==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 14-JUN-10 3NGZ . COMPND 2 MOLECULE: RIBONUCLEASE T; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.-Y.HSIAO,H.S.YUAN . 413 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18655.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 278 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 9.2 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 . 2 0.5 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 . 11 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 2 0 0 4 0 2 0 0 0 0 1 1 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 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 . 0 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 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 8 A T 0 0 108 0, 0.0 2,-0.3 0, 0.0 42,-0.3 0.000 360.0 360.0 360.0 19.3 -41.2 -12.4 27.5 2 9 A G >> - 0 0 26 1,-0.1 4,-1.2 40,-0.1 3,-0.8 -0.686 360.0-130.4 -94.1 145.1 -42.9 -12.3 24.1 3 10 A L H 3> S+ 0 0 17 -2,-0.3 4,-0.9 1,-0.2 3,-0.4 0.887 110.0 53.7 -57.2 -41.0 -41.4 -13.8 21.0 4 11 A C H 34>S+ 0 0 37 99,-0.4 5,-1.5 1,-0.2 -1,-0.2 0.727 107.7 51.4 -68.7 -24.1 -42.0 -10.5 19.0 5 12 A D H X45S+ 0 0 107 -3,-0.8 3,-0.8 3,-0.2 -1,-0.2 0.748 98.4 69.2 -78.5 -27.9 -40.1 -8.6 21.7 6 13 A R H 3<5S+ 0 0 4 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.1 0.890 112.9 19.4 -65.4 -44.9 -37.1 -10.9 21.6 7 14 A F T ><5S- 0 0 1 -4,-0.9 3,-2.3 3,-0.3 -1,-0.3 -0.359 115.1 -91.1-124.7 54.5 -35.7 -10.0 18.1 8 15 A R T < 5S- 0 0 80 -3,-0.8 -3,-0.2 353,-0.3 3,-0.1 0.811 93.7 -43.8 33.4 46.8 -37.2 -6.6 17.4 9 16 A G T 3 - 0 0 75 1,-0.2 4,-2.7 -3,-0.1 -3,-0.1 -0.762 52.3-167.6 -94.6 111.6 -24.8 -22.9 -7.0 24 31 A A T 4 S+ 0 0 17 -2,-0.8 -1,-0.2 1,-0.2 5,-0.0 0.781 87.9 50.3 -64.8 -29.2 -28.2 -21.5 -5.7 25 32 A K T 4 S+ 0 0 169 1,-0.1 -1,-0.2 3,-0.0 -2,-0.0 0.882 126.1 18.9 -76.4 -38.6 -29.1 -20.2 -9.1 26 33 A T T 4 S+ 0 0 70 -3,-0.1 36,-2.9 35,-0.1 2,-0.2 0.647 102.8 86.5-112.1 -20.6 -28.5 -23.3 -11.2 27 34 A D B < S-f 62 0B 6 -4,-2.7 36,-0.2 34,-0.2 -6,-0.1 -0.614 78.9-102.7 -93.5 148.0 -28.4 -26.4 -8.9 28 35 A A - 0 0 0 34,-2.1 -8,-2.5 -2,-0.2 2,-0.5 -0.293 20.6-133.9 -66.6 143.1 -31.5 -28.4 -7.8 29 36 A L E +B 19 0A 3 -10,-0.2 -10,-0.2 27,-0.2 29,-0.2 -0.857 29.3 174.4 -86.3 134.0 -33.0 -28.0 -4.4 30 37 A L E + 0 0 0 -12,-2.9 25,-3.8 -2,-0.5 2,-0.3 0.669 57.2 12.1-117.7 -30.5 -33.6 -31.6 -3.2 31 38 A E E +BC 18 54A 19 -13,-2.0 -13,-1.9 23,-0.3 -1,-0.4 -0.992 55.7 178.7-145.4 151.3 -34.9 -31.3 0.4 32 39 A I E -BC 17 53A 1 21,-1.9 21,-2.1 -2,-0.3 2,-0.3 -0.947 1.1-179.0-152.7 