==== 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 LYASE 12-JAN-99 1B57 . COMPND 2 MOLECULE: PROTEIN (FRUCTOSE-BISPHOSPHATE ALDOLASE II); . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.R.HALL,W.N.HUNTER . 692 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24639.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 511 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 79 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 1.2 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 . 2 0.3 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 . 31 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 281 40.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.0 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 2 0 0 0 2 2 0 4 0 0 4 0 2 2 2 0 0 2 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 6 5 3 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 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 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 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 S 0 0 58 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 166.5 42.4 32.1 129.6 2 2 A K > - 0 0 84 1,-0.1 3,-1.7 345,-0.1 4,-0.4 -0.979 360.0-123.2-124.0 149.2 40.1 35.1 130.3 3 3 A I G >> S+ 0 0 1 343,-2.5 3,-2.0 -2,-0.4 4,-1.9 0.869 110.1 56.4 -57.4 -38.8 39.3 38.2 128.3 4 4 A F G 34 S+ 0 0 82 343,-2.8 -1,-0.3 1,-0.3 343,-0.1 0.672 89.2 75.6 -81.4 1.0 40.4 40.6 131.0 5 5 A D G <4 S+ 0 0 105 -3,-1.7 -1,-0.3 342,-0.2 -2,-0.2 0.781 115.6 18.9 -68.2 -28.6 43.8 39.1 131.1 6 6 A F T <4 S+ 0 0 89 -3,-2.0 2,-0.3 -4,-0.4 -2,-0.2 0.668 126.0 33.9-113.6 -34.5 44.5 40.9 127.8 7 7 A V < - 0 0 6 -4,-1.9 -1,-0.2 12,-0.1 3,-0.1 -0.932 61.3-135.8-126.9 167.1 42.0 43.8 127.4 8 8 A K - 0 0 174 -2,-0.3 94,-0.0 1,-0.2 -3,-0.0 -0.662 43.0 -78.7-112.9 163.6 40.0 46.3 129.5 9 9 A P S S+ 0 0 51 0, 0.0 2,-0.2 0, 0.0 89,-0.2 -0.159 91.7 64.7 -56.4 150.0 36.4 47.4 129.3 10 10 A G E S-a 103 0A 9 92,-2.5 94,-2.9 87,-0.2 2,-0.4 -0.761 99.5 -27.0 128.4-168.1 35.7 49.9 126.5 11 11 A V E -a 104 0A 6 -2,-0.2 2,-0.5 92,-0.2 94,-0.2 -0.679 61.6-137.5 -86.6 127.9 35.9 49.7 122.7 12 12 A I + 0 0 6 92,-3.1 94,-0.4 -2,-0.4 2,-0.3 -0.804 36.8 153.2 -90.0 125.2 38.4 47.1 121.5 13 13 A T > + 0 0 16 -2,-0.5 3,-1.2 92,-0.1 156,-0.1 -0.855 38.9 25.3-137.0-179.0 40.6 48.1 118.5 14 14 A G T > S- 0 0 17 154,-1.7 3,-1.8 -2,-0.3 4,-0.4 -0.271 124.9 -20.1 64.1-144.7 44.0 47.3 117.1 15 15 A D T 3> S+ 0 0 89 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.622 123.0 81.6 -76.8 -8.7 45.5 43.9 117.8 16 16 A D H <> S+ 0 0 51 -3,-1.2 4,-2.2 1,-0.2 -1,-0.3 0.704 83.9 62.4 -63.7 -27.9 43.2 43.5 120.8 17 17 A V H <> S+ 0 0 1 -3,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.950 106.5 43.8 -62.4 -45.5 40.5 42.4 118.3 18 18 A Q H > S+ 0 0 39 -4,-0.4 4,-2.9 1,-0.2 -2,-0.2 0.905 111.5 55.3 -65.8 -31.3 42.7 39.4 117.3 19 19 A K H X S+ 0 0 80 -4,-2.3 4,-2.4 1,-0.3 -1,-0.2 0.912 107.8 47.4 -63.5 -47.0 43.4 38.8 121.0 20 20 A V H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -1,-0.3 0.839 113.1 49.0 -60.2 -42.3 39.7 38.6 121.9 21 21 A F H X S+ 0 0 4 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.901 109.5 53.3 -68.1 -31.8 39.1 36.2 118.9 22 22 A Q H X S+ 0 0 104 -4,-2.9 4,-2.9 1,-0.2 3,-0.5 0.960 108.7 48.6 -65.4 -41.3 42.1 34.1 120.0 23 23 A V H X S+ 0 0 1 -4,-2.4 4,-1.9 1,-0.3 -1,-0.2 0.891 108.8 54.2 -66.3 -39.7 40.7 33.7 123.6 24 24 A A H <>S+ 0 0 0 -4,-1.9 5,-3.6 2,-0.2 -1,-0.3 0.826 111.1 44.2 -56.4 -52.1 37.3 32.7 122.2 25 25 A K H ><5S+ 0 0 53 -4,-1.6 3,-2.2 -3,-0.5 -2,-0.2 0.956 111.7 53.8 -63.0 -40.0 38.8 29.9 120.0 26 26 A E H 3<5S+ 0 0 107 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.832 118.9 35.5 -63.7 -22.6 41.0 28.8 122.9 27 27 A N T 3<5S- 0 0 56 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.360 111.0-117.1-111.3 3.6 37.8 28.6 125.1 28 28 A N T < 5S+ 0 0 80 -3,-2.2 2,-0.3 1,-0.2 -3,-0.2 0.880 72.3 116.6 62.8 47.8 35.4 27.4 122.4 29 29 A F < - 0 0 2 -5,-3.6 2,-0.3 -6,-0.2 -1,-0.2 -0.917 45.3-154.5-135.7 168.6 33.0 30.3 122.4 30 30 A A - 0 0 0 311,-1.3 243,-0.2 -2,-0.3 242,-0.1 -0.935 21.6-112.1-133.7 166.1 32.0 33.0 119.9 31 31 A L E -b 273 0A 0 241,-2.4 243,-2.2 -2,-0.3 25,-0.1 -0.770 23.5-127.0 -98.0 135.1 30.6 36.5 120.2 32 32 A P E -b 274 0A 0 0, 0.0 25,-1.7 0, 0.0 2,-0.4 -0.420 19.8-154.9 -72.3 141.5 27.1 37.5 119.2 33 33 A A E -bc 275 57A 0 241,-2.0 243,-3.2 23,-0.2 2,-0.5 -0.982 13.1-165.3-124.2 111.6 27.0 40.5 116.8 34 34 A V E -bc 276 58A 0 23,-2.1 25,-2.5 -2,-0.4 2,-0.4 -0.925 18.3-134.2-111.1 131.3 23.8 42.4 117.0 35 35 A N E - c 0 59A 12 241,-1.4 2,-0.3 -2,-0.5 25,-0.2 -0.624 30.7-165.8 -80.7 133.4 22.5 45.0 114.5 36 36 A C - 0 0 0 23,-2.5 25,-0.3 -2,-0.4 3,-0.1 -0.779 22.2-167.0-119.9 155.8 21.2 48.0 116.5 37 37 A V - 0 0 23 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.268 66.9 -17.5-129.0 22.3 19.0 50.9 115.4 38 38 A G S > S- 0 0 5 1,-0.1 4,-2.2 349,-0.1 3,-0.4 -0.965 87.9 -59.8 166.6-173.8 19.3 53.5 118.2 39 39 A T H > S+ 0 0 5 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.845 123.3 