==== 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 ISOMERASE 23-DEC-05 2CB0 . COMPND 2 MOLECULE: GLUCOSAMINE-FRUCTOSE-6-PHOSPHATE . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR K.J.KIM,M.H.KIM,B.S.KANG . 653 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22953.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 488 74.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 93 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 52 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 234 35.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.8 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 1 3 2 0 2 1 3 0 0 6 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 7 5 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 X > 0 0 103 0, 0.0 4,-2.0 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 131.5 35.4 33.7 38.8 2 2 A K H > + 0 0 88 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.856 360.0 57.7 -56.4 -47.8 33.7 37.1 38.6 3 3 A T H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.870 111.0 43.1 -53.7 -44.9 30.2 35.9 37.9 4 4 A L H > S+ 0 0 24 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.899 114.6 48.9 -70.2 -44.5 30.1 33.8 41.1 5 5 A T H < S+ 0 0 74 -4,-2.0 4,-0.5 2,-0.2 -2,-0.2 0.899 112.9 49.3 -57.6 -42.6 31.7 36.4 43.3 6 6 A E H >< S+ 0 0 8 -4,-3.0 3,-1.0 1,-0.2 -2,-0.2 0.908 108.0 52.0 -70.3 -41.0 29.2 39.0 41.9 7 7 A I H >< S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.922 109.5 52.2 -56.4 -43.0 26.2 36.7 42.6 8 8 A K T 3< S+ 0 0 89 -4,-2.1 -1,-0.2 1,-0.3 4,-0.2 0.599 95.4 68.4 -73.3 -8.7 27.5 36.3 46.1 9 9 A Q T <> + 0 0 73 -3,-1.0 4,-2.5 -4,-0.5 3,-0.5 0.421 69.8 108.0 -85.3 0.3 27.7 40.1 46.5 10 10 A T H <> S+ 0 0 1 -3,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.841 73.9 49.5 -48.6 -49.2 23.9 40.1 46.4 11 11 A P H > S+ 0 0 11 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.874 114.1 45.9 -61.0 -38.5 23.3 40.9 50.2 12 12 A K H > S+ 0 0 137 -3,-0.5 4,-2.3 -4,-0.2 -2,-0.2 0.858 107.9 58.9 -72.5 -34.4 25.8 43.9 50.0 13 13 A G H X S+ 0 0 2 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.817 101.4 54.1 -58.6 -36.4 24.1 45.0 46.8 14 14 A I H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.912 108.5 49.3 -64.9 -42.9 20.8 45.3 48.6 15 15 A I H X S+ 0 0 53 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.925 111.5 48.5 -63.1 -42.3 22.4 47.6 51.1 16 16 A K H X S+ 0 0 79 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.902 109.0 54.5 -63.2 -44.0 24.0 49.7 48.3 17 17 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.892 106.5 50.4 -54.9 -45.9 20.5 49.8 46.7 18 18 A D H X S+ 0 0 38 