==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/RNA 06-JUN-01 1JBS . COMPND 2 MOLECULE: 29-MER SARCIN/RICIN DOMAIN RNA ANALOG; . SOURCE 2 SYNTHETIC: YES; . AUTHOR X.YANG,T.GERCZEI,L.GLOVER,C.C.CORRELL . 298 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17232.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 53.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 27.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 1 0.3 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 . 29 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 24 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 8 2 1 1 2 2 0 0 0 2 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 1 0 2 0 0 1 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 83 0, 0.0 25,-2.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 144.4 70.5 66.5 38.7 2 2 A T E -A 25 0A 80 23,-0.2 2,-0.4 24,-0.1 23,-0.2 -0.959 360.0-155.5-116.7 127.6 69.5 69.9 37.3 3 3 A W E -A 24 0A 8 21,-3.5 21,-3.3 -2,-0.5 2,-0.5 -0.856 4.5-156.0-105.0 140.4 68.3 70.3 33.7 4 4 A T E -AB 23 148A 23 144,-3.1 144,-2.4 -2,-0.4 2,-0.4 -0.945 9.3-175.8-118.5 129.5 68.5 73.6 31.9 5 5 A a E -A 22 0A 3 17,-3.0 17,-3.5 -2,-0.5 2,-0.7 -0.939 18.0-145.1-120.8 143.8 66.4 74.6 28.9 6 6 A I E -A 21 0A 71 -2,-0.4 2,-0.5 15,-0.2 15,-0.2 -0.954 25.1-179.6-107.9 116.9 66.8 77.7 27.0 7 7 A N E -A 20 0A 0 13,-3.1 13,-2.7 -2,-0.7 2,-0.3 -0.978 23.5-134.0-124.1 126.2 63.3 78.9 25.9 8 8 A Q E -Ac 19 138A 42 129,-3.0 131,-2.7 -2,-0.5 2,-0.4 -0.601 27.3-174.8 -76.2 131.9 62.7 82.0 23.8 9 9 A Q E -A 18 0A 66 9,-3.2 9,-3.3 -2,-0.3 2,-0.8 -0.985 30.4-109.4-133.5 141.3 59.9 84.1 25.2 10 10 A L E -A 17 0A 74 -2,-0.4 7,-0.2 7,-0.3 5,-0.1 -0.589 25.0-151.1 -73.6 106.2 58.4 87.2 23.7 11 11 A N E >> -A 16 0A 42 5,-2.2 4,-0.8 -2,-0.8 5,-0.6 -0.684 8.0-150.4 -74.9 122.4 59.3 90.2 25.8 12 12 A P T 45S+ 0 0 113 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.912 90.5 54.9 -62.6 -43.4 56.4 92.6 25.3 13 13 A K T 45S+ 0 0 199 1,-0.2 -2,-0.0 2,-0.1 -3,-0.0 0.808 121.4 28.5 -62.1 -33.0 58.4 95.8 25.7 14 14 A T T 45S- 0 0 71 2,-0.2 -1,-0.2 -3,-0.2 3,-0.1 0.404 94.2-141.9-107.0 0.6 60.9 94.9 23.0 15 15 A N T <5 + 0 0 124 -4,-0.8 2,-0.3 -3,-0.3 -2,-0.1 0.725 65.1 117.5 43.1 23.8 58.4 92.8 21.0 16 16 A K E -A 2 0A 34 -2,-0.4 4,-2.7 74,-0.3 -23,-0.2 -0.809 10.4-150.5 -89.7 120.1 65.0 69.3 39.1 26 26 A Q H > S+ 0 0 40 -25,-2.5 4,-3.1 -2,-0.6 5,-0.2 0.892 98.3 56.3 -56.7 -39.8 65.1 65.7 37.8 27 27 A A H > S+ 0 0 71 -26,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.937 110.5 43.4 -60.1 -43.7 63.8 64.5 41.1 28 28 A K H > S+ 0 0 112 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.895 112.8 51.9 -69.3 -39.0 60.8 66.8 40.8 29 29 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.939 110.3 49.5 -61.3 -46.0 60.2 65.9 37.1 30 30 A E H X S+ 0 0 63 -4,-3.1 4,-1.6 1,-0.2 -2,-0.2 0.926 108.7 52.0 -58.4 -46.6 60.3 62.2 38.0 31 31 A S H X S+ 0 0 46 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.881 106.7 55.1 -57.5 -37.8 57.8 62.8 40.8 32 32 A N H X S+ 0 0 1 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.907 105.8 51.4 -60.0 -42.4 55.6 64.5 38.3 33 33 A S H < S+ 0 0 1 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.816 109.5 50.0 -67.7 -29.4 55.7 61.4 36.1 34 34 A H H < S+ 0 0 103 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.849 108.9 50.9 -77.6 -32.9 54.7 59.2 39.0 35 35 A H H < S+ 0 0 108 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.719 97.7 82.0 -75.9 -20.8 51.7 61.4 40.0 36 36 A A S < S- 0 0 2 -4,-1.2 70,-0.0 -5,-0.2 2,-0.0 -0.571 92.9 -99.9 -83.5 149.6 50.5 61.4 36.4 37 37 A P - 0 0 39 0, 0.0 2,-1.8 0, 0.0 -1,-0.1 -0.289 26.2-114.2 -68.9 152.7 48.4 58.4 35.3 38 38 A L S S+ 0 0 61 -4,-0.1 2,-0.3 2,-0.1 -4,-0.0 -0.542 78.8 107.1 -88.1 73.0 49.8 55.5 33.2 39 39 A S S S- 0 0 22 -2,-1.8 2,-0.6 9,-0.0 3,-0.1 -0.908 70.5-123.0-143.3 167.3 47.7 56.2 30.2 40 40 A D S S- 0 0 24 44,-0.4 9,-0.2 -2,-0.3 2,-0.2 -0.877 79.5 -46.1-117.4 95.0 48.1 57.6 26.7 41 41 A G S S+ 0 0 12 7,-2.6 3,-0.1 -2,-0.6 4,-0.1 -0.500 86.4 121.5 78.9-152.3 45.6 60.5 26.4 42 42 A K + 0 0 178 1,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.682 57.2 107.4 67.8 16.4 42.2 59.9 27.7 43 43 A T S S- 0 0 30 5,-0.1 3,-0.4 1,-0.1 -1,-0.3 -0.875 84.2-110.4-122.0 159.2 42.5 62.8 30.1 44 44 A G S S+ 0 0 25 -2,-0.3 64,-0.2 1,-0.2 65,-0.1 0.851 121.3 39.4 -54.3 -38.9 41.0 66.2 30.1 45 45 A S S S- 0 0 0 62,-2.3 -1,-0.2 2,-0.3 63,-0.1 0.678 108.4-123.2 -84.3 -19.9 44.3 67.9 29.3 46 46 A S + 0 0 46 61,-0.4 -5,-0.2 -3,-0.4 -2,-0.1 0.188 61.0 154.9 92.6 -10.4 45.4 65.1 26.9 47 47 A Y + 0 0 29 60,-0.3 -1,-0.3 -7,-0.1 -2,-0.3 -0.774 40.0 40.0-103.8 149.1 48.5 64.6 29.0 48 48 A P S S+ 0 0 0 0, 0.0 -7,-2.6 0, 0.0 2,-0.3 0.594 83.5 153.6 -78.7 160.7 50.4 62.5 29.5 49 49 A H E -D 95 0A 46 46,-1.6 46,-2.4 -9,-0.2 -9,-0.1 -0.986 48.4 -65.5-149.5 161.3 50.5 61.1 25.9 50 50 A W E -D 94 0A 52 -2,-0.3 2,-0.7 44,-0.2 44,-0.3 -0.158 35.8-156.0 -48.5 126.0 52.7 59.2 23.5 51 51 A F E -D 93 0A 21 42,-3.5 42,-0.6 1,-0.1 -1,-0.1 -0.925 5.8-163.4-105.2 106.6 55.9 61.0 22.5 52 52 A T > - 0 0 54 -2,-0.7 3,-2.6 