56.7 -65.4 -33.7 20.2 54.1 121.8 40 40 A D H > S+ 0 0 23 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.877 110.1 41.3 -65.8 -49.3 17.7 51.6 123.2 41 41 A S H > S+ 0 0 18 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.894 115.3 52.5 -66.0 -44.0 18.9 48.5 121.2 42 42 A I H X S+ 0 0 1 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.941 111.1 46.6 -54.5 -49.6 22.6 49.5 121.8 43 43 A N H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.863 109.4 54.1 -65.4 -34.7 22.0 49.8 125.6 44 44 A A H X S+ 0 0 0 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.881 109.6 49.0 -63.0 -37.5 20.1 46.4 125.7 45 45 A V H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.936 112.4 46.7 -67.2 -49.9 23.1 44.8 124.0 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.902 112.2 51.0 -57.2 -40.7 25.6 46.3 126.5 47 47 A E H X S+ 0 0 32 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.807 108.4 51.2 -64.8 -48.0 23.4 45.3 129.4 48 48 A T H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.929 109.9 49.9 -56.7 -44.8 23.1 41.7 128.2 49 49 A A H X>S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 5,-1.4 0.892 111.3 49.0 -60.3 -47.2 26.9 41.5 127.9 50 50 A A H <5S+ 0 0 35 -4,-2.1 -1,-0.2 3,-0.2 -2,-0.2 0.877 110.9 51.9 -57.5 -43.6 27.3 42.9 131.4 51 51 A K H <5S+ 0 0 128 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.918 119.5 31.7 -64.8 -39.4 24.8 40.4 132.7 52 52 A V H <5S- 0 0 12 -4,-2.6 293,-2.9 2,-0.1 -1,-0.2 0.629 107.7-124.2 -95.3 -12.3 26.4 37.2 131.3 53 53 A K T <5 + 0 0 119 -4,-1.6 293,-2.0 -5,-0.3 294,-0.9 0.996 64.2 119.0 64.1 75.5 29.9 38.6 131.5 54 54 A A < - 0 0 0 -5,-1.4 -1,-0.2 291,-0.2 -2,-0.1 -0.966 65.6 -97.9-156.2 152.5 31.2 38.3 128.0 55 55 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 49,-0.2 -0.320 42.9-166.6 -62.1 165.3 32.5 40.6 125.2 56 56 A V E - d 0 104A 0 47,-1.4 49,-2.6 -25,-0.1 2,-0.5 -0.983 20.2-125.9-152.9 164.2 30.0 41.5 122.5 57 57 A I E -cd 33 105A 0 -25,-1.7 -23,-2.1 -2,-0.3 2,-0.5 -0.977 15.9-163.8-117.4 121.1 29.8 43.1 119.0 58 58 A V E +cd 34 106A 0 47,-2.1 49,-2.2 -2,-0.5 2,-0.3 -0.944 23.1 173.0 -96.9 126.2 27.6 46.1 118.4 59 59 A Q E -cd 35 107A 1 -25,-2.5 -23,-2.5 -2,-0.5 2,-0.4 -0.893 23.5-148.4-134.2 165.3 27.0 46.6 114.7 60 60 A F E - d 0 108A 0 47,-1.3 49,-2.7 -2,-0.3 -23,-0.1 -0.997 9.7-145.3-126.2 138.1 25.0 48.7 112.4 61 61 A S > - 0 0 11 -2,-0.4 4,-2.6 -25,-0.3 5,-0.2 -0.245 37.9-103.6 -85.8 161.4 23.6 47.8 109.0 62 62 A N H > S+ 0 0 32 48,-0.3 4,-1.7 2,-0.2 5,-0.2 0.924 125.6 46.2 -60.1 -37.5 