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.897 110.5 50.6 -60.8 -39.6 19.0 51.2 49.9 19 19 A E H X S+ 0 0 107 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.935 110.8 48.1 -63.0 -44.3 21.8 53.9 50.0 20 20 A S H X S+ 0 0 3 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.896 112.1 49.5 -62.6 -48.5 21.1 54.9 46.3 21 21 A F H >X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 3,-0.8 0.942 109.9 51.5 -50.3 -54.7 17.4 55.1 47.0 22 22 A N H 3< S+ 0 0 63 -4,-2.7 4,-0.3 1,-0.3 3,-0.3 0.880 105.7 55.6 -58.3 -36.0 18.0 57.3 50.1 23 23 A Q H 3< S+ 0 0 125 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.823 120.5 28.8 -63.2 -33.3 20.2 59.6 48.1 24 24 A V H XX S+ 0 0 19 -4,-1.2 3,-1.8 -3,-0.8 4,-1.8 0.509 86.5 104.4-106.2 -5.3 17.5 60.3 45.5 25 25 A K T 3< S+ 0 0 51 -4,-1.6 -1,-0.1 1,-0.3 -2,-0.1 0.749 89.9 37.6 -60.6 -29.5 14.2 59.8 47.4 26 26 A D T 34 S+ 0 0 131 -4,-0.3 -1,-0.3 -3,-0.2 3,-0.1 0.529 114.9 56.2 -95.7 -5.2 13.4 63.6 47.8 27 27 A K T <4 S+ 0 0 150 -3,-1.8 2,-0.5 1,-0.2 -2,-0.2 0.711 108.5 46.4 -89.7 -28.2 14.7 64.4 44.3 28 28 A I < - 0 0 5 -4,-1.8 2,-0.7 94,-0.0 -1,-0.2 -0.969 59.3-173.1-128.0 117.1 12.6 62.0 42.4 29 29 A R - 0 0 184 -2,-0.5 121,-0.1 -3,-0.1 -3,-0.1 -0.910 22.3-141.1-110.5 103.0 8.8 61.5 42.8 30 30 A L - 0 0 3 -2,-0.7 2,-0.1 119,-0.3 4,-0.1 -0.450 17.6-147.2 -62.7 128.4 7.6 58.6 40.8 31 31 A P - 0 0 28 0, 0.0 27,-0.1 0, 0.0 -1,-0.1 -0.219 24.6-101.9 -87.4-176.4 4.1 59.3 39.2 32 32 A R S S+ 0 0 175 1,-0.1 27,-3.4 26,-0.1 2,-0.7 0.809 104.3 58.6 -79.3 -36.1 1.4 56.7 38.6 33 33 A R E +a 59 0A 106 25,-0.2 48,-3.0 46,-0.1 49,-1.1 -0.867 69.4 166.1-103.7 111.6 1.8 56.2 34.8 34 34 A I E -ab 60 82A 4 25,-2.4 27,-1.8 -2,-0.7 2,-0.4 -0.983 26.2-153.7-133.4 132.2 5.3 55.0 33.9 35 35 A L E -ab 61 83A 4 47,-2.3 49,-3.6 -2,-0.4 2,-0.5 -0.885 15.2-155.7-101.3 136.0 6.8 53.5 30.8 36 36 A Y E -ab 62 84A 0 25,-3.0 27,-1.5 -2,-0.4 2,-0.4 -0.927 10.3-175.5-117.8 128.7 9.8 51.2 31.2 37 37 A L E +ab 63 85A 0 47,-3.2 49,-2.0 -2,-0.5 2,-0.3 -0.985 19.1 134.4-128.4 130.3 12.4 50.6 28.5 38 38 A G E -ab 64 86A 0 25,-0.8 27,-1.1 -2,-0.4 2,-0.4 -0.960 39.4-123.1-161.0 168.7 15.4 48.2 28.6 39 39 A C > - 0 0 12 47,-0.5 3,-2.0 -2,-0.3 6,-0.1 -0.955 69.1 -24.9-123.7 144.2 17.2 45.6 26.6 40 40 A G T >> S+ 0 0 3 -2,-0.4 4,-1.6 1,-0.3 3,-1.1 -0.339 138.2 2.5 62.7-129.2 18.0 41.9 27.4 41 41 A S H 3> S+ 0 0 9 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.855 134.9 58.3 -52.6 -35.9 18.1 41.5 31.2 42 42 A S H <> S+ 0 0 8 -3,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.741 101.8 54.1 -74.9 -19.8 17.1 45.2 31.6 43 43 A H H <> S+ 0 0 15 -3,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.884 