==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-SEP-98 5HOH . COMPND 2 MOLECULE: PROTEIN (RIBONUCLEASE T1); . SOURCE 2 ORGANISM_SCIENTIFIC: ASPERGILLUS ORYZAE; . AUTHOR U.LANGHORST,R.LORIS,V.P.DENISOV,J.DOUMEN,P.ROOSE,D.MAES, . 416 4 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21171.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 238 57.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 104 25.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 27 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 60 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.9 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 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 4 4 8 0 8 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 . 4 0 0 4 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 A 0 0 114 0, 0.0 2,-1.5 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -68.1 18.1 2.6 50.4 2 2 A a + 0 0 63 1,-0.2 10,-0.2 10,-0.1 3,-0.1 -0.619 360.0 150.1 -89.7 77.4 20.7 5.4 51.0 3 3 A D + 0 0 68 -2,-1.5 2,-0.4 8,-0.9 -1,-0.2 0.803 69.2 35.0 -77.6 -31.8 20.4 7.2 47.6 4 4 A Y E -A 11 0A 61 7,-2.4 7,-2.9 -3,-0.3 2,-0.6 -0.982 68.5-163.8-131.5 123.0 21.2 10.6 49.1 5 5 A T E -A 10 0A 55 99,-3.0 99,-1.2 -2,-0.4 2,-0.7 -0.919 6.0-177.6-111.1 115.8 23.6 11.2 52.0 6 6 A b E > -A 9 0A 3 3,-2.7 3,-3.1 -2,-0.6 2,-0.7 -0.853 68.4 -64.1-111.8 99.0 23.5 14.6 53.8 7 7 A G T 3 S- 0 0 55 -2,-0.7 84,-0.0 1,-0.3 87,-0.0 -0.576 121.3 -20.8 58.1-107.9 26.2 14.6 56.3 8 8 A S T 3 S+ 0 0 130 -2,-0.7 2,-0.3 -3,-0.1 -1,-0.3 0.366 115.7 106.0-110.8 -0.8 24.8 11.8 58.4 9 9 A A E < -A 6 0A 17 -3,-3.1 -3,-2.7 2,-0.0 2,-0.5 -0.662 56.3-154.3 -82.8 136.9 21.2 12.0 57.2 10 10 A a E -A 5 0A 69 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.958 12.8-176.3-118.3 119.3 20.2 9.2 54.8 11 11 A Y E -A 4 0A 4 -7,-2.9 -7,-2.4 -2,-0.5 -8,-0.9 -0.930 11.8-149.8-118.9 140.6 17.4 9.7 52.3 12 12 A S > - 0 0 29 -2,-0.4 4,-1.9 -10,-0.2 5,-0.2 -0.405 36.9-100.7 -94.3 175.3 15.8 7.2 49.8 13 13 A S H > S+ 0 0 67 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.874 125.3 52.7 -63.9 -37.6 14.3 8.1 46.4 14 14 A S H > S+ 0 0 82 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.874 105.2 54.0 -65.5 -40.3 10.8 7.9 48.0 15 15 A D H > S+ 0 0 66 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.949 113.1 43.0 -59.2 -48.3 11.8 10.3 50.8 16 16 A V H X S+ 0 0 3 -4,-1.9 4,-3.2 1,-0.2 5,-0.2 0.935 113.4 51.4 -63.0 -47.4 12.9 12.9 48.2 17 17 A S H X S+ 0 0 75 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.865 111.3 47.9 -59.2 -39.5 9.9 12.3 46.0 18 18 A T H X S+ 0 0 81 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.894 114.8 44.2 -69.5 -43.3 7.5 12.8 48.9 19 19 A A H X S+ 0 0 9 -4,-2.1 4,-2.5 -5,-0.2 5,-0.2 0.952 113.6 51.4 -66.9 -46.5 9.2 16.0 50.1 20 20 A Q H X S+ 0 0 21 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.870 107.7 52.8 -57.5 -40.8 9.5 17.3 46.6 21 21 A A H X S+ 0 0 55 