==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 27-JUL-05 2AGK . COMPND 2 MOLECULE: 1-(5-PHOSPHORIBOSYL)-5-[(5-PHOSPHORIBOSYLAMINO) . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR H.V.TILBEURGH,PARIS-SUD YEAST STRUCTURAL GENOMICS (YSG) . 233 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11286.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 76.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 15.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 23 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.7 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 1 0 0 1 0 0 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 3 1 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 PARALLEL BRIDGES PER LADDER . 1 1 0 1 1 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 0 0 0 0 0 0 0 1 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 2 A T 0 0 16 0, 0.0 2,-0.3 0, 0.0 206,-0.2 0.000 360.0 360.0 360.0 121.2 5.0 16.4 10.8 2 3 A K - 0 0 61 232,-0.0 206,-2.7 202,-0.0 2,-0.3 -0.927 360.0-104.1-125.3 154.7 4.8 19.4 13.1 3 4 A F E -a 208 0A 1 224,-0.4 2,-0.4 -2,-0.3 206,-0.2 -0.632 35.2-157.5 -69.0 130.5 5.0 23.1 12.7 4 5 A I E -a 209 0A 2 204,-2.6 206,-1.7 -2,-0.3 2,-0.1 -0.968 6.8-145.2-113.0 127.1 8.4 24.4 14.0 5 6 A G - 0 0 0 -2,-0.4 32,-1.9 29,-0.2 2,-0.3 -0.455 15.2-167.0 -87.7 167.1 8.8 28.0 15.1 6 7 A C E -b 37 0A 11 204,-0.4 2,-0.3 30,-0.2 32,-0.2 -0.963 19.4-156.1-147.0 161.4 11.8 30.3 14.8 7 8 A I E -b 38 0A 1 30,-2.1 32,-2.8 -2,-0.3 2,-0.4 -0.916 16.1-162.3-138.9 114.9 13.2 33.6 15.9 8 9 A D E -b 39 0A 51 -2,-0.3 7,-2.8 7,-0.3 2,-0.4 -0.850 8.4-159.5 -99.4 134.4 15.8 35.2 13.6 9 10 A L E +bC 40 14A 0 30,-3.0 32,-3.3 -2,-0.4 2,-0.4 -0.938 15.5 171.1-119.1 133.1 18.0 37.8 15.1 10 11 A H E > S-bC 41 13A 101 3,-2.8 3,-1.8 -2,-0.4 32,-0.1 -0.994 73.9 -5.7-140.8 133.8 20.0 40.5 13.3 11 12 A N T 3 S- 0 0 98 30,-0.6 33,-0.1 32,-0.6 34,-0.1 0.838 130.1 -56.7 50.4 37.2 21.8 43.5 15.0 12 13 A G T 3 S+ 0 0 32 31,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.594 119.8 98.5 77.2 13.2 20.4 42.4 18.3 13 14 A E E < S-C 10 0A 122 -3,-1.8 -3,-2.8 7,-0.1 -1,-0.2 -0.915 79.1 -99.1-132.3 151.4 16.7 42.6 17.1 14 15 A V E -C 9 0A 13 5,-0.4 2,-0.7 -2,-0.3 -5,-0.2 -0.509 35.8-121.6 -67.5 134.7 14.1 40.2 15.8 15 16 A K 0 0 110 -7,-2.8 -7,-0.3 -2,-0.2 -1,-0.1 -0.745 360.0 360.0 -76.0 113.9 13.7 40.0 12.0 16 17 A Q 0 0 72 -2,-0.7 -1,-0.1 202,-0.1 201,-0.1 0.532 360.0 360.0-127.8 360.0 10.0 40.9 11.5 17 ! 