108.8 47.5 -72.4 -43.7 14.0 44.5 29.6 44 44 A F H X S+ 0 0 14 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.898 113.0 50.1 -65.6 -35.3 13.0 41.7 32.0 45 45 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.937 107.0 53.6 -64.9 -45.0 13.8 44.2 34.8 46 46 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.879 108.1 51.4 -50.0 -44.4 11.6 46.8 33.0 47 47 A K H X S+ 0 0 49 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.930 110.0 48.9 -59.4 -46.6 8.8 44.2 33.1 48 48 A L H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.910 111.7 48.2 -58.1 -46.1 9.3 43.6 36.8 49 49 A L H X S+ 0 0 1 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.889 109.9 53.0 -66.4 -37.4 9.3 47.3 37.5 50 50 A A H X S+ 0 0 6 -4,-2.3 4,-2.2 -5,-0.2 10,-0.3 0.943 107.8 52.9 -59.9 -44.1 6.1 47.7 35.4 51 51 A X H X S+ 0 0 10 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.893 108.6 46.7 -60.3 -44.0 4.4 45.0 37.5 52 52 A V H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.840 108.2 57.6 -69.7 -30.6 5.1 46.5 40.8 53 53 A T H <>S+ 0 0 0 -4,-1.7 5,-2.6 2,-0.2 -2,-0.2 0.944 111.2 42.5 -61.3 -48.3 3.9 49.8 39.5 54 54 A N H ><5S+ 0 0 17 -4,-2.2 3,-1.9 341,-0.3 -2,-0.2 0.908 110.1 57.2 -60.4 -43.7 0.6 48.1 38.7 55 55 A X H 3<5S+ 0 0 27 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.857 106.3 50.2 -61.7 -33.2 0.6 46.3 42.0 56 56 A H T 3<5S- 0 0 50 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.383 129.6 -92.0 -91.0 11.5 0.8 49.6 43.8 57 57 A G T < 5S+ 0 0 54 -3,-1.9 -3,-0.2 337,-0.3 -2,-0.1 0.579 91.9 107.9 95.5 11.7 -2.1 51.2 41.9 58 58 A G S > -a 38 0A 7 0, 0.0 4,-1.7 0, 0.0 3,-0.9 -0.402 40.9-117.1 -64.6 146.9 11.9 46.2 24.5 65 65 A C H 3> S+ 0 0 0 -27,-1.1 4,-2.7 1,-0.2 5,-0.1 0.865 113.9 53.0 -52.3 -41.9 13.6 49.4 23.2 66 66 A S H 3> S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.753 106.8 52.5 -69.9 -25.8 13.6 48.2 19.6 67 67 A E H <> S+ 0 0 0 -3,-0.9 4,-2.0 2,-0.2 -1,-0.2 0.804 110.8 48.0 -75.3 -33.2 9.8 47.6 19.8 68 68 A F H X S+ 0 0 13 -4,-1.7 4,-0.7 3,-0.2 -2,-0.2 0.926 114.7 47.2 -69.2 -43.5 9.4 51.1 21.0 69 69 A L H < S+ 0 0 22 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.909 130.5 16.7 -60.7 -46.2 11.6 52.3 18.2 70 70 A Y H < S+ 0 0 102 -4,-2.4 -3,-0.2 -5,-0.1 -2,-0.2 0.645 135.9 25.0-108.0 -17.9 9.9 50.4 15.4 71 71 A S H >< + 0 0 11 -4,-2.0 3,-1.9 -5,-0.2 4,-0.3 0.073 63.5 134.6-140.7 31.3 6.5 49.2 16.5 72 72 A K G >< + 0 0 87 -4,-0.7 3,-1.6 1,-0.3 5,-0.4 0.749 67.8 71.0 -56.3 -28.4 5.2 51.5 19.3 73 73 A E G 3 S+ 0 0 75 1,-0.3 -1,-0.3 -3,-0.1 305,-0.2 0.724 93.5 57.7 -56.2 -27.1 1.7 51.7 17.7 74 74 A A G < S+ 0 0 1 -3,-1.9 301,-0.3 -7,-0.2 -1,-0.3 0.551 97.4 77.1 -82.0 -9.5 1.1 48.0 18.6 75 75 A Y S < S- 0 0 33 -3,-1.6 2,-2.1 -4,-0.3 3,-0.4 -0.764 84.3-118.1-114.0 146.8 1.6 48.6 22.4 76 76 A P + 0 0 32 0, 0.0 -3,-0.1 0, 0.0 304,-0.0 -0.275 57.9 142.8 -80.3 59.8 -0.6 50.2 25.1 77 77 A I + 0 0 31 -2,-2.1 2,-0.1 -5,-0.4 -16,-0.1 0.915 22.9 170.1 -62.6 -46.7 1.7 53.0 25.9 78 78 A G - 0 0 66 -3,-0.4 -1,-0.2 1,-0.2 -3,-0.0 -0.439 60.8 -39.2 68.0-141.7 -0.9 55.7 26.5 79 79 A K - 0 0 168 -2,-0.1 -1,-0.2 -45,-0.0 -46,-0.1 -0.774 66.5-159.2-122.5 86.7 0.5 58.9 28.0 80 80 A P - 0 0 25 0, 0.0 -46,-0.2 0, 0.0 3,-0.1 -0.292 14.4-151.0 -64.1 149.6 3.2 58.1 30.5 81 81 A E S S+ 0 0 80 -48,-3.0 2,-0.3 1,-0.3 -47,-0.2 0.575 86.1 18.3 -92.6 -13.4 4.1 60.7 33.2 82 82 A L E -b 34 0A 6 -49,-1.1 -47,-2.3 22,-0.1 2,-0.5 -0.973 67.1-149.6-153.5 141.5 7.6 59.3 33.3 83 83 A V E -bc 35 106A 2 22,-1.8 24,-2.5 -2,-0.3 2,-0.5 -0.988 14.7-154.2-116.7 126.7 9.7 57.1 31.1 84 84 A V E -bc 36 107A 0 -49,-3.6 -47,-3.2 -2,-0.5 2,-0.4 -0.885 6.1-165.7-102.9 123.4 12.3 54.9 32.8 85 85 A G E -bc 37 108A 0 22,-3.0 24,-2.6 -2,-0.5 2,-0.4 -0.916 8.3-163.3-107.7 137.1 15.4 53.8 30.7 86 86 A I E +bc 38 109A 0 -49,-2.0 -47,-0.5 -2,-0.4 2,-0.3 -0.977 22.4 148.0-127.7 127.6 17.5 51.0 32.2 87 87 A S - 0 0 2 22,-2.5 24,-0.4 -2,-0.4 29,-0.1 -0.883 36.5-146.9-156.6 126.5 21.0 50.0 31.3 88 88 A R S S+ 0 0 49 -2,-0.3 23,-2.1 1,-0.2 24,-0.4 0.944 107.9 33.1 -58.7 -52.2 23.6 48.4 33.6 89 89 A S S S- 0 0 51 21,-0.1 -1,-0.2 22,-0.1 26,-0.2 0.770 100.3-135.8 -68.8 -26.3 26.5 50.2 31.7 90 90 A G S S+ 0 0 0 19,-0.2 26,-2.4 24,-0.1 25,-0.1 0.547 88.2 89.3 70.2 13.4 24.4 53.2 30.9 91 91 A E + 0 0 87 24,-0.2 2,-0.3 23,-0.1 -3,-0.0 0.309 45.1 136.2-120.6 4.2 25.8 53.1 27.4 92 92 A T >> - 0 0 38 1,-0.2 4,-1.9 2,-0.1 3,-0.7 -0.409 47.7-148.2 -57.1 115.7 23.3 50.7 25.7 93 93 A T H 3> S+ 0 0 95 -2,-0.3 4,-3.1 1,-0.3 5,-0.2 0.889 91.8 55.5 -58.7 -46.7 22.7 52.5 22.3 94 94 A E H 3> S+ 0 0 26 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.798 107.9 48.9 -60.7 -34.0 19.1 51.4 22.0 95 95 A V H <> S+ 0 0 2 -3,-0.7 4,-2.3 2,-0.2 -1,-0.2 0.915 112.0 48.4 -70.4 -47.1 18.1 52.9 25.3 96 96 A L H X S+ 0 0 31 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.966 114.7 46.8 -56.2 -49.6 19.8 56.2 24.5 97 97 A L H X S+ 0 0 72 -4,-3.1 4,-0.9 1,-0.2 -2,-0.2 0.857 110.5 50.5 -61.8 -44.1 18.1 56.2 21.1 98 98 A A H >< S+ 0 0 0 -4,-2.2 3,-0.7 -5,-0.2 -1,-0.2 0.936 112.4 47.7 -60.0 -44.3 14.6 55.4 22.5 99 99 A L H >< S+ 0 0 4 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.806 100.6 64.7 -68.8 -27.8 14.8 58.1 25.1 100 100 A E H 3< S+ 0 0 143 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.836 98.0 57.8 -63.5 -29.6 16.0 60.7 22.6 