8 -8.2 5.2 57 57 A V G X S+ 0 0 0 -3,-1.1 3,-2.5 -4,-0.4 -1,-0.3 0.832 78.2 71.1 -54.3 -37.1 1.9 -8.0 4.2 58 58 A c G < S+ 0 0 10 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.665 101.3 44.0 -58.2 -7.4 2.4 -11.0 6.6 59 59 A S G < S+ 0 0 94 -3,-2.4 -1,-0.3 -4,-0.1 -2,-0.2 0.166 104.9 80.5-120.6 20.2 0.5 -13.2 4.1 60 60 A Q S < S- 0 0 43 -3,-2.5 2,-0.7 1,-0.2 15,-0.2 0.333 93.8 -13.9-103.4-133.9 2.2 -11.9 1.0 61 61 A K E -D 74 0B 107 13,-1.7 13,-3.2 1,-0.0 2,-0.4 -0.634 62.4-141.4 -81.2 112.2 5.6 -12.6 -0.7 62 62 A N E +D 73 0B 93 -2,-0.7 2,-0.3 11,-0.2 11,-0.3 -0.632 32.8 162.8 -73.6 125.0 8.0 -14.5 1.6 63 63 A V E -D 72 0B 34 9,-1.6 9,-1.0 -2,-0.4 2,-0.2 -0.863 42.8 -86.2-133.6 165.2 11.6 -13.3 1.3 64 64 A A - 0 0 73 -2,-0.3 6,-0.2 7,-0.1 2,-0.2 -0.535 40.1-130.8 -72.9 139.6 14.8 -13.5 3.4 65 65 A d > - 0 0 7 4,-2.5 3,-2.3 -2,-0.2 7,-0.1 -0.492 28.1-105.5 -81.8 159.3 15.3 -10.9 6.1 66 66 A K T 3 S+ 0 0 162 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.831 122.8 55.4 -53.9 -36.8 18.7 -9.0 6.2 67 67 A N T 3 S- 0 0 111 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.305 122.4-107.4 -79.7 2.0 19.6 -11.1 9.3 68 68 A G S < S+ 0 0 56 -3,-2.3 -2,-0.1 1,-0.3 -1,-0.1 0.332 76.3 130.9 89.0 -5.0 19.0 -14.3 7.3 69 69 A Q - 0 0 114 1,-0.1 -4,-2.5 -5,-0.1 -1,-0.3 -0.315 56.2-133.9 -70.7 165.9 15.8 -15.4 9.0 70 70 A T S S+ 0 0 104 -6,-0.2 -1,-0.1 1,-0.1 -6,-0.0 0.118 79.9 93.3-116.8 26.2 12.8 -16.4 6.9 71 71 A N + 0 0 31 -9,-0.1 39,-2.6 2,-0.0 2,-0.3 -0.143 60.6 112.2-105.7 32.3 9.9 -14.5 8.5 72 72 A d E -DE 63 109B 0 -9,-1.0 -9,-1.6 37,-0.2 2,-0.4 -0.800 45.4-169.5-104.9 147.6 10.2 -11.5 6.2 73 73 A Y E -DE 62 108B 30 35,-2.0 35,-2.4 -2,-0.3 2,-0.4 -0.987 12.4-145.7-140.9 137.0 7.5 -10.6 3.6 74 74 A Q E -DE 61 107B 33 -13,-3.2 -13,-1.7 -2,-0.4 33,-0.2 -0.824 30.8-108.5-103.1 135.6 7.5 -8.1 0.7 75 75 A S - 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C 0 97A 67 -44,-2.3 11,-0.3 -2,-0.4 2,-0.1 -0.317 36.7-134.3 -62.9 143.7 19.0 13.0 9.3 87 87 A T > - 0 0 55 9,-1.7 3,-1.1 1,-0.1 9,-0.2 -0.331 27.6-100.0 -90.7-179.3 20.3 16.2 7.7 88 88 A G T 3 S+ 0 0 94 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 0.522 120.1 61.0 -76.6 -6.8 23.9 17.5 8.2 89 89 A S T 3 S+ 0 0 100 7,-0.0 2,-0.5 2,-0.0 -1,-0.3 0.135 77.4 115.8-105.5 16.2 22.6 19.9 10.8 90 90 A S < + 0 0 23 -3,-1.1 2,-0.4 6,-0.2 5,-0.2 -0.819 27.1 158.2 -98.3 125.1 21.2 17.4 13.3 91 91 A K B > -G 94 0C 142 3,-1.2 3,-2.6 -2,-0.5 -3,-0.0 -0.976 47.9 -75.2-143.8 123.6 22.7 17.0 16.8 92 92 A Y T 3 S+ 0 0 111 1,-0.4 -55,-0.0 -2,-0.4 -52,-0.0 -0.350 118.2 23.5 -59.4 142.3 20.6 15.4 19.7 93 93 A P T 3 S+ 0 0 85 0, 0.0 2,-1.1 0, 0.0 -1,-0.4 -0.967 124.9 57.4 -78.4 6.7 18.4 16.6 21.2 94 94 A N B < S+G 91 0C 120 -3,-2.6 -3,-1.2 -54,-0.0 -2,-0.2 -0.492 76.1 177.5 -96.9 67.6 17.9 18.9 18.1 95 95 A b - 0 0 26 -2,-1.1 2,-0.4 -5,-0.2 -5,-0.1 -0.338 7.8-164.9 -65.2 148.3 17.4 16.1 15.6 96 96 A A - 0 0 19 -9,-0.2 -9,-1.7 -66,-0.0 2,-0.4 -0.995 2.1-160.7-140.0 141.2 16.6 17.2 12.1 97 97 A Y E -C 86 0A 8 -2,-0.4 2,-0.5 -11,-0.3 -70,-0.3 -0.958 19.2-139.7-128.3 147.4 15.2 15.4 9.0 98 98 A K E -C 85 0A 115 -13,-3.0 -13,-1.6 -2,-0.4 2,-0.5 -0.868 28.6-144.1 -91.7 127.7 15.0 15.6 5.3 99 99 A T E +C 84 0A 26 -2,-0.5 2,-0.4 -76,-0.4 -15,-0.2 -0.870 20.8 179.5 -96.2 129.5 11.5 14.4 4.1 100 100 A T E -C 83 0A 52 -17,-2.2 -17,-2.7 -2,-0.5 2,-0.3 -0.993 20.9-138.1-130.9 130.9 11.3 12.5 0.8 101 101 A Q E +C 82 0A 128 -2,-0.4 2,-0.3 -19,-0.2 -19,-0.2 -0.676 33.5 164.0 -86.0 137.2 8.1 11.0 -0.8 102 102 A A E -C 81 0A 27 -21,-2.3 -21,-2.7 -2,-0.3 2,-0.4 -0.945 34.6-148.3-146.5 166.7 8.4 7.6 -2.3 103 103 A N E +C 80 0A 111 -2,-0.3 2,-0.3 -23,-0.3 -23,-0.2 -0.909 43.3 137.6-135.9 110.6 6.3 4.6 -3.6 104 104 A K E -C 79 0A 79 -25,-1.5 -25,-2.7 -2,-0.4 2,-0.1 -0.903 57.4 -90.4-149.4 169.0 8.1 1.3 -3.0 105 105 A H - 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