==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-DEC-95 1BEL . COMPND 2 MOLECULE: RIBONUCLEASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR M.H.DUNG,J.A.BELL . 124 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7082.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 75 60.5 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 . 11 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 8.1 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 . 2 1.6 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 0 232 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 108.5 10.1 29.5 -16.1 2 2 A E - 0 0 94 4,-0.1 2,-0.1 3,-0.0 0, 0.0 -0.581 360.0-153.7 -77.6 127.9 9.0 32.6 -14.2 3 3 A T > - 0 0 66 -2,-0.4 4,-2.8 1,-0.1 5,-0.2 -0.454 32.6-103.8 -88.3 169.1 10.6 35.9 -15.2 4 4 A A H > S+ 0 0 54 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.902 124.7 49.9 -59.8 -39.9 11.0 38.9 -12.9 5 5 A A H > S+ 0 0 28 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.897 111.7 47.7 -64.8 -42.3 8.0 40.6 -14.7 6 6 A A H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.893 110.4 52.2 -65.8 -42.4 5.8 37.5 -14.3 7 7 A K H X S+ 0 0 91 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.906 107.3 51.9 -61.0 -44.7 6.7 37.2 -10.6 8 8 A F H X S+ 0 0 4 -4,-2.0 4,-2.3 -5,-0.2 5,-0.3 0.929 112.0 47.8 -56.6 -46.1 5.8 40.8 -10.0 9 9 A E H X S+ 0 0 62 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.950 113.3 45.8 -63.2 -50.0 2.3 40.2 -11.7 10 10 A R H < S+ 0 0 58 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.902 120.3 40.9 -57.0 -44.7 1.6 36.9 -9.7 11 11 A Q H < S+ 0 0 22 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.801 130.4 19.6 -75.5 -31.6 2.7 38.5 -6.4 12 12 A H H < S+ 0 0 9 -4,-2.3 35,-3.2 -5,-0.2 2,-0.4 0.544 93.5 94.6-121.6 -15.0 1.1 42.0 -6.8 13 13 A M B < +a 47 0A 12 -4,-2.1 35,-0.2 -5,-0.3 3,-0.1 -0.736 25.8 157.5 -93.8 134.1 -1.7 42.3 -9.4 14 14 A D > + 0 0 13 33,-2.6 3,-0.9 -2,-0.4 36,-0.1 -0.510 9.2 153.8-146.6 70.0 -5.4 41.9 -8.6 15 15 A S T 3 + 0 0 64 1,-0.2 33,-0.1 33,-0.2 35,-0.1 0.652 63.2 76.0 -71.4 -17.8 -7.2 43.7 -11.3 16 16 A S T 3 S+ 0 0 120 33,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.577 96.2 45.6 -73.1 -13.1 -10.3 41.5 -10.7 17 17 A T < - 0 0 52 -3,-0.9 3,-0.1 32,-0.1 -3,-0.1 -0.948 67.3-148.9-128.9 143.1 -11.4 43.3 -7.6 18 18 A S S S- 0 0 102 -2,-0.3 2,-0.3 1,-0.3 30,-0.2 0.699 82.4 -14.4 -84.5 -19.3 -11.6 47.1 -7.1 19 19 A A S S- 0 0 36 28,-0.1 2,-0.5 82,-0.0 -1,-0.3 -0.964 73.3 -97.0-167.7 166.4 -10.8 46.8 -3.5 