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.888 110.5 47.6 -64.0 -39.8 5.7 16.7 45.9 22 22 A A H X S+ 0 0 26 -4,-1.5 4,-1.7 -3,-0.2 -2,-0.2 0.932 114.4 45.8 -66.8 -46.2 4.8 18.6 49.1 23 23 A G H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.875 111.7 50.7 -65.0 -39.6 7.0 21.6 48.2 24 24 A Y H X S+ 0 0 39 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.876 107.8 54.7 -66.9 -37.1 5.9 21.7 44.6 25 25 A K H X S+ 0 0 103 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.896 108.6 46.3 -63.4 -45.2 2.3 21.8 45.6 26 26 A L H X>S+ 0 0 33 -4,-1.7 5,-3.0 2,-0.2 4,-0.6 0.887 112.5 51.8 -64.4 -39.7 2.7 24.8 48.0 27 27 A H H ><5S+ 0 0 41 -4,-1.9 3,-0.9 3,-0.2 -2,-0.2 0.926 108.9 51.0 -60.1 -45.5 4.6 26.5 45.2 28 28 A E H 3<5S+ 0 0 110 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.859 113.8 43.1 -60.8 -39.7 1.8 25.8 42.8 29 29 A D H 3<5S- 0 0 79 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.457 114.2-117.9 -86.5 -3.8 -0.8 27.2 45.2 30 30 A G T <<5 + 0 0 67 -3,-0.9 2,-0.3 -4,-0.6 -3,-0.2 0.808 67.0 137.9 71.5 32.0 1.4 30.2 46.0 31 31 A E < - 0 0 106 -5,-3.0 2,-0.3 -6,-0.1 -1,-0.2 -0.739 32.3-167.8-110.4 156.9 1.8 29.3 49.7 32 32 A T - 0 0 78 -2,-0.3 2,-0.3 -5,-0.0 5,-0.1 -0.981 2.6-164.8-141.9 153.6 4.7 29.4 52.1 33 33 A V B > +B 38 0B 40 5,-2.5 5,-2.5 -2,-0.3 37,-0.3 -0.960 46.5 35.3-137.3 152.0 5.6 28.1 55.6 34 34 A G T > 5S- 0 0 25 -2,-0.3 3,-1.9 35,-0.2 37,-0.1 0.054 92.3 -72.7 91.9 160.1 8.3 28.8 58.1 35 35 A S T 3 5S+ 0 0 72 35,-0.4 -1,-0.2 36,-0.3 37,-0.1 0.768 134.2 49.7 -61.2 -26.1 10.3 31.8 59.2 36 36 A N T 3 5S- 0 0 58 -3,-0.2 -1,-0.3 34,-0.1 -2,-0.1 0.242 112.0-121.3 -95.7 7.6 12.2 31.5 55.9 37 37 A S T < 5 - 0 0 59 -3,-1.9 -3,-0.2 1,-0.1 -2,-0.1 0.927 40.3-129.4 52.6 63.0 9.0 31.3 53.8 38 38 A Y B + 0 0 35 2,-0.1 3,-1.1 1,-0.1 -2,-0.0 0.942 47.0 163.5 62.4 51.0 22.2 28.6 42.7 45 45 A Y T 3 S+ 0 0 173 1,-0.3 284,-0.1 2,-0.1 -1,-0.1 0.830 72.7 62.5 -65.0 -32.8 24.9 30.9 44.1 46 46 A E T 3 S- 0 0 53 1,-0.1 -1,-0.3 283,-0.0 -2,-0.1 0.648 107.5-129.4 -66.7 -18.0 27.0 27.8 44.7 47 47 A G < - 0 0 44 -3,-1.1 -2,-0.1 1,-0.1 -1,-0.1 0.872 36.0-177.2 70.7 38.9 27.1 27.2 41.0 48 48 A F - 0 0 33 1,-0.1 2,-1.3 53,-0.0 -1,-0.1 -0.357 32.4-118.0 -66.9 149.8 26.0 23.5 41.1 49 49 A D - 0 0 155 2,-0.0 2,-0.2 -2,-0.0 -1,-0.1 -0.625 41.0-179.1 -92.9 75.9 25.8 21.7 37.8 50 50 A F - 0 0 27 -2,-1.3 38,-0.1 1,-0.1 37,-0.1 -0.510 25.8-148.7 -75.8 143.2 22.1 20.9 37.6 51 51 A S S S+ 0 0 127 36,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.580 77.5 72.5 -86.1 -15.4 20.9 19.0 34.5 52 52 A V S S- 0 0 27 35,-0.1 2,-0.1 1,-0.1 -2,-0.1 -0.719 88.1-103.3-102.9 154.9 17.4 20.6 34.6 53 53 A S - 0 0 88 -2,-0.3 30,-0.2 1,-0.1 29,-0.2 -0.386 48.5 -82.2 -76.7 154.4 16.6 24.2 33.6 54 54 A S S S+ 0 0 84 27,-0.1 2,-0.1 -2,-0.1 -1,-0.1 -0.147 81.0 88.6 -76.8 174.2 15.8 27.0 36.1 55 55 A P - 0 0 43 0, 0.0 27,-0.6 0, 0.0 2,-0.3 0.572 63.5-166.8 -75.1 155.4 14.1 28.6 37.9 56 56 A Y E -CD 42 81C 29 -14,-0.7 -14,-2.6 25,-0.2 2,-0.4 -0.804 9.0-161.9-111.0 154.6 14.9 26.5 41.0 57 57 A Y E -CD 41 80C 17 23,-2.3 23,-1.9 -2,-0.3 2,-0.4 -0.990 11.2-139.6-136.0 138.7 13.2 26.4 44.4 58 58 A E E +CD 40 79C 16 -18,-2.4 -18,-1.2 -2,-0.4 21,-0.2 -0.833 21.7 174.7-102.2 142.2 14.4 25.0 47.7 59 59 A W E - D 0 78C 2 19,-1.8 19,-3.3 -2,-0.4 2,-0.1 -0.992 33.4-107.3-145.0 133.9 12.2 23.1 50.1 60 60 A P E - D 0 77C 1 0, 0.0 8,-0.5 0, 0.0 2,-0.5 -0.366 23.4-161.1 -67.4 139.6 13.2 21.4 53.3 61 61 A I - 0 0 6 15,-1.5 2,-0.4 12,-0.2 15,-0.4 -0.989 16.9-142.5-119.2 125.1 13.4 17.6 53.5 62 62 A L > - 0 0 26 4,-0.6 3,-1.4 -2,-0.5 12,-0.1 -0.771 13.5-143.7 -96.7 139.0 13.3 16.2 57.1 63 63 A S T 3 S+ 0 0 84 -2,-0.4 -1,-0.1 1,-0.3 -53,-0.1 0.771 100.0 67.5 -65.3 -26.7 15.3 13.3 58.4 64 64 A S T 3 S- 0 0 53 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.672 110.7-119.7 -67.8 -17.8 12.3 12.3 60.6 65 65 A G S < S+ 0 0 53 -3,-1.4 -2,-0.1 1,-0.4 -1,-0.1 0.241 72.8 126.2 95.8 -14.2 10.3 11.5 57.5 66 66 A D - 0 0 113 1,-0.1 -4,-0.6 -5,-0.0 -1,-0.4 -0.380 66.9-108.8 -74.8 156.5 7.6 14.1 58.2 67 67 A V - 0 0 68 -6,-0.1 -6,-0.1 -3,-0.1 -1,-0.1 -0.712 42.5 -99.9 -86.3 136.5 6.7 16.7 55.6 68 68 A Y + 0 0 10 -8,-0.5 -1,-0.1 -2,-0.4 -34,-0.0 -0.306 43.9 172.1 -58.8 132.9 7.9 20.2 56.4 69 69 A S - 0 0 102 3,-0.1 -35,-0.2 -3,-0.0 -1,-0.1 -0.026 66.4 -69.5-134.5 32.8 5.1 22.4 57.9 70 70 A G S S+ 0 0 24 -37,-0.3 -35,-0.4 1,-0.1 -33,-0.1 0.373 100.5 106.0 100.3 -6.6 6.7 25.6 59.1 71 71 A G S S- 0 0 42 1,-0.2 -36,-0.3 -37,-0.1 -1,-0.1 0.402 87.3 -26.3 -79.6-140.6 8.8 24.3 62.0 72 72 A S - 0 0 12 166,-0.3 -1,-0.2 165,-0.2 221,-0.1 -0.675 56.1-160.4 -79.0 115.5 12.5 23.9 62.2 73 73 A P - 0 0 0 0, 0.0 3,-0.3 0, 0.0 -12,-0.2 0.722 22.7-156.9 -68.8 -25.8 13.7 23.2 58.6 74 74 A G - 0 0 8 218,-2.1 220,-0.2 1,-0.2 221,-0.1 -0.237 38.3 -59.2 76.8-166.0 17.0 21.6 59.5 75 75 A A S S+ 0 0 15 219,-0.1 17,-1.5 -69,-0.1 2,-0.3 0.659 103.4 84.1 -94.0 -15.0 20.1 21.5 57.2 76 76 A D E + E 0 91C 14 -15,-0.4 -15,-1.5 -3,-0.3 2,-0.3 -0.686 48.3 179.1-100.9 146.4 18.7 19.6 54.2 77 77 A R E -DE 60 90C 0 13,-2.8 13,-2.3 -2,-0.3 2,-0.4 -0.981 21.8-142.7-140.0 147.4 16.8 20.8 51.1 78 78 A V E -DE 59 89C 0 -19,-3.3 -19,-1.8 -2,-0.3 2,-0.5 -0.877 22.3-148.7-105.9 139.6 15.4 19.3 47.9 79 79 A V E +DE 58 88C 0 9,-3.0 8,-3.0 -2,-0.4 9,-1.5 -0.966 23.0 166.9-115.1 126.2 15.7 21.5 44.8 80 80 A F E -DE 57 86C 0 -23,-1.9 -23,-2.3 -2,-0.5 6,-0.2 -0.872 21.0-139.0-131.7 165.2 13.1 21.4 42.0 81 81 A N E > -D 56 0C 2 4,-1.5 3,-1.8 -2,-0.3 -25,-0.2 -0.475 43.4 -81.0-113.5-172.3 12.1 23.6 39.0 82 82 A E T 3 S+ 0 0 74 -27,-0.6 -26,-0.1 1,-0.3 -28,-0.1 0.665 127.8 57.0 -64.9 -19.5 8.9 24.7 37.4 83 83 A N T 3 S- 0 0 115 -30,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.390 116.5-114.4 -90.0 2.7 8.5 21.3 35.7 84 84 A N < + 0 0 60 -3,-1.8 2,-0.4 1,-0.3 -2,-0.1 0.870 67.3 150.6 63.1 35.7 8.6 19.6 39.1 85 85 A Q - 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