136.4 -36.1 -28.6 2.7 33 40 A A E -BC 16 52A 0 -17,-2.0 -17,-1.6 -2,-0.3 2,-0.3 -0.942 6.4-165.4-129.5 154.7 -37.4 -28.6 6.3 34 41 A A E -BC 15 51A 3 17,-2.4 17,-2.4 -2,-0.3 2,-0.5 -0.998 6.4-170.7-144.8 134.4 -38.6 -25.7 8.4 35 42 A I E -BC 14 50A 2 -21,-2.6 -21,-2.8 -2,-0.3 15,-0.2 -0.974 11.1-155.1-129.3 116.7 -39.3 -25.4 12.2 36 43 A T E -B 13 0A 4 13,-2.2 12,-3.6 -2,-0.5 2,-0.3 -0.483 16.9-138.5 -80.1 159.8 -41.1 -22.4 13.6 37 44 A L E - C 0 47A 1 -25,-0.9 2,-0.3 10,-0.3 12,-0.1 -0.798 16.1-170.5-121.5 160.2 -40.4 -21.4 17.2 38 45 A K E - C 0 46A 96 8,-3.0 8,-2.8 -2,-0.3 2,-0.4 -0.962 15.4-135.5-142.4 160.2 -42.5 -20.2 20.1 39 46 A M E - C 0 45A 34 -2,-0.3 6,-0.2 6,-0.2 -36,-0.2 -0.955 18.8-132.9-115.9 139.5 -41.9 -18.8 23.6 40 47 A D > - 0 0 56 4,-2.1 3,-1.8 -2,-0.4 -37,-0.0 -0.179 41.8 -87.7 -77.3-179.3 -43.7 -19.8 26.7 41 48 A E T 3 S+ 0 0 158 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.746 129.6 55.0 -66.1 -20.9 -45.2 -17.3 29.2 42 49 A Q T 3 S- 0 0 97 2,-0.1 -1,-0.3 -40,-0.0 -40,-0.1 0.505 121.8-105.5 -89.5 -4.1 -41.8 -17.2 31.0 43 50 A G < + 0 0 3 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.595 68.2 147.6 94.7 12.5 -40.0 -16.3 27.9 44 51 A W - 0 0 50 151,-0.0 -4,-2.1 1,-0.0 2,-0.4 -0.623 42.0-131.5 -82.0 140.2 -38.3 -19.7 27.1 45 52 A L E +C 39 0A 3 143,-0.3 -6,-0.2 -2,-0.3 147,-0.1 -0.757 36.1 153.1 -98.7 135.0 -37.8 -20.5 23.4 46 53 A M E -C 38 0A 62 -8,-2.8 -8,-3.0 -2,-0.4 139,-0.1 -0.972 46.3 -76.6-153.1 164.8 -38.8 -23.8 21.9 47 54 A P E +C 37 0A 55 0, 0.0 -10,-0.3 0, 0.0 3,-0.1 -0.310 41.0 174.0 -64.7 146.4 -39.8 -25.5 18.6 48 55 A D E + 0 0 76 -12,-3.6 2,-0.4 1,-0.4 -11,-0.2 0.549 57.5 13.3-114.6 -91.1 -43.4 -25.0 17.4 49 56 A T E - 0 0 55 -12,-0.1 -13,-2.2 46,-0.1 2,-0.4 -0.746 62.7-157.3 -97.8 139.3 -44.4 -26.3 14.0 50 57 A T E +C 35 0A 66 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.2 -0.943 13.1 174.1-115.8 135.6 -42.3 -28.7 11.9 51 58 A L E +C 34 0A 29 -17,-2.4 -17,-2.4 -2,-0.4 2,-0.3 -0.976 1.9 178.0-135.1 151.0 -42.4 -29.2 8.1 52 59 A H E -C 33 0A 109 -2,-0.3 2,-0.3 -19,-0.3 -19,-0.2 -0.986 1.3-178.6-157.1 143.6 -40.3 -31.3 5.8 53 60 A F E -C 32 0A 41 -21,-2.1 -21,-1.9 -2,-0.3 2,-0.5 -0.999 27.7-138.6-146.0 139.8 -40.2 -32.1 2.1 54 61 A H E -Cd 31 82A 75 27,-0.6 29,-2.6 -2,-0.3 2,-0.5 -0.872 39.1-143.2 -86.0 132.3 -38.4 -34.1 -0.5 55 62 A V E - d 0 83A 3 -25,-3.8 29,-0.2 -2,-0.5 27,-0.1 -0.863 4.4-131.8-111.1 131.4 -38.1 -31.7 -3.5 56 63 A E - 0 0 103 27,-2.9 29,-0.3 -2,-0.5 -27,-0.2 -0.559 40.0-101.1 -72.5 135.8 -38.3 -32.6 -7.1 57 64 A P - 0 0 26 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.420 