20 20 A A + 0 0 13 -2,-0.3 81,-0.1 61,-0.2 61,-0.1 -0.887 36.3 168.8 -98.2 129.5 -10.6 44.3 -0.6 21 21 A S + 0 0 129 -2,-0.5 2,-0.4 80,-0.0 -1,-0.1 0.586 54.9 76.0-108.9 -27.1 -13.8 44.2 1.5 22 22 A S S > S- 0 0 63 1,-0.1 3,-1.6 2,-0.0 4,-0.3 -0.753 71.0-140.3 -96.9 142.5 -13.2 41.1 3.5 23 23 A S T 3 S+ 0 0 94 -2,-0.4 76,-0.4 1,-0.3 4,-0.3 0.650 107.3 60.1 -65.8 -17.4 -10.8 40.8 6.5 24 24 A N T 3> S+ 0 0 70 1,-0.2 4,-1.9 2,-0.1 -1,-0.3 0.377 73.9 100.8 -88.8 -5.4 -10.1 37.4 5.0 25 25 A Y H <> S+ 0 0 18 -3,-1.6 4,-3.0 1,-0.2 5,-0.3 0.936 83.1 45.5 -47.7 -57.3 -8.8 38.8 1.6 26 26 A a H > S+ 0 0 0 -4,-0.3 4,-2.9 1,-0.2 5,-0.3 0.911 108.7 55.8 -56.0 -46.1 -5.1 38.5 2.4 27 27 A N H > S+ 0 0 52 70,-0.3 4,-1.0 -4,-0.3 -1,-0.2 0.883 114.5 40.2 -55.7 -40.4 -5.5 35.0 3.8 28 28 A Q H X S+ 0 0 110 -4,-1.9 4,-2.5 -3,-0.2 -1,-0.2 0.924 117.5 44.7 -74.4 -49.9 -7.0 33.8 0.6 29 29 A M H X S+ 0 0 25 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.843 108.4 57.2 -66.1 -36.1 -4.8 35.7 -1.9 30 30 A M H <>S+ 0 0 0 -4,-2.9 5,-2.2 -5,-0.3 6,-0.3 0.921 113.0 41.2 -63.0 -40.9 -1.6 34.9 -0.2 31 31 A K H ><5S+ 0 0 154 -4,-1.0 3,-1.7 -5,-0.3 5,-0.3 0.942 114.4 50.7 -72.3 -46.7 -2.3 31.3 -0.5 32 32 A S H 3<5S+ 0 0 84 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.857 107.6 53.9 -57.3 -40.1 -3.7 31.4 -4.1 33 33 A R T 3<5S- 0 0 60 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.311 116.2-111.2 -83.0 9.1 -0.8 33.3 -5.4 34 34 A N T < 5S+ 0 0 80 -3,-1.7 3,-0.2 1,-0.1 -3,-0.2 0.914 76.2 132.2 65.4 43.6 1.7 30.7 -4.1 35 35 A L < + 0 0 11 -5,-2.2 6,-1.6 -6,-0.1 -4,-0.2 0.241 58.5 61.1-107.8 8.3 3.2 33.1 -1.4 36 36 A T + 0 0 34 -6,-0.3 2,-0.4 -5,-0.3 -1,-0.1 0.015 66.7 131.0-126.2 30.5 3.1 30.7 1.6 37 37 A K S S- 0 0 147 -3,-0.2 2,-2.0 1,-0.1 -6,-0.0 -0.741 87.7 -15.3 -85.5 130.4 5.5 27.9 0.4 38 38 A D S S+ 0 0 131 -2,-0.4 2,-0.3 2,-0.0 -1,-0.1 -0.184 141.3 18.9 72.9 -45.7 8.2 26.9 2.9 39 39 A R S S- 0 0 204 -2,-2.0 2,-0.6 54,-0.1 56,-0.0 -0.961 89.0 -98.5-145.8 161.8 7.6 30.1 4.9 40 40 A b - 0 0 11 -2,-0.3 -4,-0.2 -4,-0.1 46,-0.1 -0.758 38.9-122.6 -84.5 123.8 4.9 32.7 5.2 41 41 A K - 0 0 58 -6,-1.6 3,-0.1 -2,-0.6 45,-0.1 -0.524 25.2-146.6 -62.9 121.3 5.7 35.8 3.1 42 42 A P S S+ 0 0 77 0, 0.0 44,-2.7 0, 0.0 2,-0.3 0.855 70.4 11.3 -64.4 -38.4 5.7 38.5 5.8 43 43 A V E + B 0 85A 60 42,-0.2 2,-0.3 54,-0.1 42,-0.2 -0.999 65.4 163.1-143.4 143.6 4.5 41.4 3.9 44 44 A N E - B 0 84A 4 40,-2.2 40,-2.9 -2,-0.3 2,-0.4 -0.978 21.5-145.2-160.7 148.5 2.9 41.8 0.5 45 45 A T E - B 0 83A 10 -2,-0.3 2,-0.4 38,-0.2 