==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-OCT-05 2EU8 . COMPND 2 MOLECULE: ADENYLATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR S.CHEN,Y.SHAMOO . 432 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21254.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 313 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 24 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 177 41.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.9 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 1 0 0 2 1 1 7 0 2 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 4 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 . 4 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 M 0 0 6 0, 0.0 80,-1.6 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 88.8 -3.4 77.0 23.8 2 2 A N E +a 81 0A 1 78,-0.3 106,-3.0 104,-0.2 107,-1.3 -0.881 360.0 175.0-103.9 107.4 -0.3 78.8 22.4 3 3 A L E -ab 82 109A 0 78,-2.8 80,-3.0 -2,-0.7 2,-0.4 -0.849 26.7-162.7-122.9 153.2 1.9 76.3 20.5 4 4 A V E -ab 83 110A 2 105,-1.8 107,-3.2 -2,-0.3 2,-0.5 -0.998 10.9-158.2-128.5 130.3 5.0 76.1 18.4 5 5 A L E +ab 84 111A 1 78,-2.6 80,-1.6 -2,-0.4 81,-0.4 -0.943 18.7 172.7-109.4 128.6 5.8 73.1 16.2 6 6 A M E + b 0 112A 13 105,-2.5 107,-2.8 -2,-0.5 2,-0.2 -0.952 11.2 128.3-134.3 156.3 9.5 72.7 15.3 7 7 A G - 0 0 14 -2,-0.3 3,-0.1 105,-0.2 107,-0.1 -0.861 57.3 -72.0 169.0 159.9 11.4 69.9 13.5 8 8 A L S > S- 0 0 28 105,-0.4 3,-2.6 -2,-0.2 4,-0.2 -0.248 76.2 -65.5 -66.0 158.8 13.8 69.3 10.6 9 9 A P T 3 S+ 0 0 5 0, 0.0 -1,-0.2 0, 0.0 115,-0.1 -0.209 125.9 10.3 -47.6 123.3 12.5 69.6 7.1 10 10 A G T 3 S+ 0 0 21 -3,-0.1 -2,-0.1 113,-0.1 0, 0.0 0.458 84.7 127.2 85.8 1.6 10.0 66.8 6.5 11 11 A A S < S- 0 0 3 -3,-2.6 -3,-0.1 1,-0.1 105,-0.0 0.719 87.3 -93.7 -63.4 -22.6 9.7 65.7 10.2 12 12 A G S > S+ 0 0 14 -4,-0.2 4,-2.5 -5,-0.1 5,-0.3 0.697 74.7 142.7 116.9 27.2 6.0 66.1 10.0 13 13 A K H > S+ 0 0 24 -5,-0.2 4,-2.5 1,-0.2 5,-0.2 0.935 81.0 43.9 -61.7 -47.5 5.0 69.5 11.2 14 14 A G H > S+ 0 0 33 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.872 113.9 51.1 -66.0 -37.8 2.1 69.9 8.7 15 15 A T H > S+ 0 0 23 2,-0.2 4,-0.9 1,-0.2 -2,-0.2 0.932 116.1 39.5 -65.7 -46.9 0.9 66.4 9.3 16 16 A Q H X S+ 0 0 6 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.845 113.2 56.2 -72.2 -33.8 0.7 66.8 13.0 17 17 A G H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.3 5,-0.2 0.862 100.6 57.9 -65.9 -36.7 -0.6 70.3 12.8 18 18 A E H X S+ 0 0 53 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.861 108.2 47.8 -60.7 -36.2 -3.5 69.2 10.7 19 19 A R H X S+ 0 0 48 -4,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.880 111.0 50.7 -72.6 -39.6 -4.5 66.8 13.5 20 20 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 5,-0.4 0.918 108.6 51.0 -64.3 -44.9 -4.1 69.5 16.2 21 21 A V H X S+ 0 0 41 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.833 109.0 51.7 -64.1 -32.4 -6.3 72.0 14.3 22 22 A E H < S+ 0 0 162 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.921 115.2 40.6 -71.0 -42.9 -9.1 69.5 13.9 23 23 A D H < S+ 0 0 73 -4,-1.8 -2,-0.2 1,-0.1 -1,-0.2 0.809 133.7 19.0 -75.0 -30.7 -9.2 68.6 17.6 24 24 A Y H < S- 0 0 70 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.668 85.2-134.5-117.9 -19.8 -8.8 72.1 18.9 25 25 A G < + 0 0 56 -4,-1.8 -4,-0.2 -5,-0.4 -3,-0.1 0.761 50.5 144.9 72.7 24.0 -9.7 74.7 16.2 26 26 A I - 0 0 12 -6,-0.3 -1,-0.2 1,-0.1 55,-0.2 -0.717 60.2 -89.5 -93.5 148.5 -6.7 77.0 16.8 27 27 A P - 0 0 19 0, 0.0 55,-2.7 0, 0.0 2,-0.9 -0.313 31.6-137.1 -58.4 131.7 -5.2 78.7 13.7 28 28 A H E -c 82 0A 58 53,-0.2 2,-0.9 2,-0.0 55,-0.2 -0.820 22.9-169.5 -93.5 104.6 -2.4 76.8 11.9 29 29 A I E +c 83 0A 2 53,-3.3 55,-2.8 -2,-0.9 2,-0.6 -0.818 9.8 173.7-102.1 99.5 0.2 79.4 11.1 30 30 A S E > -c 84 0A 9 -2,-0.9 4,-2.5 53,-0.2 55,-0.2 -0.915 21.8-160.9-107.5 117.0 2.9 78.1 8.8 31 31 A T H > S+ 0 0 6 53,-1.4 4,-2.5 -2,-0.6 5,-0.2 0.873 95.6 55.1 -63.6 -34.2 5.4 80.6 7.6 32 32 A G H > S+ 0 0 20 52,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.945 110.1 45.3 -62.1 -46.7 6.3 78.3 4.7 33 33 A D H > S+ 0 0 83 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.899 111.8 53.0 -62.4 -41.6 2.7 78.1 3.7 34 34 A M H X S+ 0 0 52 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.901 109.8 47.8 -61.5 -42.5 2.4 81.9 4.0 35 35 A F H X S+ 0 0 12 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.914 113.0 47.7 -65.6 -43.0 5.4 82.5 1.8 36 36 A R H X S+ 0 0 57 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.874 109.1 52.9 -67.8 -35.7 4.1 80.1 -0.9 37 37 A A H X S+ 0 0 43 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.903 111.8 47.7 -64.0 -38.7 0.7 81.6 -0.9 38 38 A A H X>S+ 0 0 8 -4,-1.8 5,-1.8 1,-0.2 4,-0.7 0.881 109.1 53.1 -67.5 -39.3 2.4 85.0 -1.4 39 39 A M H <5S+ 0 0 39 -4,-2.3 -2,-0.2 7,-0.2 -1,-0.2 0.848 109.5 49.7 -64.6 -34.2 4.5 83.4 -4.2 40 40 A K H <5S+ 0 0 174 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.911 112.9 44.0 -70.8 -44.8 1.4 82.2 -5.9 41 41 A E H <5S- 0 0 142 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.545 107.6-131.9 -76.6 -7.2 -0.4 85.6 -5.7 42 42 A E T <5 + 0 0 145 -4,-0.7 -3,-0.2 -5,-0.2 -4,-0.1 0.854 44.6 165.8 57.3 40.0 2.9 87.1 -6.8 43 43 A T >< - 0 0 46 -5,-1.8 4,-2.3 1,-0.1 5,-0.2 -0.375 54.1-103.2 -77.5 163.3 2.9 89.8 -4.1 44 44 A P H > S+ 0 0 113 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.874 125.3 53.4 -56.9 -36.1 6.1 91.7 -3.5 45 45 A L H > S+ 0 0 46 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.938 107.9 51.1 -62.4 -46.2 6.6 89.6 -0.3 46 46 A G H > S+ 0 0 0 -8,-0.3 4,-2.3 