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 18 38 A Q 0 0 171 0, 0.0 199,-0.0 0, 0.0 200,-0.0 0.000 360.0 360.0 360.0 137.0 7.5 44.8 16.9 19 39 A H - 0 0 72 -5,-0.1 -5,-0.4 198,-0.0 2,-0.1 -0.994 360.0-110.4-144.6 147.5 8.3 42.5 19.8 20 40 A P >> - 0 0 75 0, 0.0 3,-1.4 0, 0.0 4,-0.9 -0.362 40.1-104.0 -72.6 163.0 11.5 41.6 21.7 21 41 A S H 3> S+ 0 0 4 1,-0.3 4,-2.1 2,-0.2 3,-0.3 0.833 119.3 62.2 -57.6 -34.8 12.8 38.1 21.4 22 42 A S H 3> S+ 0 0 29 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.784 94.9 62.1 -62.6 -28.3 11.5 37.1 24.8 23 43 A Y H <> S+ 0 0 97 -3,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.946 108.4 41.3 -60.6 -48.0 7.9 37.7 23.6 24 44 A Y H X S+ 0 0 0 -4,-0.9 4,-2.8 -3,-0.3 5,-0.2 0.884 112.6 54.1 -68.3 -40.5 8.3 35.0 20.9 25 45 A A H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.900 111.6 45.7 -58.8 -42.1 10.1 32.7 23.3 26 46 A K H X S+ 0 0 102 -4,-2.4 4,-3.1 2,-0.2 -2,-0.2 0.910 112.3 51.4 -66.7 -44.1 7.2 33.0 25.8 27 47 A L H X S+ 0 0 17 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.927 110.7 47.0 -59.0 -47.7 4.6 32.6 23.0 28 48 A Y H <>S+ 0 0 0 -4,-2.8 5,-2.9 2,-0.2 -1,-0.2 0.883 114.9 47.4 -63.5 -39.4 6.2 29.4 21.8 29 49 A K H ><5S+ 0 0 99 -4,-1.8 3,-1.2 -5,-0.2 -2,-0.2 0.936 111.5 49.9 -65.2 -46.7 6.4 28.0 25.3 30 50 A D H 3<5S+ 0 0 96 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.873 116.0 42.2 -60.9 -39.5 2.8 28.9 26.2 31 51 A R T 3<5S- 0 0 101 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.385 111.3-123.9 -88.0 2.4 1.6 27.2 23.0 32 52 A D T < 5 + 0 0 102 -3,-1.2 2,-1.1 1,-0.2 -3,-0.2 0.895 44.6 170.1 54.7 47.7 4.0 24.3 23.6 33 53 A V > < - 0 0 1 -5,-2.9 3,-0.6 -6,-0.1 -1,-0.2 -0.779 22.7-153.6 -88.1 98.1 5.7 24.5 20.2 34 54 A Q T 3 + 0 0 108 -2,-1.1 -29,-0.2 1,-0.2 26,-0.1 -0.364 62.7 21.4 -73.7 151.4 8.6 22.1 20.7 35 55 A G T 3 S+ 0 0 12 24,-0.5 -1,-0.2 1,-0.2 25,-0.1 0.672 75.8 165.7 73.2 23.5 11.9 22.2 18.9 36 56 A C < - 0 0 2 -3,-0.6 25,-3.0 23,-0.4 2,-0.4 -0.309 26.7-134.4 -71.3 155.7 11.9 25.9 17.8 37 57 A H E -bd 6 61A 9 -32,-1.9 -30,-2.1 23,-0.2 2,-0.5 -0.949 10.3-158.6-121.3 129.8 15.2 27.5 16.6 38 58 A V E -bd 7 62A 1 23,-2.8 25,-2.7 -2,-0.4 2,-0.5 -0.914 20.3-164.0 -98.5 123.9 16.7 30.9 17.5 39 59 A I E -bd 8 63A 21 -32,-2.8 -30,-3.0 -2,-0.5 2,-0.7 -0.957 11.8-149.8-120.0 122.0 19.1 31.9 14.7 40 60 A K E -b 9 0A 20 23,-2.6 2,-0.8 -2,-0.5 -30,-0.2 -0.795 10.2-160.1 -89.3 115.2 21.7 34.6 15.1 41 61 A L E -b 10 0A 59 -32,-3.3 -30,-0.6 -2,-0.7 23,-0.0 -0.873 61.4 -31.8 -98.5 104.0 22.4 36.3 11.8 42 62 A G S S- 0 0 51 -2,-0.8 3,-0.3 -32,-0.1 -33,-0.1 -0.254 99.1 -35.0 79.3-170.4 25.8 38.0 12.1 43 63 A P S S+ 0 0 94 0, 0.0 -32,-0.6 0, 0.0 -31,-0.3 -0.179 106.3 45.0 -82.3 174.3 27.3 39.5 15.2 44 64 A N S S+ 0 0 122 -33,-0.1 4,-0.2 -34,-0.1 -34,-0.1 0.708 79.5 106.3 68.6 27.7 25.9 41.4 18.2 45 