38,-0.2 -0.985 6.8-157.9-122.9 135.6 0.9 44.4 -1.4 46 46 A F E - B 0 82A 0 36,-2.6 36,-2.5 -2,-0.4 2,-0.5 -0.898 11.0-147.2-110.5 135.1 -1.9 43.8 -4.0 47 47 A V E -aB 13 81A 0 -35,-3.2 -33,-2.6 -2,-0.4 2,-0.9 -0.937 3.2-156.0-108.3 123.9 -2.8 46.5 -6.6 48 48 A H + 0 0 9 32,-3.1 32,-0.3 -2,-0.5 2,-0.3 -0.529 60.7 94.5 -97.1 62.2 -6.4 46.8 -7.8 49 49 A E S S- 0 0 54 -2,-0.9 -35,-0.3 30,-0.1 -2,-0.1 -0.923 83.4 -76.7-142.7 166.4 -5.7 48.5 -11.1 50 50 A S > - 0 0 48 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.324 36.9-121.4 -68.5 149.5 -5.3 47.4 -14.7 51 51 A L H > S+ 0 0 64 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.904 115.3 53.0 -54.4 -45.7 -2.0 45.8 -15.7 52 52 A A H > S+ 0 0 64 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.836 108.0 51.5 -60.7 -35.4 -1.6 48.6 -18.4 53 53 A D H 4 S+ 0 0 87 -3,-0.3 4,-0.3 2,-0.2 -1,-0.2 0.839 111.8 45.3 -71.4 -34.8 -2.1 51.3 -15.7 54 54 A V H >< S+ 0 0 1 -4,-2.0 3,-1.4 1,-0.2 4,-0.4 0.882 111.3 52.8 -74.3 -40.6 0.5 49.8 -13.4 55 55 A Q H >< S+ 0 0 71 -4,-2.6 3,-1.5 1,-0.3 -2,-0.2 0.870 99.7 64.2 -61.9 -34.0 3.0 49.3 -16.3 56 56 A A G >< S+ 0 0 39 -4,-1.4 3,-1.6 1,-0.3 -1,-0.3 0.671 83.6 76.9 -63.1 -20.7 2.5 53.0 -17.2 57 57 A V G X S+ 0 0 0 -3,-1.4 3,-2.3 1,-0.3 -1,-0.3 0.795 77.4 75.3 -60.4 -28.2 4.0 53.9 -13.8 58 58 A c G < S+ 0 0 9 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.529 99.9 41.9 -62.2 -9.9 7.4 53.1 -15.4 59 59 A S G < S+ 0 0 99 -3,-1.6 -1,-0.3 -4,-0.1 -2,-0.2 0.135 104.3 86.7-119.7 15.4 7.2 56.4 -17.3 60 60 A Q S < S- 0 0 45 -3,-2.3 2,-0.6 1,-0.2 15,-0.2 0.352 92.7 -16.3 -90.7-138.3 5.9 58.4 -14.3 61 61 A K E -D 74 0B 99 13,-1.7 13,-3.1 1,-0.1 2,-0.3 -0.593 64.5-138.8 -76.7 111.6 7.7 60.2 -11.5 62 62 A N E +D 73 0B 94 -2,-0.6 2,-0.3 11,-0.2 11,-0.3 -0.552 34.4 164.2 -71.9 128.1 11.3 59.0 -11.2 63 63 A V E -D 72 0B 28 9,-2.7 9,-1.1 -2,-0.3 2,-0.2 -0.913 41.6 -90.4-137.4 164.4 12.4 58.5 -7.6 64 64 A A - 0 0 73 -2,-0.3 6,-0.2 7,-0.1 2,-0.1 -0.527 41.5-123.9 -75.6 143.3 15.1 56.8 -5.7 65 65 A d > - 0 0 7 4,-3.3 3,-2.1 -2,-0.2 -1,-0.1 -0.447 26.9-107.2 -79.9 163.8 14.5 53.2 -4.7 66 66 A K T 3 S+ 0 0 170 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.775 121.7 56.9 -64.5 -21.4 14.8 52.3 -1.0 67 67 A N T 3 S- 0 0 107 2,-0.0 -1,-0.3 1,-0.0 3,-0.1 0.310 125.7-100.1 -88.8 8.8 18.0 50.5 -1.8 68 68 A G S < S+ 0 0 59 -3,-2.1 -2,-0.1 1,-0.3 -1,-0.0 0.249 79.3 137.0 92.2 -14.0 19.6 53.7 -3.3 69 69 A Q - 0 0 92 1,-0.1 -4,-3.3 -5,-0.1 -1,-0.3 -0.175 51.9-141.8 -64.9 159.1 18.9 52.7 -7.0 70 70 A T S