1,-0.2 -7,-0.2 0.907 109.6 48.1 -58.1 -45.5 6.2 86.5 -2.4 47 47 A L H X S+ 0 0 95 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.907 113.3 47.9 -64.6 -40.7 8.8 87.5 -5.0 48 48 A E H X S+ 0 0 106 -4,-2.1 4,-0.6 -5,-0.2 3,-0.3 0.922 114.8 45.0 -65.9 -43.7 11.3 88.5 -2.4 49 49 A A H >X S+ 0 0 1 -4,-2.6 4,-2.6 1,-0.2 3,-0.8 0.844 99.9 71.3 -68.3 -35.6 10.9 85.2 -0.4 50 50 A K H 3X S+ 0 0 90 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.855 89.6 59.5 -49.1 -46.6 11.0 83.0 -3.5 51 51 A S H 3X S+ 0 0 66 -4,-0.9 4,-0.6 -3,-0.3 -1,-0.2 0.881 113.8 37.5 -53.0 -43.0 14.7 83.6 -4.1 52 52 A Y H XX>S+ 0 0 77 -3,-0.8 5,-2.3 -4,-0.6 4,-0.9 0.931 116.7 50.3 -75.7 -48.0 15.5 82.1 -0.7 53 53 A I H ><5S+ 0 0 23 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.903 106.8 54.2 -58.3 -45.2 12.8 79.4 -0.7 54 54 A D H 3<5S+ 0 0 62 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.789 112.9 44.5 -61.6 -27.5 13.8 78.0 -4.2 55 55 A K H <<5S- 0 0 123 -4,-0.6 -1,-0.3 -3,-0.6 -2,-0.2 0.556 115.6-114.8 -92.9 -9.3 17.4 77.6 -3.0 56 56 A G T <<5S+ 0 0 6 -3,-0.9 -3,-0.2 -4,-0.9 118,-0.2 0.583 72.3 134.7 85.9 10.6 16.4 76.1 0.3 57 57 A E < - 0 0 78 -5,-2.3 -1,-0.3 -6,-0.2 2,-0.2 -0.489 62.9 -96.5 -89.4 161.6 17.8 79.1 2.3 58 58 A L - 0 0 45 -2,-0.2 -1,-0.1 -3,-0.1 3,-0.1 -0.552 35.4-119.0 -77.3 141.0 16.1 80.9 5.1 59 59 A V - 0 0 11 -2,-0.2 -10,-0.1 1,-0.1 -1,-0.1 -0.574 51.3 -82.7 -74.2 142.5 14.1 84.0 4.2 60 60 A P > - 0 0 52 0, 0.0 4,-1.6 0, 0.0 5,-0.2 -0.110 36.4-122.3 -49.3 144.4 15.7 87.0 6.2 61 61 A D H > S+ 0 0 57 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.892 102.0 58.9 -54.0 -52.6 14.6 87.5 9.8 62 62 A E H > S+ 0 0 178 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.914 111.3 38.4 -49.3 -54.0 13.2 91.0 9.6 63 63 A V H > S+ 0 0 35 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.874 117.0 51.7 -68.4 -36.5 10.6 90.4 6.9 64 64 A T H X S+ 0 0 5 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.948 109.9 48.3 -64.6 -49.0 9.6 87.0 8.3 65 65 A I H X S+ 0 0 35 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.899 107.1 59.5 -58.1 -40.1 9.1 88.4 11.8 66 66 A G H X S+ 0 0 40 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.2 0.910 106.4 43.9 -57.0 -46.5 7.0 91.1 10.4 67 67 A I H X S+ 0 0 26 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.827 113.1 51.7 -71.6 -29.5 4.4 88.8 8.8 68 68 A V H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.895 106.3 54.8 -72.9 -37.7 4.2 86.6 11.9 69 69 A K H X S+ 0 0 111 -4,-2.4 4,-0.5 1,-0.2 -2,-0.2 0.946 111.8 43.2 -59.5 -49.5 3.6 89.6 14.2 70 70 A E H >< S+ 0 0 132 -4,-1.7 3,-1.1 1,-0.2 4,-0.4 0.919 113.6 52.7 -62.7 -43.4 0.6 90.8 12.1 71 71 A R H >< S+ 0 0 55 -4,-2.0 3,-1.7 1,-0.3 -2,-0.2 0.918 104.9 53.4 -58.8 -47.3 -0.7 87.3 11.8 72 72 A L H 3< S+ 