65 A N > + 0 0 1 -3,-0.3 4,-2.4 -34,-0.1 5,-0.2 0.380 42.6 97.9-111.6 -0.2 23.0 39.0 18.8 46 66 A D H > S+ 0 0 65 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.884 84.6 47.0 -65.3 -41.6 24.1 37.1 21.9 47 67 A D H > S+ 0 0 125 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.912 113.9 48.2 -63.8 -43.3 22.2 39.1 24.4 48 68 A A H > S+ 0 0 8 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.872 113.1 49.4 -66.7 -34.3 19.0 38.9 22.3 49 69 A A H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.948 112.0 46.8 -67.4 -49.2 19.5 35.2 21.9 50 70 A R H X S+ 0 0 70 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.879 106.9 59.3 -60.4 -37.1 20.1 34.7 25.7 51 71 A E H X S+ 0 0 73 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.928 111.3 41.0 -54.0 -47.7 17.0 36.8 26.3 52 72 A A H X S+ 0 0 0 -4,-1.6 4,-1.3 2,-0.2 3,-0.3 0.947 116.9 46.9 -66.5 -48.6 14.9 34.3 24.3 53 73 A L H < S+ 0 0 0 -4,-2.8 6,-0.3 1,-0.2 3,-0.2 0.890 113.5 48.1 -63.8 -39.4 16.6 31.2 25.7 54 74 A Q H < S+ 0 0 93 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.726 102.8 61.9 -77.3 -21.4 16.4 32.4 29.3 55 75 A E H < S+ 0 0 88 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.876 124.4 19.7 -66.1 -36.7 12.7 33.3 29.0 56 76 A S S >X S- 0 0 2 -4,-1.3 3,-1.4 -3,-0.2 4,-0.6 -0.674 96.1-148.1-133.2 74.8 12.0 29.6 28.2 57 77 A P T 34 S- 0 0 85 0, 0.0 21,-0.2 0, 0.0 -3,-0.1 -0.147 73.0 -4.2 -59.9 137.5 15.0 27.7 29.6 58 78 A Q T 34 S+ 0 0 121 19,-2.7 20,-0.2 2,-0.2 3,-0.1 0.750 111.9 94.8 55.2 30.5 16.1 24.5 27.8 59 79 A F T <4 S+ 0 0 25 -3,-1.4 -24,-0.5 18,-0.5 -23,-0.4 0.600 73.5 56.1-118.8 -25.8 13.1 24.8 25.5 60 80 A L S < S- 0 0 0 -4,-0.6 19,-2.2 17,-0.4 20,-0.3 -0.867 72.6-132.0-112.6 147.9 14.6 26.6 22.4 61 81 A Q E -d 37 0A 3 -25,-3.0 -23,-2.8 -2,-0.3 2,-0.4 -0.582 19.1-147.9 -88.2 159.1 17.5 25.7 20.2 62 82 A V E +de 38 81A 0 18,-2.0 20,-2.7 -2,-0.2 2,-0.3 -0.995 18.8 168.9-133.1 137.2 20.2 28.2 19.2 63 83 A G E +de 39 82A 0 -25,-2.7 -23,-2.6 -2,-0.4 20,-0.1 -0.889 30.6 86.5-137.1 169.6 22.3 28.6 16.1 64 84 A G S S+ 0 0 10 18,-0.8 -23,-0.1 -2,-0.3 19,-0.0 0.497 98.9 12.3 103.3 110.8 24.6 31.1 14.4 65 85 A G S S+ 0 0 46 1,-0.2 2,-0.4 -25,-0.1 18,-0.1 0.779 83.3 159.9 67.4 28.6 28.3 31.1 15.3 66 86 A I + 0 0 2 16,-0.4 18,-0.4 3,-0.1 20,-0.3 -0.711 7.5 144.1 -85.8 129.2 28.3 27.8 17.1 67 87 A N >> - 0 0 39 -2,-0.4 4,-1.6 16,-0.1 3,-0.8 -0.846 64.1 -79.5-147.3-174.2 31.6 26.0 17.5 68 88 A D T 34 S+ 0 0 38 -2,-0.2 4,-0.3 1,-0.2 -2,-0.0 0.701 121.9 57.5 -66.7 -19.1 33.6 23.8 19.9 69 89 A T T 34 S+ 0 0 118 1,-0.1 -1,-0.2 2,-0.1 4,-0.1 0.728 120.2 23.2 -85.2 -22.6 34.6 26.8 22.0 70 90 A N T <> S+ 0 0 35 -3,-0.8 4,-2.2 