23.4 50.5 106.3 63 63 A G H > S+ 0 0 25 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.865 113.3 47.4 -70.1 -37.1 19.6 50.7 107.0 64 64 A G H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.906 110.6 53.2 -74.4 -39.3 20.0 50.8 110.8 65 65 A A H X S+ 0 0 0 -4,-2.6 4,-1.2 2,-0.2 -2,-0.2 0.894 110.0 46.3 -61.4 -43.1 22.7 53.4 110.7 66 66 A S H X S+ 0 0 31 -4,-1.7 4,-1.4 2,-0.2 3,-0.4 0.913 106.3 59.5 -76.9 -16.8 20.6 55.8 108.6 67 67 A F H < S+ 0 0 4 -4,-1.7 4,-0.3 1,-0.2 -2,-0.2 0.887 101.7 56.6 -67.3 -33.9 17.6 55.1 111.0 68 68 A I H < S+ 0 0 1 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.841 105.9 47.9 -70.4 -28.5 19.9 56.5 113.7 69 69 A A H < S- 0 0 0 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.768 125.8-106.4 -81.2 -21.4 20.4 59.7 111.8 70 70 A G >< - 0 0 1 -4,-1.4 3,-2.5 -3,-0.2 -2,-0.1 0.364 13.9-104.9 100.7 134.4 16.6 59.8 111.3 71 71 A K T 3 S+ 0 0 150 1,-0.3 -1,-0.1 -4,-0.3 -4,-0.1 0.588 118.5 57.6 -67.8 -11.0 14.6 59.1 108.2 72 72 A G T 3 S+ 0 0 28 -3,-0.1 -1,-0.3 319,-0.1 -2,-0.1 0.436 75.2 119.1-100.2 4.0 14.0 62.9 107.8 73 73 A V < - 0 0 15 -3,-2.5 2,-0.6 -7,-0.2 375,-0.2 -0.385 65.0-126.9 -58.9 162.9 17.6 64.0 107.7 74 74 A K - 0 0 69 373,-1.1 2,-0.7 6,-0.1 -1,-0.1 -0.831 24.1-154.0-114.6 109.2 18.6 65.8 104.5 75 75 A S + 0 0 66 -2,-0.6 4,-0.1 1,-0.2 5,-0.1 -0.838 20.7 177.8 -96.0 119.2 21.6 64.2 103.0 76 76 A D + 0 0 120 -2,-0.7 -1,-0.2 2,-0.1 3,-0.1 0.989 69.0 50.8 -66.1 -70.8 23.9 66.2 100.7 77 77 A V S > S- 0 0 75 1,-0.1 3,-2.1 2,-0.1 4,-0.3 -0.147 102.5 -84.0 -78.5 153.6 26.5 63.5 100.0 78 78 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.448 117.8 3.2 -57.7 124.3 26.0 59.9 98.9 79 79 A Q T 3> S+ 0 0 53 -3,-0.1 4,-2.4 -4,-0.1 5,-0.2 0.658 88.8 145.5 68.6 19.3 25.2 57.7 101.9 80 80 A G H <> + 0 0 4 -3,-2.1 4,-2.7 1,-0.2 5,-0.2 0.895 67.4 48.5 -61.5 -38.6 25.3 60.9 104.1 81 81 A A H > S+ 0 0 15 -4,-0.3 4,-2.8 1,-0.2 5,-0.3 0.935 111.8 48.9 -65.8 -39.7 22.6 59.7 106.4 82 82 A A H > S+ 0 0 2 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.874 112.9 48.9 -71.0 -32.5 24.2 56.2 106.9 83 83 A I H X S+ 0 0 23 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.943 113.8 45.2 -67.5 -49.7 27.5 57.9 107.6 84 84 A L H X S+ 0 0 15 -4,-2.7 4,-2.0 -5,-0.2 -2,-0.2 0.932 115.2 46.8 -62.2 -45.0 26.0 60.4 110.2 85 85 A G H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.898 111.6 50.6 -64.3 -43.0 23.9 57.7 112.0 86 86 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.3 -1,-0.2 0.922 110.3 50.1 -64.8 -40.2 26.8 55.2 112.2 87 