0 0 3 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.601 101.6 62.9 -66.2 -11.1 -0.7 86.6 15.5 73 73 A G T << S+ 0 0 36 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.552 78.2 112.5 -91.3 -7.9 -2.7 89.7 16.1 74 74 A K S X S- 0 0 110 -3,-1.7 3,-1.7 -4,-0.4 4,-0.1 -0.208 79.6-113.9 -64.3 155.6 -5.7 88.5 14.2 75 75 A D G > S+ 0 0 144 1,-0.3 3,-1.8 2,-0.2 4,-0.2 0.794 111.0 69.0 -60.6 -30.5 -9.0 87.8 16.0 76 76 A D G 3 S+ 0 0 68 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.589 91.1 61.9 -68.5 -6.2 -8.8 84.1 15.2 77 77 A C G X S+ 0 0 1 -3,-1.7 3,-1.1 1,-0.2 -1,-0.3 0.349 70.5 108.9 -97.8 5.2 -5.8 83.8 17.5 78 78 A E T < S+ 0 0 117 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.847 87.0 31.7 -49.1 -44.2 -8.0 84.8 20.5 79 79 A R T 3 S- 0 0 165 1,-0.3 -1,-0.3 -3,-0.3 2,-0.3 0.418 131.5 -61.3 -98.1 1.3 -8.0 81.4 22.1 80 80 A G < - 0 0 0 -3,-1.1 -1,-0.3 -55,-0.1 2,-0.3 -0.828 47.3-131.2 143.8 178.1 -4.6 80.2 20.9 81 81 A F E -a 2 0A 1 -80,-1.6 -78,-2.8 -2,-0.3 2,-0.5 -0.983 10.3-131.3-161.3 161.9 -2.5 79.5 17.8 82 82 A L E -ac 3 28A 0 -55,-2.7 -53,-3.3 -2,-0.3 2,-0.3 -0.928 19.9-160.1-125.5 103.5 -0.3 76.9 16.2 83 83 A L E -ac 4 29A 0 -80,-3.0 -78,-2.6 -2,-0.5 2,-0.4 -0.687 9.6-170.0 -82.8 137.0 3.0 78.2 14.9 84 84 A D E -ac 5 30A 11 -55,-2.8 -53,-1.4 -2,-0.3 -52,-0.5 -0.964 68.8 -2.2-133.0 112.2 4.6 75.9 12.3 85 85 A G S S+ 0 0 4 -80,-1.6 -79,-0.1 -2,-0.4 -55,-0.1 0.587 101.4 131.4 85.9 7.3 8.1 76.5 11.0 86 86 A F + 0 0 0 -81,-0.4 -81,-0.3 1,-0.2 -1,-0.1 -0.975 55.2 27.5-147.1 131.3 8.6 79.7 13.1 87 87 A P + 0 0 4 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.609 63.9 154.9 -83.2 165.1 10.8 80.4 14.8 88 88 A R + 0 0 56 1,-0.2 2,-0.3 -2,-0.1 94,-0.1 0.093 64.2 51.4-137.6 22.5 13.7 78.6 13.3 89 89 A T S > S- 0 0 10 1,-0.1 4,-2.0 92,-0.1 3,-0.2 -0.960 84.5-118.7-152.0 149.2 16.5 80.8 14.5 90 90 A V H > S+ 0 0 41 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.879 115.2 57.5 -59.6 -37.9 17.3 82.1 18.0 91 91 A A H > S+ 0 0 45 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.896 107.6 46.6 -60.0 -41.3 16.9 85.7 16.7 92 92 A Q H > S+ 0 0 5 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.865 110.5 54.0 -68.9 -35.1 13.3 84.8 15.6 93 93 A A H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.911 109.4 47.0 -64.3 -43.4 12.7 83.1 18.9 94 94 A E H X S+ 0 0 109 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.875 112.4 50.6 -66.9 -36.2 13.8 86.2 20.8 95 95 A A H X S+ 0 0 18 -4,-1.9 4,-2.3 -5,-0.2 -2,-0.2 0.910 108.2 52.1 -67.7 -41.9 11.6 88.4 18.6 96 96 A L H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.875 102.6 60.5 -61.8 -37.5 8.6 86.1 19.1 97 97 A E H X S+ 0 0 55 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.945 108.8 42.2 -55.4 -47.9 9.1 86.5 22.9 98 98 