==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 31-JAN-97 2CGP . COMPND 2 MOLECULE: DNA (5'-D(*GP*TP*CP*AP*CP*AP*TP*TP*AP*AP*T)-3'); . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.M.PASSNER,T.A.STEITZ . 200 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11683.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 151 75.5 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 . 51 25.5 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 . 1 0.5 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 . 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 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 32.5 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+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 1 1 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 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 . 1 2 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 D > 0 0 91 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 129.2 -40.9 52.9 8.4 2 9 A P H > + 0 0 115 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.881 360.0 49.4 -65.1 -42.1 -41.2 56.7 9.0 3 10 A T H > S+ 0 0 20 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.847 112.2 49.6 -67.6 -35.0 -38.3 56.8 11.5 4 11 A L H > S+ 0 0 38 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.943 109.1 46.8 -71.3 -51.6 -36.0 54.8 9.2 5 12 A E H X S+ 0 0 149 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.861 115.2 50.9 -59.5 -32.3 -36.5 56.8 5.9 6 13 A W H < S+ 0 0 69 -4,-1.4 3,-0.5 -5,-0.2 -1,-0.2 0.919 111.7 45.1 -68.2 -48.2 -36.0 59.9 8.0 7 14 A F H >< S+ 0 0 1 -4,-1.9 3,-1.9 1,-0.2 -2,-0.2 0.931 111.6 53.5 -61.3 -44.7 -32.8 58.6 9.6 8 15 A L H >< S+ 0 0 46 -4,-3.3 3,-1.1 1,-0.3 -1,-0.2 0.686 96.2 67.6 -66.0 -18.8 -31.5 57.4 6.2 9 16 A S T 3< S+ 0 0 83 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.561 100.8 49.2 -78.4 -8.4 -32.1 60.9 4.8 10 17 A H T < S+ 0 0 58 -3,-1.9 2,-0.3 -4,-0.2 -1,-0.2 0.254 101.1 88.4-108.6 7.9 -29.2 62.1 7.0 11 18 A C S < S- 0 0 13 -3,-1.1 2,-0.6 79,-0.1 79,-0.2 -0.715 71.3-133.8-107.4 156.2 -27.0 59.3 5.9 12 19 A H E -A 89 0A 134 77,-2.8 77,-1.4 -2,-0.3 2,-0.4 -0.956 25.5-134.9-110.2 118.8 -24.6 59.0 3.0 13 20 A I E -A 88 0A 87 -2,-0.6 2,-0.3 75,-0.2 75,-0.2 -0.623 23.7-177.1 -79.4 131.3 -24.9 55.8 1.0 14 21 A H E -A 87 0A 88 73,-3.0 73,-3.2 -2,-0.4 2,-0.3 -0.928 14.7-142.7-124.2 147.2 -21.7 53.9 0.1 15 22 A K E -A 86 0A 149 -2,-0.3 71,-0.2 71,-0.2 69,-0.0 -0.829 12.7-167.3-110.1 151.2 -21.5 50.7 -2.0 16 23 A Y E -A 85 0A 47 69,-2.4 69,-2.6 -2,-0.3 2,-0.1 -1.000 19.9-125.0-138.3 134.9 -19.0 47.9 -1.4 17 24 A P > - 0 0 91 0, 0.0 3,-1.7 0, 0.0 64,-0.3 -0.429 48.0 -80.2 -76.3 158.9 -18.1 45.0 -3.6 18 25 A S T 3 S+ 0 0 55 1,-0.2 64,-0.2 64,-0.1 66,-0.1 -0.237 115.4 21.6 -57.4 146.4 -18.5 41.5 -2.2 19 26 A K T 3 S+ 0 0 181 62,-2.1 -1,-0.2 1,-0.3 63,-0.1 0.272 92.2 127.5 77.9 -7.1 -15.6 40.3 -0.1 20 27 A S < - 0 0 29 -3,-1.7 61,-2.6 60,-0.1 2,-0.6 -0.284 63.0-114.2 -75.3 164.2 -14.4 43.8 0.8 21 28 A T E +D 80 0B 52 59,-0.2 59,-0.3 1,-0.2 3,-0.1 -0.909 28.4 179.8-108.1 119.6 -13.9 44.9 4.3 22 29 A L E S+ 0 0 8 57,-1.7 2,-0.4 -2,-0.6 58,-0.2 0.843 73.8 27.5 -79.1 -41.5 -16.2 47.6 5.7 23 30 A I E -D 79 0B 8 56,-1.5 56,-1.8 52,-0.0 2,-0.5 -0.973 69.3-149.7-127.7 140.1 -14.8 47.9 9.2 24 31 A H > - 0 0 72 -2,-0.4 3,-1.7 54,-0.2 51,-0.4 -0.955 24.3-120.7-113.2 124.1 -11.2 47.1 10.4 25 32 A Q T 3 S+ 0 0 82 -2,-0.5 51,-0.2 1,-0.2 53,-0.1 -0.282 96.3 28.4 -61.6 137.2 -10.8 45.9 13.9 26 33 A G T 3 S+ 0 0 28 49,-2.2 -1,-0.2 1,-0.3 3,-0.1 0.080 93.2 117.3 99.9 -22.7 -8.5 48.1 16.0 27 34 A E S < S- 0 0 106 -3,-1.7 48,-2.4 1,-0.1 -1,-0.3 -0.302 76.5 -82.4 -79.7 161.4 -9.3 51.4 14.2 28 35 A K B -G 74 0C 116 46,-0.2 2,-0.7 -3,-0.1 46,-0.2 -0.413 40.6-137.2 -63.4 133.0 -11.0 54.5 15.7 29 36 A A + 0 0 7 44,-2.7 44,-0.4 1,-0.2 43,-0.2 -0.858 51.0 133.7 -96.4 114.5 -14.8 54.2 15.7 30 37 A E + 0 0 120 -2,-0.7 62,-2.8 1,-0.1 2,-0.4 0.370 56.4 69.4-138.0 0.1 -16.4 57.4 14.6 31 38 A T E -B 91 0A 41 60,-0.3 2,-0.4 -3,-0.2 60,-0.2 -0.943 58.7-150.1-133.3 144.3 -19.0 56.1 12.2 32 39 A L E -B 90 0A 1 58,-2.9 58,-1.8 -2,-0.4 2,-0.2 -0.847 17.9-159.7-108.4 141.9 -22.3 54.2 12.3 33 40 A Y E -BC 89 63A 21 30,-2.9 30,-1.5 -2,-0.4 2,-0.3 -0.711 10.6-169.9-117.1 171.3 -23.4 51.9 9.5 34 41 A Y E -BC 88 62A 23 54,-1.3 54,-2.5 28,-0.3 2,-0.7 -0.841 27.0-123.7-163.2 118.0 -26.8 50.5 8.4 35 42 A I E +B 87 0A 0 26,-2.8 25,-3.4 23,-0.3 26,-0.3 -0.557 28.8 173.3 -73.7 107.0 -27.2 47.8 5.7 36 43 A V E S+ 0 0 49 50,-1.7 2,-0.3 -2,-0.7 51,-0.2 0.814 75.0 0.2 -79.1 -32.4 -29.6 49.0 3.0 37 44 A K E S+B 86 0A 123 49,-2.1 49,-1.8 22,-0.1 -1,-0.3 -0.988 108.5 19.8-155.7 148.5 -28.9 45.9 0.8 38 45 A G S S- 0 0 4 -2,-0.3 2,-0.3 47,-0.2 47,-0.1 -0.207 71.5 -90.7 87.0-179.1 -26.8 42.8 1.0 39 46 A S - 0 0 18 19,-0.2 43,-2.8 45,-0.2 44,-1.5 -0.896 28.4-165.8-135.2 161.7 -25.1 40.9 3.9 40 47 A V E -EF 57 81B 0 17,-2.5 17,-1.9 -2,-0.3 2,-0.4 -0.848 18.3-123.3-137.5 175.0 -21.8 40.9 5.8 41 48 A A E -EF 56 