2,-0.1 5,-0.2 0.470 92.5 95.5-122.2 -3.2 31.1 28.0 22.9 71 91 A C H X S+ 0 0 0 -4,-1.6 4,-1.9 1,-0.2 -3,-0.1 0.905 86.8 49.0 -61.6 -42.3 28.8 25.0 22.5 72 92 A L H 4 S+ 0 0 99 -4,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.894 110.2 50.8 -66.8 -37.7 28.8 24.0 26.2 73 93 A E H >4 S+ 0 0 91 1,-0.2 3,-1.6 2,-0.2 4,-0.4 0.934 109.8 50.0 -65.3 -43.0 28.0 27.6 27.4 74 94 A W H >X S+ 0 0 11 -4,-2.2 4,-2.3 1,-0.3 3,-1.6 0.875 101.1 64.7 -62.1 -34.3 25.1 27.9 24.9 75 95 A L T 3< S+ 0 0 10 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.564 82.4 78.4 -68.8 -6.8 23.7 24.5 26.2 76 96 A K T <4 S+ 0 0 121 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.890 117.9 10.4 -61.2 -36.7 23.2 26.1 29.6 77 97 A W T <4 S+ 0 0 51 -3,-1.6 -19,-2.7 -4,-0.4 -18,-0.5 0.644 116.4 78.3-120.1 -21.3 20.1 27.7 28.3 78 98 A A < - 0 0 0 -4,-2.3 -17,-0.2 -20,-0.2 3,-0.1 -0.698 66.5-141.2 -93.9 145.1 19.4 26.1 24.8 79 99 A S S S- 0 0 28 -19,-2.2 2,-0.3 -2,-0.3 -18,-0.2 0.907 89.5 -3.2 -64.6 -42.3 17.8 22.6 24.4 80 100 A K - 0 0 37 -20,-0.3 -18,-2.0 -6,-0.1 2,-0.4 -0.973 69.3-127.1-144.6 155.7 20.2 22.0 21.5 81 101 A V E -ef 62 111A 2 29,-2.4 31,-2.2 -2,-0.3 2,-0.6 -0.858 20.2-141.6-104.4 145.5 22.9 23.9 19.6 82 102 A I E -ef 63 112A 0 -20,-2.7 -18,-0.8 -2,-0.4 -16,-0.4 -0.930 10.7-151.5-112.4 111.6 22.7 24.2 15.8 83 103 A V E + f 0 113A 2 29,-2.5 31,-2.4 -2,-0.6 -16,-0.1 -0.644 26.5 156.6 -83.5 139.2 26.0 24.0 13.9 84 104 A T > + 0 0 36 -18,-0.4 3,-1.2 -2,-0.3 -1,-0.1 0.311 65.9 2.8-124.2-104.8 26.2 25.9 10.6 85 105 A S G > S+ 0 0 57 1,-0.2 3,-2.1 2,-0.1 7,-0.1 0.663 109.0 80.9 -71.1 -18.3 29.4 27.1 8.9 86 106 A W G 3 S+ 0 0 53 -20,-0.3 -1,-0.2 1,-0.3 -18,-0.1 0.756 81.6 67.7 -62.3 -21.4 31.9 25.8 11.5 87 107 A L G < S+ 0 0 2 -3,-1.2 8,-3.1 11,-0.1 2,-0.4 0.514 100.7 60.0 -71.8 -3.2 31.6 22.3 9.8 88 108 A F B < S-L 94 0B 11 -3,-2.1 6,-0.2 6,-0.2 2,-0.1 -0.958 81.8-122.6-129.5 143.4 33.4 23.8 6.7 89 109 A T > - 0 0 20 4,-2.0 3,-2.6 -2,-0.4 4,-0.1 -0.403 45.1 -99.9 -68.7 161.1 36.7 25.4 6.0 90 110 A K T 3 S+ 0 0 156 1,-0.3 -1,-0.1 2,-0.1 39,-0.1 0.755 127.1 59.3 -56.6 -23.6 36.4 28.9 4.5 91 111 A E T 3 S- 0 0 130 2,-0.1 -1,-0.3 43,-0.0 44,-0.1 0.541 124.3-104.1 -81.7 -10.5 37.1 27.2 1.1 92 112 A G < + 0 0 1 -3,-2.6 45,-2.2 1,-0.3 2,-0.6 0.647 68.7 147.5 97.6 19.0 34.0 25.0 1.6 93 113 A H - 0 0 90 43,-0.2 -4,-2.0 44,-0.1 -1,-0.3 -0.784 48.7-123.3 -91.3 122.1 35.5 21.7 2.5 94 114 A F B -L 88 0B 35 -2,-0.6 2,-0.6 -6,-0.2 -6,-0.2 -0.385 18.7-153.8 -63.1 134.4 33.4 19.6 4.9 95 115 A Q >> - 0 0 66 -8,-3.1 3,-1.3 1,-0.2 4,-1.2 -0.822 14.4-179.0-116.0 89.6 35.3 18.7 8.1 96 116 A L H 3> S+ 0 0 52 -2,-0.6 4,-2.5 1,-0.3 5,-0.2 0.850 