87 A I H X S+ 0 0 16 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.895 112.2 47.7 -62.1 -42.8 29.1 57.9 113.7 88 88 A S H X S+ 0 0 10 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.965 112.1 47.8 -69.3 -41.3 26.5 58.9 116.3 89 89 A G H X S+ 0 0 3 -4,-3.0 4,-2.2 1,-0.2 5,-0.2 0.938 111.7 52.6 -62.5 -37.0 25.8 55.3 117.3 90 90 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.3 -1,-0.2 0.948 107.0 51.5 -63.7 -44.2 29.6 54.7 117.5 91 91 A H H X S+ 0 0 64 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.923 107.5 53.1 -62.6 -33.6 30.0 57.7 119.8 92 92 A H H X S+ 0 0 5 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.913 109.7 48.3 -65.1 -40.9 27.3 56.4 122.1 93 93 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.922 111.6 49.0 -62.2 -47.5 29.1 53.1 122.4 94 94 A H H < S+ 0 0 43 -4,-2.7 4,-0.4 1,-0.2 -2,-0.2 0.909 113.2 48.9 -60.4 -34.2 32.5 54.8 123.1 95 95 A Q H < S+ 0 0 49 -4,-2.4 -1,-0.2 -5,-0.2 4,-0.2 0.828 124.3 27.0 -66.2 -48.4 30.7 56.9 125.8 96 96 A M H >X S+ 0 0 0 -4,-1.9 4,-1.4 -5,-0.2 3,-0.6 0.677 94.4 83.0 -93.1 -33.2 29.0 54.0 127.5 97 97 A A H >X>S+ 0 0 0 -4,-2.6 5,-1.6 1,-0.2 4,-0.8 0.935 93.9 49.0 -55.3 -47.0 30.9 50.7 127.0 98 98 A E H 345S+ 0 0 121 -4,-0.4 3,-0.4 -5,-0.3 -1,-0.2 0.834 109.1 53.4 -61.4 -25.9 33.4 51.2 129.9 99 99 A H H <45S+ 0 0 39 -3,-0.6 323,-1.1 1,-0.3 -1,-0.2 0.687 105.5 53.6 -84.2 -18.9 30.6 52.2 132.3 100 100 A Y H <<5S- 0 0 12 -4,-1.4 -1,-0.3 -3,-0.7 -2,-0.2 0.646 113.3-126.8 -78.2 -13.0 28.8 49.0 131.5 101 101 A G T <5 + 0 0 31 -4,-0.8 -3,-0.2 -3,-0.4 -2,-0.1 0.772 66.4 121.1 80.9 22.4 32.1 47.2 132.4 102 102 A V < - 0 0 1 -5,-1.6 -92,-2.5 -94,-0.0 2,-0.5 -0.916 64.8-124.0-129.6 143.9 32.4 45.3 129.0 103 103 A P E -a 10 0A 0 0, 0.0 -47,-1.4 0, 0.0 2,-0.4 -0.773 37.8-167.0 -80.0 135.9 34.8 45.0 126.2 104 104 A V E -ad 11 56A 0 -94,-2.9 -92,-3.1 -2,-0.5 2,-0.5 -0.965 19.8-150.9-134.2 132.9 33.0 45.9 123.0 105 105 A I E - d 0 57A 4 -49,-2.6 -47,-2.1 -2,-0.4 2,-0.5 -0.926 18.7-151.7-100.8 131.9 33.9 45.4 119.3 106 106 A L E + d 0 58A 0 -2,-0.5 33,-2.5 -94,-0.4 34,-2.0 -0.912 26.9 158.0-107.4 131.6 32.2 48.1 117.1 107 107 A H E -ed 140 59A 1 -49,-2.2 -47,-1.3 -2,-0.5 2,-0.4 -0.909 36.4-128.0-148.4 161.2 31.4 47.2 113.5 108 108 A T E -ed 141 60A 0 32,-0.8 34,-0.7 -2,-0.3 -47,-0.2 -0.936 28.5-135.2-111.2 151.3 29.4 47.8 110.4 109 109 A D - 0 0 6 -49,-2.7 33,-0.4 -2,-0.4 35,-0.1 0.040 59.2 -10.9 -93.0-172.3 27.4 45.1 108.5 110 110 A H + 0 0 31 33,-0.1 2,-0.5 1,-0.1 -48,-0.3 0.142 56.3 177.8 -26.6 116.4 27.1 44.3 