1,-0.1 -1,-0.1 0.696 7.5-156.2 -65.8 -22.8 56.9 59.4 19.1 53 53 A N T 3 S- 0 0 14 1,-0.3 -1,-0.1 14,-0.1 3,-0.1 0.817 76.6 -50.4 46.0 33.4 60.5 60.6 19.1 54 54 A G T 3 S+ 0 0 10 1,-0.3 8,-3.1 13,-0.1 -1,-0.3 0.424 115.5 106.5 90.7 0.9 60.2 60.3 15.3 55 55 A Y B < -H 61 0B 34 -3,-2.6 -1,-0.3 6,-0.2 6,-0.2 -0.576 59.3-131.8-107.9 170.4 58.8 56.7 15.0 56 56 A D > - 0 0 46 4,-1.8 3,-1.1 -2,-0.2 25,-0.1 -0.460 50.7 -80.4-104.2-175.3 55.4 55.2 14.1 57 57 A G T 3 S+ 0 0 17 1,-0.3 24,-1.9 -2,-0.2 -2,-0.0 0.693 126.4 57.5 -63.2 -21.0 53.8 52.4 16.3 58 58 A N B 3 S-I 80 0C 110 22,-0.2 -1,-0.3 2,-0.1 22,-0.2 -0.101 120.3-100.9-101.0 34.7 55.9 49.6 14.8 59 59 A G S < S+ 0 0 22 -3,-1.1 2,-0.5 20,-0.5 -2,-0.1 0.696 76.3 147.1 57.6 17.8 59.3 51.2 15.7 60 60 A K - 0 0 117 19,-0.1 -4,-1.8 -4,-0.1 2,-0.3 -0.766 48.3-126.2 -89.7 126.5 59.6 52.4 12.1 61 61 A L B -H 55 0B 81 -2,-0.5 -6,-0.2 -6,-0.2 2,-0.2 -0.512 20.3-118.5 -74.7 131.8 61.5 55.7 11.8 62 62 A I > - 0 0 68 -8,-3.1 3,-0.6 -2,-0.3 -1,-0.1 -0.512 43.7 -96.9 -67.9 133.6 59.7 58.5 9.9 63 63 A K T 3 S+ 0 0 195 1,-0.2 -1,-0.1 -2,-0.2 3,-0.1 -0.184 107.1 19.4 -53.6 142.0 61.9 59.4 7.0 64 64 A G T 3 S+ 0 0 68 1,-0.2 2,-0.4 -3,-0.1 -1,-0.2 0.873 99.2 123.9 65.0 39.0 64.1 62.4 7.5 65 65 A R < - 0 0 134 -3,-0.6 -1,-0.2 -11,-0.1 -4,-0.0 -0.995 45.5-162.8-135.8 137.3 63.9 62.2 11.3 66 66 A T - 0 0 135 -2,-0.4 3,-0.1 -3,-0.1 -12,-0.1 -0.952 23.1-139.0-117.2 111.0 66.6 61.8 13.9 67 67 A P - 0 0 26 0, 0.0 2,-0.3 0, 0.0 -13,-0.1 -0.228 30.4 -96.1 -64.2 161.2 65.2 60.7 17.3 68 68 A I - 0 0 30 -15,-0.1 2,-0.8 1,-0.0 77,-0.0 -0.645 34.2-132.7 -77.2 133.5 66.5 62.3 20.4 69 69 A K + 0 0 168 -2,-0.3 7,-0.1 1,-0.2 -1,-0.0 -0.826 27.3 178.4 -89.0 113.8 69.3 60.2 21.9 70 70 A F - 0 0 24 -2,-0.8 -1,-0.2 2,-0.2 3,-0.1 0.759 37.1-125.4 -88.1 -26.1 68.5 59.9 25.6 71 71 A G S S+ 0 0 69 1,-0.2 2,-0.4 2,-0.1 3,-0.1 0.670 78.3 99.1 90.4 17.0 71.4 57.7 26.7 72 72 A K S >> S- 0 0 85 1,-0.1 4,-1.8 5,-0.0 3,-1.7 -0.968 72.0-135.0-137.9 118.2 69.4 54.9 28.3 73 73 A A H 3> S+ 0 0 84 -2,-0.4 4,-1.1 1,-0.3 3,-0.4 0.855 106.4 52.5 -38.0 -53.9 68.7 51.7 26.4 74 74 A D H 34 S+ 0 0 97 1,-0.2 -1,-0.3 2,-0.2 3,-0.2 0.836 113.0 45.1 -53.8 -35.8 65.0 51.7 27.4 75 75 A b H <4 S+ 0 0 2 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.747 114.4 47.0 -81.6 -26.1 64.6 55.3 26.2 76 76 A D H < S+ 0 0 55 -4,-1.8 -2,-0.2 -3,-0.4 -1,-0.2 0.444 84.0 109.6 -97.2 -1.3 66.4 54.8 23.0 77 77 A R S < S- 0 0 152 -4,-1.1 -18,-0.1 -5,-0.3 14,-0.0 -0.534 82.1-102.4 -76.4 138.7 64.7 51.6 21.8 78 78 A P - 0 0 59 