A E H X S+ 0 0 138 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.901 113.5 53.1 -65.9 -41.1 8.6 90.2 22.6 99 99 A I H X S+ 0 0 13 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.924 112.2 43.3 -60.2 -46.9 5.7 89.8 20.2 100 100 A L H X>S+ 0 0 4 -4,-3.1 5,-2.4 2,-0.2 4,-0.9 0.738 110.1 57.6 -72.6 -21.9 3.8 87.4 22.5 101 101 A E H <5S+ 0 0 109 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.897 108.2 46.8 -72.1 -40.9 4.7 89.7 25.5 102 102 A E H <5S+ 0 0 157 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.907 118.0 41.4 -66.2 -42.7 2.9 92.5 23.7 103 103 A Y H <5S- 0 0 83 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.598 107.0-128.0 -81.0 -12.2 -0.1 90.4 22.9 104 104 A G T <5S+ 0 0 16 -4,-0.9 -3,-0.2 -5,-0.2 -4,-0.1 0.862 72.6 121.4 67.1 34.8 -0.1 88.7 26.3 105 105 A K < - 0 0 17 -5,-2.4 -4,-0.1 -6,-0.1 -1,-0.1 -0.548 42.6-173.2-129.1 68.8 -0.1 85.3 24.7 106 106 A P - 0 0 23 0, 0.0 -104,-0.2 0, 0.0 -9,-0.1 -0.258 35.0 -91.7 -64.8 148.2 3.1 83.4 26.0 107 107 A I - 0 0 0 1,-0.1 -104,-0.2 -106,-0.1 3,-0.1 -0.311 29.9-168.5 -61.2 134.3 4.0 80.0 24.6 108 108 A D S S- 0 0 44 -106,-3.0 2,-0.3 1,-0.3 -105,-0.2 0.880 72.3 -0.2 -88.2 -47.7 2.6 77.0 26.4 109 109 A Y E -b 3 0A 37 -107,-1.3 -105,-1.8 2,-0.0 2,-0.6 -1.000 49.0-152.6-145.9 144.9 4.7 74.4 24.6 110 110 A V E -bd 4 192A 0 81,-2.3 83,-3.1 -2,-0.3 2,-0.7 -0.981 27.6-156.6-113.0 111.4 7.4 74.2 21.9 111 111 A I E -bd 5 193A 0 -107,-3.2 -105,-2.5 -2,-0.6 2,-0.7 -0.841 4.0-159.8 -97.7 113.8 6.9 70.7 20.5 112 112 A N E -bd 6 194A 11 81,-3.5 83,-3.2 -2,-0.7 2,-1.2 -0.838 5.6-154.1 -96.4 116.1 9.9 69.3 18.8 113 113 A I E - d 0 195A 2 -107,-2.8 2,-0.5 -2,-0.7 -105,-0.4 -0.773 20.3-152.4 -89.7 97.1 9.1 66.5 16.4 114 114 A E E + d 0 196A 118 81,-2.5 83,-2.3 -2,-1.2 84,-0.4 -0.624 25.5 161.4 -81.2 120.5 12.4 64.6 16.4 115 115 A V - 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0 0 8 -6,-0.2 -1,-0.2 1,-0.1 55,-0.2 -0.519 64.1 -97.4 -77.7 147.4 -12.0 78.9 55.5 244 27 B P - 0 0 21 0, 0.0 55,-2.7 0, 0.0 2,-0.8 -0.423 28.5-130.0 -67.8 136.3 -10.9 79.8 52.0 245 28 B H E -k 299 0D 54 53,-0.2 2,-0.7 -2,-0.1 55,-0.2 -0.781 27.5-171.1 -86.8 112.0 -8.1 77.7 50.5 246 29 B I E +k 300 0D 2 53,-3.5 55,-2.5 -2,-0.8 2,-0.6 -0.880 9.2 174.3-114.1 103.4 -5.5 80.3 49.2 247 30 B S E > -k 301 0D 11 -2,-0.7 4,-2.6 53,-0.2 5,-0.2 -0.930 22.7-158.1-108.8 116.0 -2.7 78.8 47.2 248 31 B T H > S+ 0 0 4 53,-1.4 4,-2.3 -2,-0.6 5,-0.2 0.855 98.0 57.1 -60.4 -31.6 -0.3 81.2 45.6 249 32 B G H > S+ 0 0 16 52,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.950 108.0 45.3 -62.9 -47.9 0.5 78.5 43.1 250 33 B D H > S+ 0 0 73 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.911 111.5 53.3 -61.1 -43.5 -3.1 78.2 42.1 251 34 B M H X S+ 0 0 47 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.880 