==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-NOV-05 2F5W . COMPND 2 MOLECULE: RIBONUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AMYLOLIQUEFACIENS; . AUTHOR T.PRANGE,M.SALEM . 324 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17440.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 54.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 18.5 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 . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 46 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 3 0 3 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 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 . 0 3 0 6 3 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 3 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 V 0 0 130 0, 0.0 2,-0.6 0, 0.0 46,-0.0 0.000 360.0 360.0 360.0 116.9 -5.1 15.6 -6.7 2 2 A I + 0 0 63 1,-0.1 19,-0.1 5,-0.1 0, 0.0 -0.914 360.0 137.3-100.8 108.2 -2.9 12.7 -5.4 3 3 A N + 0 0 25 -2,-0.6 72,-3.2 71,-0.1 2,-0.3 0.048 31.8 111.5-148.8 33.7 -1.3 10.9 -8.4 4 4 A T S > S- 0 0 66 70,-0.2 4,-2.6 1,-0.1 5,-0.4 -0.738 74.6-114.3-104.5 157.4 2.3 10.3 -7.5 5 5 A F H > S+ 0 0 28 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.925 117.0 39.3 -54.1 -49.3 3.8 6.8 -6.8 6 6 A D H > S+ 0 0 98 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.906 116.1 50.3 -70.2 -45.6 4.5 7.6 -3.2 7 7 A G H > S+ 0 0 23 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.915 116.7 39.7 -55.9 -51.3 1.2 9.5 -2.5 8 8 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.907 113.9 54.3 -73.4 -39.6 -1.0 6.9 -4.0 9 9 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 -5,-0.4 -2,-0.2 0.940 113.1 42.9 -58.0 -47.7 1.0 4.0 -2.5 10 10 A D H X S+ 0 0 80 -4,-2.9 4,-1.7 1,-0.2 5,-0.3 0.936 113.0 52.4 -63.3 -45.8 0.7 5.5 1.0 11 11 A Y H X>S+ 0 0 46 -4,-2.3 4,-2.3 -5,-0.2 5,-0.6 0.898 109.9 49.8 -58.3 -39.1 -3.0 6.4 0.5 12 12 A L H X5S+ 0 0 0 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.916 109.8 47.8 -68.4 -42.2 -3.8 2.8 -0.6 13 13 A Q H <5S+ 0 0 66 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.803 120.8 38.6 -69.4 -30.8 -2.1 1.1 2.3 14 14 A T H <5S+ 0 0 82 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.931 131.1 21.2 -80.9 -60.6 -3.7 3.4 4.9 15 15 A Y H <5S- 0 0 121 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.639 92.7-134.4 -93.3 -14.1 -7.3 4.0 3.6 16 16 A H S < - 0 0 4 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.254 43.6-100.8 -61.7 158.6 -8.0 8.7 -3.8 20 20 A D T 3 S+ 0 0 135 1,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.521 112.4 78.7 -69.6 -3.5 -11.2 10.3 -5.2 21 21 A N T 3 S+ 0 0 7 -19,-0.1 27,-2.2 26,-0.1 2,-0.4 0.395 79.5 95.0 -82.4 8.8 -9.5 11.5 -8.4 22 22 A Y E < +a 48 0A 19 -3,-1.5 2,-0.3 25,-0.2 27,-0.2 -0.807 46.9 175.1-107.0 142.6 -9.6 8.0 -9.8 23 23 A I E -a 49 0A 18 25,-2.7 27,-2.2 -2,-0.4 29,-0.2 -0.985 30.3-114.6-134.7 149.9 -12.1 6.5 -12.2 24 24 A T > - 0 0 32 -2,-0.3 4,-2.4 25,-0.2 5,-0.2 -0.311 33.2-108.4 -76.8 167.6 -12.2 3.1 -13.9 25 25 A K H > S+ 0 0 61 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.924 121.0 56.2 -62.1 -40.8 -12.0 2.8 -17.7 26 26 A S H > S+ 0 0 85 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.893 108.7 45.0 -48.2 -53.1 -15.7 1.8 -17.7 27 27 A E H > S+ 0 0 103 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.884 113.1 51.6 -61.9 -47.9 -16.7 5.0 -15.8 28 28 A A H ><>S+ 0 0 0 -4,-2.4 5,-2.3 1,-0.2 3,-0.6 0.917 108.1 51.4 -61.2 -44.4 -14.5 7.1 -18.1 29 29 A Q H ><5S+ 0 0 124 -4,-3.1 3,-2.1 1,-0.2 -2,-0.2 0.922 105.4 55.0 -61.3 -42.5 -16.1 5.6 -21.2 30 30 A A H 3<5S+ 0 0 90 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.780 105.2 55.1 -59.9 -27.0 -19.6 6.4 -20.0 31 31 A L T <<5S- 0 0 86 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.336 131.0 -92.6 -88.2 4.7 -18.5 10.0 -19.6 32 32 A G T < 5 + 0 0 38 -3,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.644 67.0 161.7 95.0 16.7 -17.4 10.1 -23.2 33 33 A W < - 0 0 24 -5,-2.3 2,-0.5 -6,-0.1 -1,-0.3 -0.541 19.1-167.4 -69.6 134.0 -13.7 9.2 -23.0 34 34 A V >>> - 0 0 56 -2,-0.3 3,-1.9 1,-0.2 5,-1.1 -0.958 10.1-158.6-120.7 109.1 -12.3 8.1 -26.3 35 35 A A G >45S+ 0 0 57 -2,-0.5 3,-1.0 1,-0.3 46,-0.2 0.877 93.0 56.2 -55.3 -41.3 -8.9 6.4 -25.8 36 36 A S G 345S+ 0 0 109 1,-0.3 -1,-0.3 -3,-0.1 44,-0.1 0.615 109.7 45.3 -66.0 -16.1 -7.9 7.1 -29.4 37 37 A K G <45S- 0 0 154 -3,-1.9 -1,-0.3 42,-0.1 -2,-0.2 0.484 98.2-137.0-102.4 -10.4 -8.6 10.9 -29.0 38 38 A G T <<5 + 0 0 9 -3,-1.0 41,-0.4 -4,-0.9 3,-0.3 0.862 56.4 140.9 56.3 41.2 -6.7 11.1 -25.7 39 39 A N >>< + 0 0 25 -5,-1.1 3,-1.6 1,-0.2 4,-1.5 0.226 16.0 118.7-103.3 17.6 -9.5 13.3 -24.4 40 40 A L H 3> S+ 0 0 0 39,-0.4 4,-2.3 1,-0.3 7,-0.2 0.849 76.8 54.1 -52.6 -39.9 -9.9 12.2 -20.8 41 41 A A H 34 S+ 0 0 27 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.749 106.2 53.6 -67.8 -23.5 -9.0 15.6 -19.4 42 42 A D H <4 S+ 0 0 138 -3,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.836 119.5 30.7 -75.1 -37.1 -11.8 17.2 -21.5 43 43 A V H < S+ 0 0 47 -4,-1.5 -2,-0.2 1,-0.2 -3,-0.1 0.669 138.8 19.6-100.8 -15.0 -14.5 15.0 -20.3 44 44 A A S >< S- 0 0 7 -4,-2.3 3,-2.3 -5,-0.3 -1,-0.2 -0.429 80.1-166.0-151.3 63.4 -13.3 14.3 -16.8 45 45 A P T 3 S+ 0 0 78 0, 0.0 3,-0.1 0, 0.0 -4,-0.1 -0.177 75.9 20.7 -58.1 143.4 -10.8 17.0 -15.9 46 46 A G T 3 S+ 0 0 48 31,-0.4 2,-0.2 1,-0.3 -5,-0.1 0.306 102.1 115.1 80.5 -14.2 -8.7 16.2 -12.8 47 47 A K < - 0 0 71 -3,-2.3 2,-0.3 -7,-0.2 -1,-0.3 -0.581 44.9-166.3 -91.7 157.5 -9.4 12.5 -13.1 48 48 A S E -a 22 0A 3 -27,-2.2 -25,-2.7 -2,-0.2 2,-0.3 -0.943 30.3-105.8-129.0 152.4 -7.0 9.6 -13.8 49 49 A I E +a 23 0A 1 -2,-0.3 24,-2.9 -27,-0.2 2,-0.3 -0.608 60.3 127.2 -75.1 138.1 -7.9 6.0 -14.8 50 50 A G E +B 72 0B 3 -27,-2.2 22,-0.3 -2,-0.3 3,-0.1 -0.869 29.1 65.9 177.0 155.1 -7.4 3.5 -12.0 51 51 A G E + 0 0 11 20,-3.5 21,-0.2 1,-0.4 -27,-0.1 0.232 63.6 133.7 108.6 -7.9 -9.0 0.7 -10.0 52 52 A D E -B 71 0B 32 19,-0.5 19,-1.9 -29,-0.2 -1,-0.4 -0.419 64.1 -97.4 -75.1 153.0 -9.4 -1.8 -12.8 53 53 A I E -B 70 0B 88 17,-0.2 2,-0.5 -2,-0.1 17,-0.3 -0.381 30.2-145.5 -64.0 136.0 -8.4 -5.4 -12.3 54 54 A F E -B 69 0B 29 15,-3.4 15,-0.5 -2,-0.1 -1,-0.0 -0.938 2.5-153.3-107.9 124.6 -5.0 -6.4 -13.6 55 55 A S - 0 0 92 -2,-0.5 -1,-0.1 13,-0.1 4,-0.1 0.692 8.9-154.5 -81.5 -16.2 -5.0 -9.9 -14.9 56 56 A N > + 0 0 26 1,-0.1 3,-1.7 2,-0.1 -1,-0.1 0.868 30.6 162.0 52.1 39.0 -1.3 -10.6 -14.4 57 57 A R T 3 S+ 0 0 208 1,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.828 71.4 55.4 -64.3 -32.1 -1.4 -13.2 -17.2 58 58 A E T 3 S- 0 0 108 1,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.437 105.8-135.9 -78.8 0.4 2.4 -13.1 -17.5 59 59 A G < + 0 0 50 -3,-1.7 4,-0.2 1,-0.1 -2,-0.1 0.786 59.8 139.0 51.8 31.4 2.4 -14.0 -13.8 60 60 A K + 0 0 103 2,-0.1 -1,-0.1 43,-0.0 44,-0.1 0.851 54.0 69.6 -74.0 -33.1 5.1 -11.4 -13.2 61 61 A L S S- 0 0 3 1,-0.1 8,-0.0 -5,-0.0 34,-0.0 -0.658 105.4 -90.0 -86.0 144.7 3.5 -10.2 -9.9 62 62 A P - 0 0 48 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.256 46.8-142.9 -57.6 128.1 3.5 -12.6 -7.0 63 63 A G + 0 0 63 -4,-0.2 2,-0.2 -3,-0.0 5,-0.1 -0.491 24.3 168.8 -92.0 163.4 0.4 -14.8 -7.0 64 64 A K > - 0 0 133 3,-0.3 3,-3.3 -2,-0.2 0, 0.0 -0.848 43.9 -94.3-172.6 132.5 -1.6 -16.1 -4.0 65 65 A S T 3 S+ 0 0 123 1,-0.3 3,-0.1 -2,-0.2 -2,-0.0 -0.278 116.1 14.0 -54.7 128.2 -5.0 -17.8 -3.6 66 66 A G T 3 S+ 0 0 74 1,-0.3 2,-0.5 24,-0.0 -1,-0.3 0.301 97.5 130.6 87.1 -11.2 -7.5 -15.1 -3.0 67 67 A R < - 0 0 43 -3,-3.3 2,-0.4 22,-0.1 -3,-0.3 -0.708 36.5-170.4 -88.0 129.8 -5.1 -12.4 -4.1 68 68 A T - 0 0 62 -2,-0.5 22,-1.5 -3,-0.1 2,-0.4 -0.943 9.1-149.0-113.1 130.6 -6.4 -9.8 -6.6 69 69 A W E -BC 54 89B 10 -15,-0.5 -15,-3.4 -2,-0.4 2,-0.3 -0.878 16.1-179.7-103.4 134.3 -4.2 -7.3 -8.4 70 70 A R E -BC 53 88B 103 18,-2.4 18,-2.4 -2,-0.4 2,-0.3 -0.787 10.1-149.1-124.9 169.1 -5.5 -3.8 -9.5 71 71 A E E -BC 52 87B 15 -19,-1.9 -20,-3.5 -2,-0.3 -19,-0.5 -0.924 9.5-172.2-137.0 159.8 -3.8 -0.9 -11.3 72 72 A A E -BC 50 86B 0 14,-1.8 14,-2.7 -2,-0.3 -22,-0.3 -0.975 31.3-107.6-151.2 149.5 -4.0 2.8 -11.5 73 73 A D E - C 0 85B 0 -24,-2.9 2,-0.3 -2,-0.3 12,-0.2 -0.536 33.1-155.1 -77.6 141.2 -2.3 5.4 -13.7 74 74 A I + 0 0 0 10,-2.4 10,-0.4 -2,-0.2 -70,-0.2 -0.896 67.7 9.2-118.2 148.5 0.4 7.5 -12.1 75 75 A N S S+ 0 0 72 -72,-3.2 2,-0.3 -2,-0.3 -1,-0.2 0.646 83.1 153.2 62.1 20.3 1.6 11.0 -13.1 76 76 A Y + 0 0 8 -73,-0.2 -1,-0.2 1,-0.2 3,-0.1 -0.642 8.4 151.6 -81.1 138.4 -1.3 11.5 -15.6 77 77 A T - 0 0 110 1,-0.4 -31,-0.4 -2,-0.3 2,-0.3 0.634 61.4 -28.0-126.4 -49.8 -2.4 15.1 -16.3 78 78 A S S S+ 0 0 77 2,-0.2 -1,-0.4 -33,-0.1 2,-0.1 -0.977 95.9 30.5-163.3 164.0 -3.9 15.4 -19.8 79 79 A G S S- 0 0 29 -41,-0.4 -39,-0.4 -2,-0.3 -38,-0.2 -0.457 102.4 -2.4 84.5-156.7 -3.8 13.9 -23.2 80 80 A F S S- 0 0 136 -2,-0.1 -2,-0.2 1,-0.1 -44,-0.1 -0.309 88.3 -91.9 -63.8 149.4 -3.0 10.2 -24.0 81 81 A R - 0 0 65 -46,-0.2 -1,-0.1 1,-0.1 2,-0.1 -0.293 40.0-135.0 -65.7 152.6 -2.2 7.9 -21.1 82 82 A N - 0 0 42 2,-0.2 -1,-0.1 -8,-0.2 -6,-0.1 -0.149 24.4-102.0 -94.4-167.9 1.5 7.5 -20.1 83 83 A S S S+ 0 0 38 15,-0.2 17,-1.8 -2,-0.1 2,-0.5 0.332 83.0 109.6-101.7 7.4 3.4 4.3 -19.3 84 84 A D + 0 0 27 -10,-0.4 -10,-2.4 14,-0.2 2,-0.4 -0.752 39.9 165.7 -91.6 120.8 3.4 4.7 -15.5 85 85 A R E -CD 73 97B 4 12,-2.9 12,-2.6 -2,-0.5 2,-0.4 -0.991 30.1-145.0-136.0 144.8 1.2 2.4 -13.4 86 86 A I E -CD 72 96B 0 -14,-2.7 -14,-1.8 -2,-0.4 2,-0.5 -0.877 18.6-159.2 -98.9 136.0 0.9 1.5 -9.7 87 87 A L E +CD 71 95B 0 8,-2.7 8,-3.1 -2,-0.4 2,-0.4 -0.981 14.0 179.7-117.4 125.2 -0.0 -2.2 -9.2 88 88 A Y E -CD 70 94B 17 -18,-2.4 -18,-2.4 -2,-0.5 6,-0.2 -0.993 14.8-146.0-137.2 134.7 -1.6 -3.1 -5.8 89 89 A S E > -C 69 0B 1 4,-2.2 3,-1.8 -2,-0.4 -20,-0.2 -0.377 33.4-106.3 -89.9 167.5 -2.9 -6.3 -4.4 90 90 A S T 3 S+ 0 0 63 -22,-1.5 -21,-0.1 1,-0.3 -1,-0.1 0.676 123.9 54.3 -65.9 -13.1 -5.7 -7.0 -2.0 91 91 A D T 3 S- 0 0 67 -23,-0.2 -1,-0.3 2,-0.1 -24,-0.0 0.158 123.5-107.2-109.9 22.9 -3.1 -7.6 0.7 92 92 A W < + 0 0 64 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.579 63.6 153.8 62.6 25.8 -1.6 -4.2 -0.1 93 93 A L - 0 0 36 14,-0.0 -4,-2.2 13,-0.0 2,-0.5 -0.634 30.7-154.5 -62.6 131.5 1.6 -5.2 -1.8 94 94 A I E +D 88 0B 0 14,-1.8 13,-2.8 -2,-0.3 14,-1.8 -0.970 18.3 172.8-123.2 124.7 2.5 -2.2 -4.0 95 95 A Y E -DE 87 106B 42 -8,-3.1 -8,-2.7 -2,-0.5 2,-0.4 -0.852 15.8-145.7-119.8 159.1 4.5 -2.5 -7.2 96 96 A K E -DE 86 105B 68 9,-2.8 9,-1.8 -2,-0.3 2,-0.4 -0.951 10.3-171.8-127.3 154.3 5.3 0.0 -9.8 97 97 A T E +D 85 0B 1 -12,-2.6 -12,-2.9 -2,-0.4 7,-0.1 -0.996 14.0 174.5-136.1 140.5 5.9 -0.0 -13.6 98 98 A T S S+ 0 0 69 -2,-0.4 -14,-0.2 5,-0.3 -15,-0.2 0.067 78.7 63.7-119.9 13.2 7.1 2.8 -15.8 99 99 A D S > S- 0 0 42 4,-0.4 3,-0.6 -14,-0.1 -15,-0.1 -0.077 119.3 -86.6-137.1 39.9 7.3 0.7 -18.9 100 100 A H T 3 S- 0 0 98 -17,-1.8 -16,-0.1 1,-0.2 -17,-0.0 0.928 86.2 -52.1 57.4 54.2 3.8 -0.5 -19.6 101 101 A Y T 3 S+ 0 0 45 -18,-0.4 -1,-0.2 2,-0.2 3,-0.1 0.713 111.0 111.9 65.3 21.0 3.6 -3.6 -17.5 102 102 A Q S < S+ 0 0 122 -3,-0.6 2,-0.4 1,-0.3 -2,-0.1 0.895 83.1 20.3 -85.7 -53.3 6.8 -5.1 -18.9 103 103 A T - 0 0 80 -4,-0.0 -4,-0.4 2,-0.0 2,-0.4 -0.931 69.8-168.0-118.9 143.6 8.9 -4.8 -15.7 104 104 A F - 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