S+ 0 0 109 -6,-0.2 -1,-0.1 1,-0.2 -7,-0.1 0.379 78.9 89.5-104.1 4.8 17.6 55.2 -9.4 71 71 A N + 0 0 23 -9,-0.1 39,-2.6 2,-0.0 2,-0.3 -0.004 61.1 114.7 -96.1 35.3 15.3 53.0 -11.4 72 72 A d E -DE 63 109B 0 -9,-1.1 -9,-2.7 -3,-0.3 2,-0.4 -0.794 43.8-166.4-104.3 146.6 12.2 53.6 -9.3 73 73 A Y E -DE 62 108B 36 35,-2.3 35,-2.2 -2,-0.3 2,-0.4 -0.993 7.8-149.9-133.9 140.8 9.0 55.3 -10.3 74 74 A Q E -DE 61 107B 35 -13,-3.1 -13,-1.7 -2,-0.4 33,-0.2 -0.894 25.1-114.9-111.2 136.1 6.1 56.7 -8.4 75 75 A S - 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C 0 97A 65 -44,-2.7 11,-0.3 -2,-0.4 2,-0.1 -0.329 38.3-125.7 -59.2 136.5 1.6 38.6 8.8 87 87 A T > - 0 0 45 9,-2.2 3,-0.9 1,-0.1 9,-0.2 -0.328 21.9-105.5 -78.9 167.8 -0.1 38.7 12.2 88 88 A G T 3 S+ 0 0 95 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 0.507 122.0 46.5 -70.1 -8.2 1.5 38.2 15.6 89 89 A S T 3 S+ 0 0 101 7,-0.1 -1,-0.2 2,-0.0 -3,-0.0 0.403 80.4 124.9-112.4 -5.2 -0.1 34.7 15.8 90 90 A S < + 0 0 20 -3,-0.9 2,-0.3 6,-0.2 5,-0.2 -0.333 33.6 176.1 -58.0 132.1 0.8 33.5 12.3 91 91 A K B > -G 94 0C 155 3,-2.1 3,-2.5 -52,-0.0 -52,-0.0 -0.851 33.7 -87.1-149.6 107.8 2.6 30.2 12.4 92 92 A Y T 3 S+ 0 0 107 1,-0.4 -53,-0.0 -2,-0.3 -56,-0.0 -0.183 115.0 25.3 -46.9 135.4 3.6 28.3 9.2 93 93 A P T 3 S+ 0 0 93 0, 0.0 2,-1.5 0, 0.0 -1,-0.4 -0.987 123.7 59.9 -85.7 2.6 1.9 26.3 7.8 94 94 A N B < S-G 91 0C 126 -3,-2.5 -3,-2.1 -54,-0.0 2,-0.2 -0.575 78.4-172.9 -89.0 71.6 -0.9 28.2 9.3 95 95 A b - 0 0 25 -2,-1.5 2,-0.4 -5,-0.2 -64,-0.1 -0.440 0.4-169.7 -67.2 131.1 -0.1 31.6 7.7 96 96 A A - 0 0 27 -2,-0.2 -9,-2.2 -9,-0.2 2,-0.4 -0.987 2.3-170.2-129.2 136.5 -2.3 34.5 9.0 97 97 A Y E -C 86 0A 10 -2,-0.4 2,-0.5 -11,-0.3 -70,-0.3 -0.956 21.8-135.2-132.3 145.3 -2.6 38.0 7.6 98 98 A K E -C 85 0A 106 -13,-3.0 -13,-1.7 -2,-0.4 2,-0.5 -0.830 26.6-142.7 -93.8 130.3 -4.0 41.3 8.5 99 99 A T E -C 84 0A 28 -2,-0.5 2,-0.4 -76,-0.4 -15,-0.2 -0.844 19.5-179.1 -97.5 123.5 -5.8 42.9 5.5 100 100 A T E -C 83 0A 57 -17,-2.5 -17,-2.8 -2,-0.5 2,-0.4 -0.966 8.6-161.3-126.9 119.2 -5.5 46.7 5.1 101 101 A Q E +C 82 0A 62 -2,-0.4 2,-0.3 -19,-0.2 -19,-0.2 -0.779 26.6 138.6 -97.2 140.8 -7.2 48.5 2.3 102 102 A A E -C 81 0A 29 -21,-2.2 -21,-2.9 -2,-0.4 2,-0.6 -0.983 51.4-108.6-167.5 169.3 -6.2 52.1 1.2 103 103 A N E +C 80 0A 109 -2,-0.3 2,-0.3 -23,-0.2 -23,-0.2 -0.946 51.9 150.9-111.5 107.6 -5.5 54.5 -1.7 104 104 A K E -C 79 0A 83 -25,-2.0 -25,-3.1 -2,-0.6 2,-0.3 -0.935 49.6-104.9-133.0 161.0 -1.8 55.2 -1.9 105 105 A H - 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