104.8 111 111 A C - 0 0 0 -3,-0.1 33,-2.2 -50,-0.1 -1,-0.1 -0.910 11.0-165.8-124.6 103.5 28.5 47.0 102.5 112 112 A A > - 0 0 45 -2,-0.5 3,-1.7 31,-0.2 4,-0.5 -0.219 40.4 -89.0 -81.0 168.0 28.2 46.0 98.8 113 113 A K G > S+ 0 0 92 31,-0.3 3,-1.3 1,-0.3 32,-0.1 0.877 125.8 54.3 -47.5 -48.0 30.0 47.8 96.0 114 114 A K G 3 S+ 0 0 90 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.753 108.7 50.1 -61.4 -22.3 27.3 50.4 95.4 115 115 A L G X> S+ 0 0 47 -3,-1.7 3,-1.7 1,-0.2 4,-0.5 0.392 73.7 112.2 -99.7 7.4 27.4 51.4 99.1 116 116 A L H <> + 0 0 17 -3,-1.3 4,-2.5 -4,-0.5 3,-0.3 0.719 63.5 70.0 -56.0 -28.4 31.1 51.9 99.4 117 117 A P H 3> S+ 0 0 46 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.905 92.6 64.1 -61.5 -23.3 30.8 55.7 99.8 118 118 A W H <> S+ 0 0 0 -3,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.960 107.1 38.6 -52.4 -61.3 29.4 54.7 103.2 119 119 A I H X S+ 0 0 0 -4,-0.5 4,-2.5 -3,-0.3 5,-0.2 0.869 112.8 57.0 -67.6 -31.9 32.6 53.1 104.3 120 120 A D H X S+ 0 0 55 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.956 109.1 46.3 -61.3 -40.9 34.7 55.9 102.7 121 121 A 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0.0 349 1 B S 0 0 62 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 150.3 13.3 90.0 111.8 350 2 B K > - 0 0 84 1,-0.1 3,-1.9 345,-0.1 4,-0.5 -0.988 360.0-126.0-120.0 151.7 14.3 86.4 111.0 351 3 B I G >> S+ 0 0 2 343,-2.6 3,-1.9 -2,-0.4 4,-1.7 0.934 109.1 57.5 -64.5 -38.3 16.2 83.8 113.0 352 4 B F G 34 S+ 0 0 83 343,-2.7 -1,-0.3 1,-0.3 343,-0.1 0.614 88.3 74.8 -71.3 -2.8 18.7 83.3 110.2 353 5 B D G <4 S+ 0 0 115 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.802 115.4 20.4 -69.4 -28.7 19.7 87.0 110.2 354 6 B F T <4 S+ 0 0 94 -3,-1.9 2,-0.3 -4,-0.5 -2,-0.2 0.570 125.5 33.3-108.3 -35.6 21.6 86.3 113.5 355 7 B V < - 0 0 12 -4,-1.7 -1,-0.2 12,-0.1 3,-0.1 -0.956 59.6-138.7-128.3 166.8 22.3 82.6 113.8 356 8 B K - 0 0 163 -2,-0.3 94,-0.0 1,-0.2 -3,-0.0 -0.658 43.7 -75.9-122.1 157.0 23.1 79.5 111.7 357 9 B P S S+ 0 0 45 0, 0.0 2,-0.3 0, 0.0 89,-0.2 -0.246 92.6 64.7 -45.1 146.8 21.9 75.9 111.9 358 10 B G E S-k 451 0C 9 92,-2.5 94,-2.4 87,-0.2 2,-0.5 -0.823 99.6 -28.7 129.1-168.5 23.5 74.0 114.7 359 11 B 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621 0C 0 241,-3.0 243,-2.2 -2,-0.3 25,-0.1 -0.813 21.9-127.2-104.1 133.2 9.7 77.9 121.1 380 32 B P E -l 622 0C 0 0, 0.0 25,-1.5 0, 0.0 2,-0.4 -0.415 19.8-156.1 -61.8 141.7 8.5 74.4 122.1 381 33 B A E -lm 623 405C 0 241,-2.2 243,-2.9 23,-0.2 2,-0.5 -0.987 12.2-164.6-127.5 114.2 10.9 72.6 