82.2 62.9 -55.2 -36.4 33.8 15.5 9.6 97 117 A K H 3> S+ 0 0 172 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.807 99.1 54.9 -61.8 -30.1 36.3 15.7 12.5 98 118 A R H <> S+ 0 0 78 -3,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.904 108.1 47.5 -70.6 -41.5 34.7 19.0 13.6 99 119 A L H X S+ 0 0 0 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.928 110.4 53.2 -60.2 -45.4 31.3 17.4 13.8 100 120 A E H X S+ 0 0 45 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.904 107.2 52.0 -57.1 -41.9 32.8 14.5 15.7 101 121 A R H X S+ 0 0 105 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.907 108.5 50.4 -61.3 -43.4 34.2 17.0 18.2 102 122 A L H X S+ 0 0 2 -4,-2.0 4,-2.9 2,-0.2 5,-0.4 0.906 111.5 47.7 -60.8 -43.3 30.8 18.6 18.7 103 123 A T H X S+ 0 0 25 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.913 109.5 53.9 -63.6 -42.2 29.2 15.3 19.4 104 124 A E H < S+ 0 0 142 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.860 117.6 37.0 -58.9 -39.0 32.0 14.3 21.8 105 125 A L H < S+ 0 0 56 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.885 131.4 23.9 -78.8 -42.4 31.3 17.6 23.7 106 126 A C H < S- 0 0 15 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.728 100.2-116.6-101.5 -29.6 27.6 17.9 23.5 107 127 A G >< - 0 0 25 -4,-2.4 3,-1.8 -5,-0.4 4,-0.3 0.124 32.8 -91.2 91.1 146.7 26.1 14.4 22.9 108 128 A K G > S+ 0 0 56 1,-0.3 45,-1.7 2,-0.2 3,-0.7 0.774 125.0 61.2 -65.9 -21.7 24.2 13.5 19.8 109 129 A D G 3 S+ 0 0 99 1,-0.2 -1,-0.3 43,-0.2 -2,-0.1 0.452 104.7 48.1 -82.5 -1.0 20.9 14.5 21.5 110 130 A R G < S+ 0 0 65 -3,-1.8 -29,-2.4 -7,-0.1 2,-0.4 0.307 98.5 76.5-123.8 10.6 22.1 18.1 22.0 111 131 A I E < -f 81 0A 2 -3,-0.7 42,-0.6 -4,-0.3 2,-0.4 -0.919 53.9-164.8-119.6 148.8 23.4 19.0 18.5 112 132 A V E -f 82 0A 0 -31,-2.2 -29,-2.5 -2,-0.4 2,-0.7 -0.997 15.0-142.6-124.9 135.6 21.6 19.9 15.3 113 133 A V E -fg 83 155A 0 41,-2.2 43,-2.4 -2,-0.4 2,-0.6 -0.892 16.1-159.7 -99.1 116.3 23.3 19.9 11.9 114 134 A D E - g 0 156A 20 -31,-2.4 2,-0.6 -2,-0.7 43,-0.2 -0.887 9.5-175.5 -99.9 114.6 22.0 22.7 9.8 115 135 A L E - g 0 157A 1 41,-2.4 43,-2.4 -2,-0.6 2,-0.5 -0.958 11.1-159.5-115.0 114.5 22.6 22.3 6.1 116 136 A S E -Hg 128 158A 19 -2,-0.6 12,-3.2 12,-0.5 2,-0.3 -0.816 23.3-169.8 -88.4 127.0 21.7 25.1 3.7 117 137 A C E -H 127 0A 4 41,-2.7 2,-0.4 -2,-0.5 10,-0.2 -0.894 20.0-155.2-128.5 151.7 21.3 23.6 0.3 118 138 A R E -H 126 0A 121 8,-2.5 8,-2.6 -2,-0.3 2,-0.7 -0.980 23.9-126.3-122.2 134.7 20.9 24.8 -3.3 119 139 A K E +H 125 0A 79 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.728 33.6 172.1 -79.3 114.3 19.3 22.8 -6.0 120 140 A T E - 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