101 101 A K T << S+ 0 0 138 -4,-0.9 2,-0.4 -3,-0.7 -1,-0.3 0.502 95.9 84.0 -72.2 -7.2 12.6 60.3 20.9 102 102 A I < - 0 0 14 -3,-1.9 4,-0.0 -4,-0.1 -19,-0.0 -0.889 45.8-180.0-116.3 127.5 10.8 61.3 24.2 103 103 A N + 0 0 163 -2,-0.4 -1,-0.1 2,-0.1 3,-0.1 0.306 58.4 105.4 -97.7 -3.8 10.1 64.8 25.5 104 104 A T S S- 0 0 40 1,-0.2 -22,-0.1 -22,-0.0 -23,-0.1 -0.448 93.0 -79.9 -67.5 149.4 8.4 63.4 28.7 105 105 A P - 0 0 59 0, 0.0 -22,-1.8 0, 0.0 2,-0.4 -0.297 58.3-152.1 -47.6 143.0 10.4 63.6 31.9 106 106 A K E -c 83 0A 26 -24,-0.2 16,-2.0 -3,-0.1 15,-0.5 -0.950 16.8-162.3-128.0 143.5 12.9 60.7 32.0 107 107 A L E -cd 84 122A 0 -24,-2.5 -22,-3.0 -2,-0.4 2,-0.5 -0.989 10.5-153.8-121.6 134.7 14.7 58.7 34.6 108 108 A G E -cd 85 123A 0 14,-2.1 16,-3.1 -2,-0.4 2,-0.5 -0.924 3.7-163.8-111.5 130.5 17.8 56.6 34.0 109 109 A I E +cd 86 124A 0 -24,-2.6 -22,-2.5 -2,-0.5 2,-0.3 -0.969 30.2 135.0-112.6 125.1 18.7 53.6 36.0 110 110 A S E - d 0 125A 0 14,-1.7 16,-2.6 -2,-0.5 -22,-0.2 -0.925 62.4-118.4-155.0 169.3 22.3 52.3 35.7 111 111 A A S S+ 0 0 4 -23,-2.1 2,-0.3 -24,-0.4 -22,-0.1 0.555 98.3 45.4 -86.8 -9.9 25.2 51.1 37.8 112 112 A Y S S- 0 0 92 -24,-0.4 2,-0.4 15,-0.1 5,-0.3 -0.953 87.8-107.8-135.2 146.9 27.3 54.1 36.5 113 113 A E S S+ 0 0 120 -2,-0.3 2,-0.3 4,-0.1 -2,-0.0 -0.661 73.2 139.3 -65.5 127.1 27.1 57.8 35.9 114 114 A S > - 0 0 1 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.874 69.5 -65.2-162.7 178.5 27.0 57.5 32.2 115 115 A S H > S+ 0 0 42 -2,-0.3 4,-0.8 1,-0.2 -24,-0.2 0.898 128.5 52.9 -52.7 -41.2 25.5 58.6 28.9 116 116 A L H >4 S+ 0 0 1 -26,-2.4 3,-1.2 1,-0.2 4,-0.4 0.963 111.7 41.4 -63.6 -53.1 22.1 57.3 30.1 117 117 A T H >4 S+ 0 0 7 -5,-0.3 3,-1.0 1,-0.3 -1,-0.2 0.863 113.8 54.3 -61.5 -34.8 22.1 59.2 33.4 118 118 A R H 3< S+ 0 0 169 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.592 106.1 54.0 -76.9 -8.7 23.4 62.3 31.8 119 119 A A T << S+ 0 0 53 -3,-1.2 2,-0.3 -4,-0.8 -1,-0.2 0.399 99.7 76.7-103.0 -0.5 20.6 62.2 29.2 120 120 A C S < S- 0 0 21 -3,-1.0 -13,-0.1 -4,-0.4 3,-0.1 -0.758 78.7-125.4-112.5 156.1 17.7 62.1 31.7 121 121 A D S S+ 0 0 96 -15,-0.5 2,-0.3 -2,-0.3 -14,-0.2 0.830 100.7 17.3 -56.9 -35.1 15.8 64.5 34.0 122 122 A Y E -d 107 0A 89 -16,-2.0 -14,-2.1 2,-0.0 2,-0.3 -0.932 69.7-159.7-140.0 155.8 16.5 62.1 36.9 123 123 A S E -d 108 0A 32 -2,-0.3 2,-0.5 -16,-0.2 -14,-0.2 -1.000 12.6-163.5-145.6 145.2 18.9 59.3 37.6 124 124 A L E -d 109 0A 0 -16,-3.1 -14,-1.7 -2,-0.3 2,-0.6 -0.944 17.7-172.6-126.8 100.8 19.1 56.3 39.9 125 125 A V E -d 110 0A 26 -2,-0.5 -14,-0.2 -16,-0.2 -12,-0.1 -0.911 6.0-171.2-101.4 120.9 22.7 55.1 39.9 126 126 A V - 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