80B 7 39,-2.4 39,-2.1 -2,-0.3 2,-0.5 -0.986 13.6-149.4-127.7 130.6 -19.9 38.8 8.3 42 49 A V E +EF 55 79B 22 13,-3.6 12,-2.4 -2,-0.4 13,-1.4 -0.905 32.4 170.1 -97.7 124.4 -18.6 40.0 11.6 43 50 A L E -EF 53 78B 4 35,-3.0 35,-3.2 -2,-0.5 2,-0.3 -0.973 27.1-155.3-144.2 157.8 -15.4 38.3 12.6 44 51 A I E -E 52 0B 64 8,-2.3 8,-2.4 -2,-0.3 2,-0.3 -0.865 13.2-147.6-123.6 158.7 -12.5 38.2 15.0 45 52 A K E -E 51 0B 79 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.944 9.5-132.4-128.8 150.7 -9.0 36.8 14.8 46 53 A D > - 0 0 45 4,-2.0 3,-2.0 -2,-0.3 6,-0.0 -0.340 46.6 -82.7 -89.7 179.2 -6.6 35.2 17.2 47 54 A E T 3 S+ 0 0 165 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.690 130.0 43.2 -53.4 -24.0 -2.9 36.1 17.6 48 55 A E T 3 S- 0 0 154 2,-0.1 -1,-0.3 0, 0.0 0, 0.0 0.047 123.2 -92.9-115.4 24.8 -2.0 33.8 14.7 49 56 A G S < S+ 0 0 42 -3,-2.0 -2,-0.1 1,-0.3 2,-0.0 0.281 70.9 147.0 89.6 -16.2 -4.7 34.6 12.1 50 57 A K - 0 0 160 -5,-0.1 -4,-2.0 1,-0.1 2,-0.4 -0.380 38.2-143.1 -56.9 134.9 -7.4 32.0 12.9 51 58 A E E -E 45 0B 50 -6,-0.2 2,-0.4 -2,-0.0 -6,-0.2 -0.822 18.5-170.4-109.5 144.6 -10.8 33.5 12.2 52 59 A M E -E 44 0B 34 -8,-2.4 -8,-2.3 -2,-0.4 2,-0.6 -0.999 20.6-136.6-129.9 125.2 -14.1 33.1 14.1 53 60 A I E -E 43 0B 8 114,-2.3 -10,-0.3 -2,-0.4 3,-0.1 -0.758 18.2-176.1 -85.7 118.0 -17.4 34.4 12.6 54 61 A L E - 0 0 54 -12,-2.4 2,-0.3 -2,-0.6 -11,-0.2 0.811 63.9 -26.4 -80.2 -35.3 -19.4 36.1 15.4 55 62 A S E -E 42 0B 34 -13,-1.4 -13,-3.6 2,-0.0 2,-0.4 -0.970 49.0-126.1-173.9 158.0 -22.4 36.9 13.3 56 63 A Y E -E 41 0B 49 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.876 28.8-161.0-107.7 147.8 -23.8 37.6 9.8 57 64 A L E -E 40 0B 9 -17,-1.9 -17,-2.5 -2,-0.4 2,-0.2 -0.980 11.2-178.9-132.9 144.9 -25.8 40.8 9.4 58 65 A N > - 0 0 70 -2,-0.4 3,-1.8 -19,-0.2 -23,-0.3 -0.548 41.4 -26.4-130.7-169.0 -28.2 41.6 6.6 59 66 A Q T 3 S+ 0 0 109 1,-0.3 -1,-0.2 -2,-0.2 -23,-0.2 -0.139 125.3 23.0 -42.0 129.2 -30.6 44.2 5.2 60 67 A G T 3 S+ 0 0 24 -25,-3.4 2,-0.4 1,-0.3 -1,-0.3 0.508 93.6 123.5 88.6 4.9 -31.9 46.4 7.9 61 68 A D < - 0 0 31 -3,-1.8 -26,-2.8 -26,-0.3 -1,-0.3 -0.814 54.8-134.3-104.4 140.6 -29.0 45.9 10.4 62 69 A F E -C 34 0A 1 -2,-0.4 2,-0.3 -28,-0.2 -28,-0.3 -0.521 24.6-171.9 -83.0 155.8 -26.9 48.6 12.0 63 70 A I E +C 33 0A 5 -30,-1.5 -30,-2.9 -2,-0.2 16,-0.0 -0.925 60.9 35.0-141.8 162.6 -23.1 48.0 12.1 64 71 A G S > S+ 0 0 12 -2,-0.3 3,-0.6 -32,-0.2 4,-0.1 0.659 76.3 127.4 65.5 19.8 -20.3 49.8 13.8 65 72 A E G > + 0 0 12 1,-0.2 3,-1.8 2,-0.1 4,-0.3 