124.5 382 34 B V E -lm 624 406C 0 23,-2.2 25,-3.0 -2,-0.4 2,-0.5 -0.920 17.8-134.1-115.7 131.6 10.5 68.8 124.3 383 35 B N E - m 0 407C 14 241,-1.4 2,-0.3 -2,-0.5 25,-0.2 -0.690 30.9-165.6 -80.9 125.8 11.8 66.3 126.8 384 36 B C - 0 0 1 23,-2.5 25,-0.3 -2,-0.5 3,-0.1 -0.838 23.3-167.0-113.7 156.5 13.5 63.4 124.8 385 37 B V - 0 0 23 -2,-0.3 2,-0.3 1,-0.2 3,-0.1 0.228 66.9 -19.1-129.2 24.1 14.5 59.9 125.9 386 38 B G S > S- 0 0 3 1,-0.1 4,-2.2 -347,-0.1 5,-0.3 -0.968 86.3 -59.8 162.5-174.4 16.7 58.7 123.0 387 39 B T H > S+ 0 0 7 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.909 123.1 57.4 -65.8 -37.5 17.8 59.1 119.3 388 40 B D H > S+ 0 0 22 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.893 111.3 38.8 -57.4 -53.7 14.2 58.4 118.1 389 41 B S H > S+ 0 0 16 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.889 115.5 52.8 -67.7 -39.8 12.5 61.2 120.0 390 42 B I H X S+ 0 0 2 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.959 111.3 47.9 -58.0 -47.4 15.4 63.7 119.4 391 43 B N H X S+ 0 0 0 -4,-2.9 4,-2.6 -5,-0.3 -1,-0.2 0.877 108.9 53.4 -57.1 -43.4 15.2 62.9 115.7 392 44 B A H X S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.921 110.1 48.4 -65.2 -35.1 11.4 63.5 115.7 393 45 B V H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.931 113.4 45.9 -65.9 -50.3 11.9 66.9 117.3 394 46 B L H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.937 111.9 52.5 -59.7 -39.4 14.6 68.0 114.8 395 47 B E H X S+ 0 0 32 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.898 108.1 51.0 -64.5 -43.9 12.5 66.7 111.9 396 48 B T H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.919 109.7 49.1 -57.0 -49.2 9.4 68.7 113.1 397 49 B A H X>S+ 0 0 0 -4,-1.9 5,-1.9 2,-0.2 4,-1.2 0.802 110.5 50.5 -61.2 -46.3 11.4 72.0 113.4 398 50 B A H <5S+ 0 0 37 -4,-1.8 -1,-0.2 3,-0.2 -2,-0.2 0.895 111.2 50.6 -59.1 -38.2 12.9 71.5 109.9 399 51 B K H <5S+ 0 0 117 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.874 120.4 31.9 -71.4 -36.7 9.4 70.9 108.5 400 52 B V H <5S- 0 0 12 -4,-2.3 293,-2.9 -5,-0.1 -1,-0.2 0.580 109.1-124.1 -95.9 -10.7 7.7 74.0 110.0 401 53 B K T <5 + 0 0 110 -4,-1.2 293,-2.1 -5,-0.3 294,-0.9 0.996 63.1 119.4 64.1 74.4 11.0 76.0 109.8 402 54 B A < - 0 0 0 -5,-1.9 -1,-0.2 291,-0.2 -2,-0.1 -0.984 65.7 -97.2-153.3 155.3 11.6 77.2 113.3 403 55 B P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 49,-0.2 -0.263 43.3-166.6 -62.9 158.7 14.1 76.9 116.1 404 56 B V E - n 0 452C 0 47,-1.1 49,-2.5 -25,-0.1 2,-0.5 -0.947 19.6-127.3-152.1 157.4 13.4 74.3 118.8 405 57 B I E -mn 381 