==== 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 ENDORIBONUCLEASE 04-JAN-96 1BIR . COMPND 2 MOLECULE: RIBONUCLEASE T1; . SOURCE 2 ORGANISM_SCIENTIFIC: ASPERGILLUS ORYZAE; . AUTHOR J.DOUMEN,M.GONCIARZ,I.ZEGERS,R.LORIS,L.WYNS,J.STEYAERT . 208 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10786.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 56.2 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 . 52 25.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 2 1.0 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 . 9 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 1 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 . 2 2 4 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 0 151 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 151.9 -17.1 5.4 14.4 2 2 A a - 0 0 46 1,-0.1 10,-0.2 10,-0.1 3,-0.2 -0.666 360.0-155.7 -86.6 140.1 -14.0 3.8 13.0 3 3 A D S S+ 0 0 81 8,-2.1 2,-0.4 1,-0.3 9,-0.2 0.844 93.2 16.9 -78.0 -33.0 -10.5 5.3 13.7 4 4 A Y E S-A 11 0A 58 7,-2.3 7,-2.9 -3,-0.1 2,-0.5 -0.999 71.2-164.9-137.0 129.1 -9.4 3.5 10.5 5 5 A T E -A 10 0A 47 99,-2.6 99,-1.4 -2,-0.4 2,-0.7 -0.973 3.8-174.9-121.3 114.8 -11.7 2.1 7.8 6 6 A b E > -A 9 0A 1 3,-2.5 3,-2.5 -2,-0.5 2,-0.4 -0.910 66.9 -60.3-106.1 97.4 -10.2 -0.3 5.3 7 7 A G T 3 S- 0 0 42 -2,-0.7 97,-0.1 1,-0.3 84,-0.0 -0.474 121.5 -17.1 64.9-116.6 -12.9 -1.0 2.8 8 8 A S T 3 S+ 0 0 122 -2,-0.4 -1,-0.3 -3,-0.1 2,-0.3 0.605 117.2 103.2 -93.6 -12.2 -15.7 -2.5 4.9 9 9 A N E < -A 6 0A 51 -3,-2.5 -3,-2.5 1,-0.0 2,-0.5 -0.535 57.7-155.2 -80.0 134.4 -13.4 -3.3 7.8 10 10 A a E -A 5 0A 71 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.934 12.9-177.2-114.5 123.7 -13.6 -1.0 10.9 11 11 A Y E -A 4 0A 5 -7,-2.9 -7,-2.3 -2,-0.5 -8,-2.1 -0.923 13.6-151.0-123.1 145.3 -10.7 -0.5 13.2 12 12 A S > - 0 0 34 -2,-0.4 4,-1.9 -9,-0.2 3,-0.2 -0.619 37.7-104.3-103.2 167.5 -10.2 1.4 16.4 13 13 A S H > S+ 0 0 57 1,-0.2 4,-2.8 -2,-0.2 5,-0.2 0.868 123.3 57.0 -59.9 -33.4 -6.9 2.8 17.7 14 14 A S H > S+ 0 0 75 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.885 104.1 50.9 -66.5 -38.0 -6.8 -0.0 20.2 15 15 A D H > S+ 0 0 56 -3,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.929 112.8 47.3 -63.2 -45.1 -7.1 -2.6 17.4 16 16 A V H X S+ 0 0 5 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.916 111.5 49.2 -63.5 -46.0 -4.2 -0.9 15.6 17 17 A S H X S+ 0 0 75 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.881 111.2 50.2 -60.1 -42.7 -2.0 -0.7 18.8 18 18 A T H X S+ 0 0 80 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.918 113.8 44.0 -63.6 -45.0 -2.6 -4.4 19.6 19 19 A A H X S+ 0 0 7 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.925 