0.738 44.9 81.4 -81.5 -23.6 -22.5 50.7 16.8 66 73 A L G 3 S+ 0 0 90 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 0.680 90.8 52.5 -60.0 -17.2 -20.3 49.5 19.6 67 74 A G G X S+ 0 0 4 -3,-0.6 3,-1.1 -36,-0.2 6,-0.3 0.569 85.5 89.2 -95.4 -6.1 -18.2 52.6 19.7 68 75 A L T < S+ 0 0 3 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.1 0.779 79.2 55.2 -60.5 -35.6 -21.0 55.1 19.9 69 76 A F T 3 S+ 0 0 115 -4,-0.3 2,-0.3 -3,-0.3 -1,-0.2 0.331 110.4 35.1 -89.4 9.8 -21.4 55.4 23.6 70 77 A E S X S- 0 0 124 -3,-1.1 3,-0.5 -4,-0.0 -1,-0.1 -0.920 81.3-110.7-163.8 133.4 -17.9 56.4 24.6 71 78 A E T 3 S+ 0 0 145 -2,-0.3 -41,-0.1 1,-0.2 -2,-0.0 -0.181 95.0 24.4 -62.5 153.4 -15.1 58.5 23.1 72 79 A G T 3 S+ 0 0 52 1,-0.2 2,-0.3 -43,-0.2 -1,-0.2 0.812 80.8 157.0 61.9 37.8 -11.9 56.9 21.8 73 80 A Q < - 0 0 58 -3,-0.5 -44,-2.7 -44,-0.4 2,-0.3 -0.672 31.5-141.7 -93.7 148.5 -13.4 53.4 21.1 74 81 A E B -G 28 0C 120 -2,-0.3 -46,-0.2 -46,-0.2 -47,-0.1 -0.777 33.5 -90.1-107.3 152.3 -11.8 51.0 18.7 75 82 A R - 0 0 20 -48,-2.4 -49,-2.2 -51,-0.4 -1,-0.1 -0.415 33.7-151.2 -59.5 130.0 -13.7 48.7 16.3 76 83 A S + 0 0 73 -51,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.609 69.0 5.2 -82.9 -12.1 -14.2 45.5 18.2 77 84 A A S S- 0 0 7 -33,-0.1 2,-0.3 -53,-0.1 -33,-0.2 -0.893 77.9 -92.2-156.1 179.8 -14.2 43.2 15.2 78 85 A W E - F 0 43B 55 -35,-3.2 -35,-3.0 -2,-0.3 2,-0.4 -0.819 29.6-161.2-102.4 145.8 -13.8 43.0 11.4 79 86 A V E -DF 23 42B 6 -56,-1.8 -57,-1.7 -2,-0.3 -56,-1.5 -0.997 11.1-179.6-131.1 122.6 -16.8 43.3 9.1 80 87 A R E -DF 21 41B 63 -39,-2.1 -39,-2.4 -2,-0.4 -59,-0.2 -0.972 33.4-108.6-124.3 145.1 -16.6 42.1 5.5 81 88 A A E - F 0 40B 3 -61,-2.6 -62,-2.1 -2,-0.4 -41,-0.3 -0.494 23.9-171.9 -72.2 127.6 -19.2 42.1 2.7 82 89 A K S S+ 0 0 78 -43,-2.8 2,-0.3 1,-0.3 -42,-0.2 0.667 80.9 10.3 -88.1 -28.8 -20.5 38.6 2.0 83 90 A T S S- 0 0 62 -44,-1.5 -1,-0.3 -66,-0.1 -64,-0.1 -0.886 112.3 -66.5-138.2 167.0 -22.4 39.9 -1.0 84 91 A A - 0 0 65 -2,-0.3 2,-0.3 -66,-0.1 -45,-0.2 -0.350 65.0-150.8 -58.7 135.9 -22.2 43.3 -2.7 85 92 A C E -A 16 0A 6 -69,-2.6 -69,-2.4 -47,-0.1 2,-0.5 -0.839 27.6-159.9-117.1 157.8 -23.5 45.8 -0.3 86 93 A E E -AB 15 37A 52 -49,-1.8 -49,-2.1 -2,-0.3 -50,-1.7 -0.996 29.3-178.3-130.3 113.3 -25.2 49.2 -0.2 87 94 A V E -AB 14 35A 0 -73,-3.2 -73,-3.0 -2,-0.5 2,-0.2 -0.987 22.7-142.7-125.5 125.5 -24.6 50.7 3.2 88 95 A A E -AB 13 34A 1 -54,-2.5 -54,-1.3 -2,-0.4 2,-0.3 -0.627 26.5-166.8 -80.5 146.6 -25.9 54.0 4.6 89 96 A E E +AB 12 33A 19 -77,-1.4 -77,-2.8 -2,-0.2 2,-0.3 -0.971 15.0 169.4-138.7 151.9 -23.3 55.7 6.8 90 97 A I E - B 0 32A 10 -58,-1.8 -58,-2.9 -2,-0.3 -79,-0.1 -0.974 36.7-102.3-160.1 144.1 -23.3 58.6 9.3 91 98 A S E > - B 0 31A 54 -2,-0.3 4,-2.1 -60,-0.2 -60,-0.3 -0.351 30.4-120.5 -69.5 153.7 -20.9 60.1 11.8 92 99 A Y H > S+ 0 0 6 -62,-2.8 4,-2.9 1,-0.2 5,-0.3 0.959 112.5 57.8 -56.8 -50.2 -21.5 59.3 15.5 93 100 A K H > S+ 0 0 132 -63,-0.3 4,-1.3 1,-0.3 -1,-0.2 0.876 108.2 43.3 -47.8 -50.9 -21.9 63.0 16.2 94 101 A K H > S+ 0 0 78 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.891 113.4 52.6 -68.2 -35.7 -24.7 63.5 13.7 95 102 A F H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.911 104.6 55.5 -64.9 -39.9 -26.4 60.3 14.9 96 103 A R H X S+ 0 0 79 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.835 107.3 51.6 -60.2 -32.0 -26.3 61.6 18.5 97 104 A Q H X S+ 0 0 106 -4,-1.3 4,-1.9 -5,-0.3 -1,-0.2 0.865 106.9 50.7 -73.7 -37.5 -28.1 64.7 17.4 98 105 A L H X S+ 0 0 11 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.839 105.3 59.1 -67.8 -31.8 -30.9 62.7 15.7 99 106 A I H < S+ 0 0 21 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.865 105.6 49.2 -62.9 -38.7 -31.2 60.7 18.9 100 107 A Q H < S+ 0 0 156 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.941 113.6 43.1 -68.6 -47.2 -32.0 64.0 20.7 101 108 A V H < S+ 0 0 110 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.872 138.3 10.4 -67.0 -33.3 -34.6 65.2 18.3 102 109 A N >< - 0 0 53 -4,-2.5 3,-0.9 -5,-0.2 4,-0.3 -0.871 59.1-170.5-150.2 109.9 -36.1 61.6 18.2 103 110 A P T 3> S+ 0 0 86 0, 0.0 4,-1.1 0, 0.0 3,-0.3 0.494 75.7 86.0 -77.3 -3.5 -35.0 58.9 20.7 104 111 A D H 3> S+ 0 0 59 1,-0.2 4,-1.1 2,-0.2 -5,-0.1 0.729 82.3 58.0 -70.0 -23.3 -36.9 56.3 18.7 105 112 A I H <> S+ 0 0 0 -3,-0.9 4,-1.3 2,-0.2 -1,-0.2 0.818 104.5 50.6 -76.8 -28.3 -33.9 55.7 16.4 106 113 A L H > S+ 0 0 46 -3,-0.3 4,-2.6 -4,-0.3 -2,-0.2 0.796 105.7 58.6 -75.3 -26.1 -31.8 54.8 19.4 107 114 A M H X S+ 0 0 133 -4,-1.1 4,-1.6 1,-0.2 -2,-0.2 0.835 104.3 49.6 -69.5 -35.9 -34.6 52.4 20.3 108 115 A R H X S+ 0 0 64 -4,-1.1 4,-1.1 2,-0.2 -1,-0.2 0.868 112.1 48.7 -70.2 -37.2 -34.1 50.6 17.0 109 116 A L H >X S+ 0 0 0 -4,-1.3 4,-1.8 2,-0.2 3,-0.6 0.957 111.5 47.5 -66.6 -53.3 -30.4 50.4 17.6 110 117 A S H 3X S+ 0 0 53 -4,-2.6 4,-2.9 1,-0.3 5,-0.2 0.811 103.2 62.7 -59.5 -34.7 -30.7 49.0 21.1 111 118 A A H 3X S+ 0 0 44 -4,-1.6 4,-1.9 1,-0.2 -1,-0.3 0.908 108.8 43.0 -58.5 -39.9 -33.3 46.4 20.0 112 119 A Q H - 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