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.304 51.5-111.0 -54.3 143.2 62.3 52.0 18.9 79 79 A P - 0 0 8 0, 0.0 -20,-0.5 0, 0.0 2,-0.5 -0.313 16.8-150.8 -82.7 164.3 58.8 51.9 20.3 80 80 A K B +IJ 58 91C 73 11,-2.8 11,-1.8 -22,-0.2 2,-0.5 -0.929 29.9 167.7-128.4 99.9 55.9 49.5 20.2 81 81 A H - 0 0 25 -24,-1.9 2,-0.1 -2,-0.5 -22,-0.0 -0.933 16.0-161.0-125.0 109.4 52.8 51.6 20.4 82 82 A S > - 0 0 40 -2,-0.5 3,-1.8 5,-0.0 -2,-0.0 -0.281 42.4 -81.4 -80.9 170.7 49.4 50.0 19.7 83 83 A Q T 3 S+ 0 0 189 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.829 130.9 27.1 -36.6 -58.5 46.2 51.9 18.9 84 84 A N T 3 S- 0 0 76 -43,-0.0 -44,-0.4 -45,-0.0 -1,-0.3 0.425 103.5-124.8 -90.7 1.6 45.2 52.7 22.4 85 85 A G S < S+ 0 0 0 -3,-1.8 -2,-0.1 1,-0.1 7,-0.1 0.782 90.4 98.0 60.9 24.4 48.8 52.7 23.7 86 86 A M + 0 0 91 -47,-0.1 -1,-0.1 -46,-0.0 -3,-0.1 0.245 43.2 139.8-125.9 11.4 47.6 50.1 26.2 87 87 A G > - 0 0 18 1,-0.2 3,-1.5 2,-0.1 -5,-0.0 -0.172 63.3-117.5 -54.5 151.2 48.7 46.8 24.6 88 88 A K T 3 S+ 0 0 203 1,-0.3 -1,-0.2 0, 0.0 -2,-0.0 0.156 114.6 42.8 -79.7 22.8 50.1 44.2 27.1 89 89 A D T 3 S+ 0 0 95 -9,-0.1 -1,-0.3 0, 0.0 2,-0.1 0.165 86.2 130.1-147.7 9.1 53.4 44.4 25.1 90 90 A D < + 0 0 9 -3,-1.5 2,-0.3 -11,-0.0 -9,-0.2 -0.439 25.5 172.4 -79.1 147.3 53.7 48.1 24.6 91 91 A H B +J 80 0C 48 -11,-1.8 -11,-2.8 -2,-0.1 2,-0.3 -0.886 23.2 126.8-153.3 114.5 56.8 50.1 25.3 92 92 A Y E - E 0 125A 7 33,-0.8 33,-2.5 -2,-0.3 2,-0.3 -0.951 55.2 -82.0-159.3 174.4 57.1 53.7 24.2 93 93 A L E -DE 51 124A 13 -42,-0.6 -42,-3.5 -2,-0.3 2,-0.3 -0.686 32.1-160.1 -93.4 141.6 57.8 57.2 25.5 94 94 A L E -DE 50 123A 0 29,-3.1 29,-2.1 -2,-0.3 2,-0.4 -0.897 5.6-151.8-114.3 145.2 55.3 59.4 27.2 95 95 A E E +DE 49 122A 20 -46,-2.4 -46,-1.6 -2,-0.3 27,-0.2 -0.923 16.7 175.2-117.0 146.4 55.6 63.2 27.6 96 96 A F E - E 0 121A 2 25,-1.2 25,-2.8 -2,-0.4 -63,-0.1 -0.990 38.4 -94.3-149.6 140.0 54.1 65.2 30.4 97 97 A P E - E 0 120A 0 0, 0.0 8,-0.4 0, 0.0 2,-0.3 -0.266 43.4-177.1 -57.1 137.2 54.3 68.9 31.3 98 98 A T - 0 0 2 21,-1.7 21,-0.4 18,-0.3 6,-0.1 -0.995 5.0-162.3-138.6 144.0 57.0 69.8 33.8 99 99 A F > - 0 0 28 4,-0.4 3,-2.2 -2,-0.3 -74,-0.3 -0.885 33.0-114.7-127.1 156.6 57.9 73.1 35.4 100 100 A P T 3 S+ 0 0 57 0, 0.0 -75,-0.3 0, 0.0 -1,-0.1 0.905 117.8 54.0 -54.9 -39.5 60.8 74.8 37.2 101 101 A D T 3 S- 0 0 110 1,-0.1 -77,-0.1 -77,-0.1 -3,-0.0 0.519 107.6-130.5 -74.0 -3.7 58.7 75.0 40.4 102 102 A G < + 0 0 15 -3,-2.2 -1,-0.1 1,-0.2 3,-0.1 0.394 49.4 154.5 73.6 -0.5 58.0 71.3 40.2 103 103 A H - 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