453C 0 -25,-1.5 -23,-2.2 -2,-0.3 2,-0.5 -0.988 16.0-162.0-113.3 119.9 14.6 73.3 122.2 406 58 B V E +mn 382 454C 0 47,-2.1 49,-2.4 -2,-0.5 2,-0.3 -0.897 23.5 173.7 -91.9 126.8 15.7 69.7 122.8 407 59 B Q E -mn 383 455C 1 -25,-3.0 -23,-2.5 -2,-0.5 2,-0.4 -0.878 23.2-150.5-133.8 165.7 15.8 69.0 126.5 408 60 B F E - n 0 456C 0 47,-1.3 49,-2.5 -2,-0.3 2,-0.1 -0.997 9.5-145.9-129.0 139.9 16.3 66.1 128.9 409 61 B S > - 0 0 12 -2,-0.4 4,-2.7 -25,-0.3 5,-0.2 -0.347 37.8-103.6 -85.3 168.5 14.9 65.5 132.3 410 62 B N H > S+ 0 0 33 48,-0.4 4,-2.2 1,-0.2 5,-0.1 0.927 126.5 46.3 -60.7 -45.2 16.9 63.7 134.9 411 63 B G H > S+ 0 0 15 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.840 113.6 47.4 -60.7 -44.4 14.8 60.6 134.2 412 64 B G H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.928 110.6 52.8 -66.1 -43.3 15.1 60.9 130.4 413 65 B A H X S+ 0 0 0 -4,-2.7 4,-1.2 1,-0.2 3,-0.4 0.938 109.8 47.3 -61.6 -45.6 18.9 61.5 130.6 414 66 B S H X S+ 0 0 37 -4,-2.2 4,-1.2 1,-0.2 3,-0.4 0.866 106.2 58.0 -75.3 -21.9 19.4 58.3 132.6 415 67 B F H < S+ 0 0 4 -4,-1.6 4,-0.2 1,-0.2 -1,-0.2 0.867 101.7 57.5 -66.4 -32.5 17.2 56.3 130.2 416 68 B I H < S+ 0 0 1 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.810 106.4 47.1 -62.6 -36.6 19.6 57.4 127.5 417 69 B A H < S- 0 0 0 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.751 124.8-110.3 -78.0 -18.5 22.5 55.8 129.4 418 70 B G >< - 0 0 2 -4,-1.2 3,-2.3 -5,-0.2 -2,-0.1 0.270 14.5-100.5 94.5 136.3 20.3 52.7 129.9 419 71 B K T 3 S+ 0 0 141 1,-0.3 -1,-0.1 -4,-0.2 -4,-0.1 0.596 119.3 56.8 -60.5 -13.8 18.6 51.4 133.0 420 72 B G T 3 S+ 0 0 29 -3,-0.1 -1,-0.3 -377,-0.1 -2,-0.1 0.357 75.5 122.0-101.1 6.3 21.3 48.8 133.4 421 73 B V < - 0 0 23 -3,-2.3 2,-0.7 -7,-0.2 -321,-0.2 -0.391 62.0-128.5 -69.0 159.7 24.3 51.1 133.5 422 74 B K - 0 0 66 -323,-1.1 2,-0.7 6,-0.1 -321,-0.1 -0.872 23.6-155.1-107.9 105.5 26.5 50.8 136.6 423 75 B S + 0 0 53 -2,-0.7 4,-0.1 1,-0.2 5,-0.1 -0.837 22.0 176.9 -97.3 124.3 27.1 54.2 138.2 424 76 B D + 0 0 114 -2,-0.7 -1,-0.2 2,-0.1 3,-0.1 0.988 69.6 50.5 -60.5 -73.0 30.0 54.9 140.3 425 77 B V S > S- 0 0 77 1,-0.1 3,-1.9 2,-0.1 4,-0.3 -0.170 101.2 -84.2 -80.0 155.8 29.4 58.6 141.0 426 78 B P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.458 117.0 3.2 -60.2 129.0 26.2 60.3 142.2 427 79 B Q T 3> S+ 0 0 54 -4,-0.1 4,-2.0 -3,-0.1 5,-0.1 0.734 89.9 146.2 64.9 18.7 23.9 61.0 139.3 428 80 B G H <> + 0 0 3 -3,-1.9 4,-2.4 1,-0.2 5,-0.2 0.930 66.1 47.3 -60.4 -41.4 26.4 59.2 137.0 429 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