113.0 52.9 -66.0 -44.4 -1.6 -5.5 16.1 20 20 A Q H X S+ 0 0 19 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.914 106.1 52.3 -58.7 -45.7 1.4 -3.1 16.0 21 21 A A H X S+ 0 0 56 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.880 110.4 49.5 -58.5 -39.1 2.8 -4.5 19.3 22 22 A A H X S+ 0 0 24 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.939 113.7 44.3 -64.6 -50.2 2.6 -8.0 18.0 23 23 A G H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.916 114.1 49.1 -63.0 -45.1 4.3 -7.2 14.7 24 24 A Y H X S+ 0 0 17 -4,-3.0 4,-2.5 1,-0.2 5,-0.2 0.903 106.0 57.4 -63.7 -40.5 7.0 -5.1 16.4 25 25 A K H X S+ 0 0 106 -4,-2.2 4,-1.0 -5,-0.2 -1,-0.2 0.921 109.6 44.7 -55.5 -48.3 7.7 -7.9 18.9 26 26 A L H <>S+ 0 0 24 -4,-1.8 5,-2.4 1,-0.2 3,-0.5 0.895 110.5 56.0 -64.2 -40.3 8.5 -10.3 16.1 27 27 A H H ><5S+ 0 0 38 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.908 105.5 49.7 -58.1 -44.3 10.6 -7.7 14.3 28 28 A E H 3<5S+ 0 0 60 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.739 112.2 49.5 -69.7 -20.1 12.9 -7.1 17.3 29 29 A D T 3<5S- 0 0 74 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.422 110.4-120.3 -95.2 -2.7 13.4 -10.9 17.7 30 30 A G T < 5 + 0 0 75 -3,-1.2 2,-0.3 -4,-0.4 -3,-0.2 0.808 69.4 137.1 66.0 30.9 14.3 -11.4 14.0 31 31 A E < - 0 0 109 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.3 -0.749 36.1-164.2-108.9 159.9 11.3 -13.8 13.8 32 32 A T - 0 0 79 -2,-0.3 2,-0.3 -3,-0.1 5,-0.1 -0.932 1.4-159.9-142.9 155.3 8.6 -14.1 11.1 33 33 A V B > +B 38 0B 39 5,-2.5 5,-3.3 -2,-0.3 37,-0.2 -0.992 48.4 32.2-139.4 150.4 5.2 -15.8 10.9 34 34 A G T > 5S- 0 0 28 -2,-0.3 3,-2.2 35,-0.2 38,-0.1 0.063 89.6 -80.0 87.2 154.7 2.9 -16.9 8.0 35 35 A S T 3 5S+ 0 0 112 1,-0.3 -1,-0.2 36,-0.2 37,-0.1 0.779 133.7 53.1 -61.6 -25.3 3.7 -18.3 4.6 36 36 A N T 3 5S- 0 0 92 -3,-0.1 -1,-0.3 4,-0.0 -2,-0.1 0.213 115.2-118.9 -95.6 12.5 4.2 -14.7 3.5 37 37 A S T < 5 - 0 0 58 -3,-2.2 -3,-0.2 1,-0.1 -2,-0.1 0.952 38.8-129.6 50.3 75.4 6.8 -14.1 6.4 38 38 A Y B + 0 0 31 2,-0.1 3,-1.2 3,-0.1 -2,-0.0 0.915 42.2 162.8 62.6 44.9 6.2 2.5 0.2 45 45 A Y T 3 S+ 0 0 193 1,-0.3 -1,-0.1 2,-0.1 54,-0.0 0.858 73.7 59.7 -57.2 -39.6 5.9 2.2 -3.6 46 46 A E T 3 S- 0 0 59 1,-0.1 -1,-0.3 55,-0.0 -2,-0.1 0.688 106.8-132.0 -61.9 -23.5 2.7 4.3 -3.3 47 47 A G < - 0 0 54 -3,-1.2 -2,-0.1 1,-0.2 2,-0.1 0.902 31.2-172.8 71.1 43.8 4.7 7.1 -1.7 48 48 A F - 0 0 34 1,-0.1 2,-2.0 53,-0.0 -1,-0.2 -0.414 32.7-116.3 -69.2 144.0 2.4 7.8 1.2 49 49 A D + 0 0 160 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.536 43.2 177.7 -80.3 69.0 3.3 10.8 3.2 50 50 A F - 0 0 15 -2,-2.0 38,-0.1 1,-0.1 4,-0.1 -0.633 23.7-151.7 -73.2 