43.1-112.2 -61.0 130.5 -35.5 -31.1 -9.2 58 65 A F > - 0 0 51 -29,-0.2 3,-2.4 1,-0.1 2,-0.3 -0.232 41.1 -85.5 -63.6 152.1 -36.8 -28.0 -11.0 59 66 A V T 3 S+ 0 0 151 1,-0.3 -1,-0.1 -31,-0.0 0, 0.0 -0.421 118.8 17.9 -62.7 121.4 -37.0 -28.1 -14.8 60 67 A G T 3 S+ 0 0 77 1,-0.3 -1,-0.3 -2,-0.3 -2,-0.1 0.406 92.7 152.0 96.2 1.1 -33.6 -27.1 -16.2 61 68 A A < - 0 0 19 -3,-2.4 2,-0.3 1,-0.1 -1,-0.3 -0.320 42.2-131.2 -65.9 144.0 -31.8 -27.8 -13.0 62 69 A N B -f 27 0B 67 -36,-2.9 -34,-2.1 2,-0.0 2,-0.4 -0.733 17.0-159.2 -87.6 146.8 -28.2 -28.8 -12.9 63 70 A L - 0 0 58 -2,-0.3 -42,-0.2 -36,-0.2 3,-0.1 -0.956 7.4-147.0-130.7 112.8 -27.3 -31.9 -10.8 64 71 A Q >> - 0 0 85 -44,-2.8 4,-1.9 -2,-0.4 3,-0.6 -0.658 7.1-145.9 -80.6 123.6 -23.6 -32.3 -9.7 65 72 A P H 3> S+ 0 0 98 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.912 100.9 54.4 -51.9 -44.6 -22.5 -36.0 -9.4 66 73 A E H 3> S+ 0 0 110 1,-0.2 4,-1.3 2,-0.2 -45,-0.1 0.828 105.7 52.6 -62.7 -33.1 -20.3 -35.1 -6.5 67 74 A A H <> S+ 0 0 9 -3,-0.6 4,-2.6 -47,-0.3 6,-0.3 0.918 110.0 46.9 -69.7 -43.9 -23.2 -33.5 -4.6 68 75 A L H X S+ 0 0 40 -4,-1.9 4,-1.8 1,-0.2 5,-0.3 0.900 111.9 51.0 -64.8 -40.8 -25.4 -36.6 -4.9 69 76 A A H < S+ 0 0 85 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.822 111.7 50.3 -63.0 -31.5 -22.5 -38.8 -3.8 70 77 A F H < S+ 0 0 123 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.978 121.3 28.7 -72.0 -54.4 -22.1 -36.5 -0.9 71 78 A N H < S- 0 0 12 -4,-2.6 -2,-0.2 -52,-0.2 -1,-0.2 0.490 98.4-127.7 -89.7 -4.5 -25.6 -36.4 0.4 72 79 A G < + 0 0 66 -4,-1.8 2,-0.3 1,-0.2 -3,-0.1 0.473 56.4 147.1 75.9 3.6 -26.8 -39.8 -0.8 73 80 A I - 0 0 17 -5,-0.3 -1,-0.2 -6,-0.3 -2,-0.1 -0.557 32.4-167.7 -80.6 131.9 -29.8 -38.5 -2.6 74 81 A D > - 0 0 88 -2,-0.3 3,-1.8 1,-0.1 6,-0.1 -0.906 1.4-170.1-116.1 99.5 -31.1 -40.1 -5.8 75 82 A P T 3 S+ 0 0 13 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.683 82.7 64.4 -63.4 -18.7 -33.7 -37.7 -7.4 76 83 A N T 3 S+ 0 0 146 -20,-0.1 -20,-0.0 3,-0.0 -2,-0.0 0.464 72.8 108.8 -83.8 -2.8 -34.7 -40.4 -9.9 77 84 A D X - 0 0 67 -3,-1.8 3,-1.6 1,-0.1 4,-0.1 -0.665 57.2-158.2 -80.2 112.2 -36.1 -42.7 -7.2 78 85 A P T 3 S+ 0 0 119 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.532 86.3 66.0 -74.0 -4.4 -39.9 -42.7 -7.6 79 86 A D T 3 S+ 0 0 148 1,-0.2 -2,-0.1 2,-0.1 -3,-0.0 0.289 73.9 93.0 -94.0 10.4 -40.4 -43.9 -4.0 80 87 A R S < S- 0 0 27 -3,-1.6 -1,-0.2 -6,-0.1 -26,-0.1 0.471 87.9-129.5 -88.5 0.7 -38.9 -40.6 -2.5 81 88 A G - 0 0 64 -3,-0.4 -27,-0.6 1,-0.2 2,-0.1 0.866 41.2-179.2 59.6 39.2 -42.3 -38.9 -2.1 82 89 A A E -d 54 0A 31 -29,-0.1 2,-0.3 -27,-0.1 -27,-0.2 -0.396 12.3-170.0 -74.3 146.0 -41.0 -35.7 -3.8 83 90 A V E -d 55 0A 48 -29,-2.6 -27,-2.9 -2,-0.1 -30,-0.0 -0.825 34.0 -84.5-123.4 169.5 -43.2 -32.6 -4.3 84 91 A S > - 0 0 57 -2,-0.3 4,-2.4 -29,-0.2 5,-0.2 -0.322 33.7-117.4 -69.3 156.1 -42.6 -29.5 -6.4 85 92 A G H > S+ 0 0 19 -29,-0.3 4,-2.7 1,-0.2 5,-0.4 0.887 117.5 57.9 -57.8 -39.1 -40.5 -26.6 -5.0 86 93 A Y H > S+ 0 0 111 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.927 108.1 45.0 -55.2 -47.7 -43.7 -24.5 -5.4 87 94 A E H > S+ 0 0 79 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.919 114.0 48.5 -67.6 -43.2 -45.6 -26.9 -3.1 88 95 A A H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.971 118.9 37.6 -60.6 -55.4 -42.9 -27.2 -0.5 89 96 A L H X S+ 0 0 0 -4,-2.7 4,-3.2 1,-0.2 5,-0.2 0.853 111.7 58.0 -68.9 -37.2 -42.3 -23.4 -0.2 90 97 A H H X S+ 0 0 61 -4,-2.6 4,-1.8 -5,-0.4 -1,-0.2 0.924 110.8 44.6 -57.3 -43.3 -46.0 -22.5 -0.6 91 98 A E H X S+ 0 0 58 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.869 113.7 49.1 -70.5 -38.2 -46.8 -24.6 2.4 92 99 A I H X S+ 0 0 1 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.933 111.5 49.5 -64.7 -45.8 -43.8 -23.3 4.4 93 100 A F H X S+ 0 0 1 -4,-3.2 4,-2.8 1,-0.2 5,-0.2 0.863 109.0 53.0 -62.4 -37.1 -44.7 -19.7 3.7 94 101 A K H X S+ 0 0 114 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.925 111.1 45.1 -64.7 -45.2 -48.3 -20.3 4.7 95 102 A V H X S+ 0 0 26 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.906 115.1 49.9 -64.8 -39.1 -47.3 -21.7 8.1 96 103 A V H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.924 108.7 49.0 -68.0 -46.2 -44.8 -18.9 8.6 97 104 A R H X S+ 0 0 84 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.908 110.9 53.0 -59.0 -40.1 -47.2 -16.0 7.7 98 105 A K H X S+ 0 0 162 -4,-1.8 4,-2.6 -5,-0.2 -1,-0.2 0.903 110.1 47.0 -62.6 -41.3 -49.7 -17.6 10.2 99 106 A G H X S+ 0 0 11 -4,-1.8 4,-2.1 2,-0.2 6,-0.2 0.890 110.4 52.6 -66.5 -40.6 -47.1 -17.7 12.9 100 107 A I H X>S+ 0 0 19 -4,-2.5 5,-2.1 2,-0.2 4,-1.1 0.936 113.5 43.4 -60.6 -47.8 -46.1 -14.1 12.2 101 108 A K H ><5S+ 0 0 173 -4,-2.5 3,-0.7 1,-0.2 -2,-0.2 0.949 113.6 50.8 -61.8 -50.8 -49.7 -12.9 12.5 102 109 A A H 3<5S+ 0 0 89 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.814 117.2 39.2 -58.1 -34.9 -50.4 -15.0 15.6 103 110 A S H 3<5S- 0 0 37 -4,-2.1 -99,-0.4 -5,-0.1 -1,-0.2 0.533 109.4-118.0 -97.1 -8.8 -47.3 -13.7 17.4 104 111 A G T <<5 + 0 0 55 -4,-1.1 -3,-0.2 -3,-0.7 -4,-0.1 0.791 62.6 144.9 76.5 29.5 -47.5 -10.1 16.3 105 112 A C < - 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