133.6 4.1 8.9 6.4 51 51 A S S S+ 0 0 126 36,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.581 74.8 83.3 -81.9 -8.7 5.3 11.5 8.9 52 52 A V S S- 0 0 15 35,-0.1 -2,-0.1 1,-0.1 2,-0.1 -0.671 88.3-105.1 -98.4 144.3 7.4 8.8 10.6 53 53 A S - 0 0 70 -2,-0.3 29,-0.2 1,-0.1 30,-0.2 -0.343 45.8 -91.0 -71.8 150.4 10.8 7.8 9.3 54 54 A S S S+ 0 0 79 27,-0.1 2,-0.1 -4,-0.1 -1,-0.1 -0.261 81.1 91.1 -81.4 174.2 11.6 4.6 7.4 55 55 A P - 0 0 41 0, 0.0 27,-0.8 0, 0.0 2,-0.3 0.570 66.6-163.2 -71.0 151.9 12.5 1.8 7.2 56 56 A Y E -CD 42 81C 25 -14,-0.6 -14,-2.7 25,-0.2 2,-0.3 -0.817 10.0-164.6-107.8 149.0 8.9 0.6 7.4 57 57 A Y E -CD 41 80C 36 23,-2.8 23,-2.4 -2,-0.3 2,-0.4 -0.972 9.8-142.1-132.7 144.6 7.5 -2.9 8.1 58 58 A E E +CD 40 79C 20 -18,-3.0 -18,-1.5 -2,-0.3 21,-0.2 -0.880 17.5 175.5-113.9 147.6 4.0 -4.3 7.5 59 59 A W E - D 0 78C 3 19,-2.1 19,-2.9 -2,-0.4 -36,-0.0 -0.993 36.1-101.9-143.8 139.9 2.0 -6.7 9.7 60 60 A P E - D 0 77C 0 0, 0.0 8,-0.5 0, 0.0 2,-0.5 -0.342 24.5-158.9 -69.2 142.7 -1.6 -7.9 9.1 61 61 A I - 0 0 8 15,-1.6 15,-0.4 12,-0.3 2,-0.4 -0.987 17.9-143.6-116.9 130.2 -4.5 -6.5 11.1 62 62 A L > - 0 0 34 4,-0.6 3,-1.6 -2,-0.5 12,-0.1 -0.840 15.2-142.8-103.0 137.7 -7.5 -8.8 11.2 63 63 A S T 3 S+ 0 0 82 -2,-0.4 -53,-0.1 1,-0.3 -1,-0.1 0.708 101.2 66.4 -65.1 -21.2 -11.2 -7.8 11.2 64 64 A S T 3 S- 0 0 84 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.679 111.1-121.1 -72.9 -17.8 -12.0 -10.6 13.7 65 65 A G S < S+ 0 0 51 -3,-1.6 -2,-0.1 1,-0.4 -1,-0.1 0.295 71.8 130.0 93.4 -10.1 -9.9 -8.7 16.2 66 66 A D - 0 0 114 1,-0.1 -4,-0.6 -5,-0.0 2,-0.4 -0.357 65.3-110.6 -72.2 156.7 -7.6 -11.6 16.6 67 67 A V - 0 0 64 -6,-0.1 -6,-0.1 -3,-0.1 -1,-0.1 -0.748 42.6 -97.4 -88.2 139.6 -3.9 -11.0 16.4 68 68 A Y + 0 0 9 -8,-0.5 3,-0.1 -2,-0.4 -1,-0.1 -0.326 49.9 162.7 -58.8 129.5 -2.2 -12.5 13.3 69 69 A S - 0 0 104 1,-0.7 -35,-0.2 -2,-0.1 2,-0.2 0.174 61.9 -63.4-135.5 21.5 -0.6 -15.9 13.9 70 70 A G S S+ 0 0 26 -37,-0.2 -1,-0.7 1,-0.1 2,-0.1 -0.595 95.5 75.2 116.3 174.6 -0.2 -17.5 10.5 71 71 A G S S+ 0 0 54 -2,-0.2 -36,-0.2 -3,-0.1 -1,-0.1 -0.436 96.6 2.3 81.3-161.2 -2.8 -18.5 8.0 72 72 A S - 0 0 106 1,-0.1 -2,-0.1 -2,-0.1 -38,-0.0 -0.426 55.8-163.8 -67.8 121.5 -4.7 -16.0 5.8 73 73 A P - 0 0 17 0, 0.0 3,-0.3 0, 0.0 -12,-0.3 0.575 25.9-148.1 -82.2 -6.8 -3.5 -12.4 6.5 74 74 A G - 0 0 45 1,-0.2 -12,-0.1 -14,-0.1 0, 0.0 -0.318 37.5 -67.4 70.6-157.9 -6.5 -10.8 4.8 75 75 A A S S+ 0 0 26 -14,-0.1 17,-1.9 -69,-0.1 2,-0.3 0.558 100.3 91.2-109.8 -7.5 -6.1 -7.4 3.0 76 76 A D E - E 0 91C 2 -15,-0.4 -15,-1.6 -3,-0.3 2,-0.3 -0.677 48.6-174.7-100.4 146.1 -5.3 -5.0 5.8 77 77 A R E -DE 60 90C 14 13,-2.9 13,-2.6 -2,-0.3 2,-0.4 -0.994 21.2-146.1-141.0 140.4 -1.9 -4.0 7.2 78 78 A V E -DE 59 89C 0 -19,-2.9 -19,-2.1 -2,-0.3 2,-0.5 -0.832 23.4-153.0 -97.3 136.9 -0.5 -1.9 10.0 79 79 A V E +DE 58 88C 0 9,-2.6 8,-3.0 -2,-0.4 9,-1.5 -0.982 22.0 164.4-116.9 128.1 2.7 -0.2 9.0 80 80 A F E -DE 57 86C 0 -23,-2.4 -23,-2.8 -2,-0.5 6,-0.2 -0.898 22.8-130.8-136.4 166.3 5.3 0.7 11.6 81 81 A N E > -D 56 0C 1 4,-2.0 3,-1.9 -2,-0.3 -25,-0.2 -0.466 40.1 -81.2-112.3-173.4 9.0 1.7 11.7 82 82 A E T 3 S+ 0 0 38 -27,-0.8 -26,-0.1 1,-0.3 -28,-0.1 0.722 126.3 53.8 -55.6 -31.1 12.2 0.7 13.6 83 83 A N T 3 S- 0 0 42 -30,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.248 119.6-108.4 -88.5 9.3 11.3 2.9 16.6 84 84 A N S < S+ 0 0 57 -3,-1.9 2,-0.4 1,-0.2 -2,-0.1 0.871 70.4 149.6 63.3 37.6 7.9 1.1 16.9 85 85 A Q - 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0 0 88 -3,-2.4 2,-0.3 -7,-0.1 -4,-0.2 -0.189 50.1-146.5 -71.6 170.8 -1.2 -2.1 -4.8 100 100 A A - 0 0 7 -6,-0.1 2,-0.3 -10,-0.0 -8,-0.2 -0.932 10.3-160.9-140.0 156.9 -2.4 -0.5 -1.6 101 101 A V E -F 91 0C 57 -10,-2.6 -10,-2.8 -2,-0.3 2,-0.2 -0.893 33.7 -99.0-129.3 160.7 -4.4 2.4 -0.5 102 102 A E E -F 90 0C 96 -2,-0.3 2,-0.5 -12,-0.2 -12,-0.3 -0.543 33.6-117.2 -80.9 150.0 -4.6 4.1 2.9 103 103 A b 0 0 10 -14,-2.7 -14,-0.3 -2,-0.2 -97,-0.2 -0.782 360.0 360.0 -86.1 130.1 -7.5 3.3 5.3 104 104 A T 0 0 142 -99,-1.4 -99,-2.6 -2,-0.5 -1,-0.0 -0.412 360.0 360.0 -84.6 360.0 -9.4 6.4 5.9 105 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 106 1 B A 0 0 151 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 159.2 41.3 -6.4 34.7 107 2 B c - 0 0 50 1,-0.1 10,-0.2 10,-0.1 3,-0.2 -0.844 360.0-160.6-107.8 136.5 38.1 -5.0 33.2 108 3 B D S S+ 0 0 90 8,-2.1 2,-0.3 -2,-0.4 9,-0.2 0.811 94.6 13.3 -78.6 -32.2 34.6 -6.3 33.8 109 4 B Y E S-G 116 0D 59 7,-2.1 7,-2.8 -3,-0.1 2,-0.5 -0.996 71.4-163.5-141.3 133.1 33.6 -4.5 30.6 110 5 B T E -G 115 0D 48 99,-2.5 99,-1.8 -2,-0.3 2,-0.6 -0.992 3.3-172.7-128.0 118.5 35.9 -3.1 28.0 111 6 B d E > -G 114 0D 0 3,-2.2 3,-2.4 -2,-0.5 2,-0.5 -0.918 66.9 -56.8-106.8 99.7 34.6 -0.7 25.5 112 7 B G T 3 S- 0 0 46 -2,-0.6 97,-0.1 1,-0.3 84,-0.0 -0.558 124.4 -16.9 65.9-117.3 37.3 0.0 22.9 113 8 B S T 3 S+ 0 0 122 -2,-0.5 2,-0.3 -3,-0.1 -1,-0.3 0.542 116.6 106.2 -92.8 -10.0 40.2 1.2 25.0 114 9 B N E < -G 111 0D 48 -3,-2.4 -3,-2.2 1,-0.0 2,-0.5 -0.575 55.4-153.9 -83.6 133.1 38.0 2.0 28.1 115 10 B c E -G 110 0D 67 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.892 13.8-178.6-109.6 124.3 38.1 -0.2 31.1 116 11 B Y E -G 109 0D 3 -7,-2.8 -7,-2.1 -2,-0.5 -8,-2.1 -0.948 13.8-153.1-125.2 138.3 35.1 -0.5 33.5 117 12 B S >> - 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