108.6 49.2 -60.9 -39.2 -3.4 82.0 41.9 252 35 B F H X S+ 0 0 13 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.924 112.4 47.6 -66.5 -43.6 -0.4 82.2 39.5 253 36 B R H X S+ 0 0 53 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.856 110.0 52.2 -66.4 -34.6 -1.8 79.5 37.2 254 37 B A H X S+ 0 0 44 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.905 110.2 49.8 -66.5 -38.9 -5.2 81.1 37.2 255 38 B A H <>S+ 0 0 7 -4,-1.9 5,-2.4 -5,-0.2 8,-0.4 0.848 111.7 47.9 -66.9 -35.9 -3.5 84.3 36.1 256 39 B M H <5S+ 0 0 38 -4,-1.9 3,-0.4 3,-0.2 -2,-0.2 0.881 109.4 52.5 -72.6 -38.3 -1.6 82.5 33.4 257 40 B K H <5S+ 0 0 124 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.880 113.1 44.1 -64.1 -37.5 -4.8 80.8 32.2 258 41 B E T <5S- 0 0 136 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.565 109.4-131.2 -82.0 -9.7 -6.5 84.2 31.9 259 42 B E T 5 + 0 0 45 -3,-0.4 -3,-0.2 -4,-0.4 -2,-0.1 0.901 46.2 164.0 58.7 46.8 -3.3 85.6 30.3 260 43 B T >< - 0 0 39 -5,-2.4 4,-2.2 1,-0.1 5,-0.2 -0.436 54.8-103.1 -88.1 164.8 -3.2 88.6 32.6 261 44 B P H > S+ 0 0 108 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.890 123.9 54.5 -55.4 -39.2 -0.0 90.8 33.0 262 45 B L H > S+ 0 0 49 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.920 107.7 49.4 -59.7 -45.3 0.6 89.1 36.4 263 46 B G H > S+ 0 0 1 -8,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.897 108.8 52.4 -61.4 -41.9 0.5 85.7 34.7 264 47 B L H X S+ 0 0 39 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.919 112.6 44.5 -60.7 -45.3 2.9 86.8 32.0 265 48 B E H < S+ 0 0 116 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.866 116.7 45.3 -68.5 -38.1 5.5 88.0 34.6 266 49 B A H >X S+ 0 0 1 -4,-2.4 4,-2.5 -5,-0.2 3,-0.7 0.829 99.5 71.9 -75.2 -32.0 5.1 85.0 36.9 267 50 B K H 3X S+ 0 0 10 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.869 88.7 58.8 -52.3 -46.8 5.3 82.5 34.0 268 51 B S H 3X S+ 0 0 54 -4,-0.9 4,-0.6 1,-0.2 -1,-0.2 0.869 114.6 37.7 -54.3 -39.3 9.0 82.9 33.2 269 52 B Y H X>>S+ 0 0 84 -3,-0.7 5,-2.2 -4,-0.5 4,-1.1 0.940 115.4 51.7 -77.2 -50.2 9.9 81.9 36.8 270 53 B I H ><5S+ 0 0 24 -4,-2.5 3,-0.7 1,-0.2 -2,-0.2 0.890 105.4 55.0 -54.3 -46.0 7.3 79.2 37.3 271 54 B D H 3<5S+ 0 0 7 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.789 111.8 44.6 -60.3 -29.9 8.2 77.4 34.1 272 55 B K H <<5S- 0 0 64 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.604 116.2-113.4 -89.2 -14.5 11.8 77.1 35.2 273 56 B G T <<5S+ 0 0 5 -4,-1.1 -3,-0.2 -3,-0.7 118,-0.2 0.566 72.7 135.8 91.4 9.6 10.9 76.1 38.7 274 57 B E < - 0 0 76 -5,-2.2 -1,-0.3 -6,-0.2 2,-0.3 -0.419 62.0 -97.5 -84.8 164.9 12.2 79.3 40.2 275 58 B L - 0 0 40 -2,-0.1 -1,-0.1 -3,-0.1 3,-0.1 -0.617 34.5-118.0 -83.4 142.7 10.4 81.4 42.8 276 59 B V - 0 0 14 -2,-0.3 -10,-0.1 1,-0.1 -1,-0.1 -0.582 50.0 -85.3 -75.3 141.7 8.4 84.3 41.6 277 60 B P > - 0 0 54 0, 0.0 4,-1.5 0, 0.0 5,-0.1 -0.041 34.6-120.8 -47.3 151.7 9.8 87.6 43.1 278 61 B D H > S+ 0 0 59 1,-0.2 4,-3.4 2,-0.2 5,-0.4 0.894 103.1 62.2 -63.7 -44.8 8.6 88.6 46.6 279 62 B E H > S+ 0 0 176 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.913 111.0 36.2 -50.9 -52.8 7.2 91.9 45.8 280 63 B V H > S+ 0 0 52 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.886 118.4 51.6 -70.6 -37.6 4.5 90.7 43.4 281 64 B T H X S+ 0 0 6 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.931 111.6 45.5 -65.5 -45.6 3.8 87.5 45.4 282 65 B I H X S+ 0 0 35 -4,-3.4 4,-2.6 1,-0.2 -1,-0.2 0.915 111.5 56.6 -62.6 -41.0 3.3 89.4 48.6 283 66 B G H X S+ 0 0 37 -4,-1.9 4,-1.9 -5,-0.4 -2,-0.2 0.899 106.0 46.2 -58.1 -45.8 1.2 91.9 46.7 284 67 B I H X S+ 0 0 25 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.828 113.8 50.4 -69.7 -29.1 -1.3 89.3 45.4 285 68 B V H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.909 107.2 52.6 -73.6 -42.1 -1.6 87.7 48.8 286 69 B K H X S+ 0 0 91 -4,-2.6 4,-0.6 1,-0.2 -2,-0.2 0.916 113.1 46.0 -58.7 -41.8 -2.2 91.1 50.6 287 70 B E H >< S+ 0 0 146 -4,-1.9 3,-0.9 -5,-0.2 4,-0.3 0.936 112.9 48.5 -66.2 -48.1 -5.0 91.7 48.1 288 71 B R H >< S+ 0 0 43 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.913 108.4 53.1 -59.2 -46.4 -6.6 88.2 48.4 289 72 B L H 3< S+ 0 0 3 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.643 98.5 66.6 -66.2 -14.5 -6.6 88.3 52.2 290 73 B G T << S+ 0 0 37 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.575 78.8 109.1 -82.8 -9.1 -8.4 91.6 52.1 291 74 B K S X S- 0 0 109 -3,-1.8 3,-1.8 -4,-0.3 4,-0.1 -0.306 81.2-116.6 -67.8 151.8 -11.5 89.9 50.6 292 75 B D G > S+ 0 0 140 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.773 109.3 68.8 -59.4 -30.1 -14.6 89.4 52.7 293 76 B D G 3 S+ 0 0 68 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.549 93.7 59.8 -69.9 -4.0 -14.4 85.6 52.6 294 77 B C G X S+ 0 0 0 -3,-1.8 3,-1.4 1,-0.1 -1,-0.3 0.330 73.7 101.0-101.6 4.2 -11.3 85.8 54.8 295 78 B E T < S+ 0 0 107 -3,-1.9 -1,-0.1 1,-0.3 -2,-0.1 0.876 88.4 37.8 -56.9 -40.9 -13.2 87.6 57.6 296 79 B R T 3 S- 0 0 192 1,-0.3 -1,-0.3 -4,-0.2 2,-0.2 0.243 130.5 -67.6 -96.9 11.3 -13.5 84.3 59.7 297 80 B G < - 0 0 1 -3,-1.4 -1,-0.3 -55,-0.1 2,-0.3 -0.692 47.8-134.8 129.9 177.5 -10.1 82.9 58.8 298 81 B F E -i 219 0D 0 -80,-1.8 -78,-2.8 -2,-0.2 2,-0.5 -0.987 11.8-127.3-166.2 163.5 -8.1 81.5 55.9 299 82 B L E -ik 220 245D 0 -55,-2.7 -53,-3.5 -2,-0.3 2,-0.2 -0.896 22.8-160.6-125.5 100.3 -5.8 78.7 54.7 300 83 B L E -ik 221 246D 0 -80,-2.9 -78,-2.0 -2,-0.5 2,-0.4 -0.584 8.7-169.5 -78.3 142.5 -2.6 79.9 53.1 301 84 B D E -ik 222 247D 9 -55,-2.5 -53,-1.4 -2,-0.2 -52,-0.5 -0.962 68.8 -0.7-138.7 114.8 -0.9 77.3 50.9 302 85 B G S S+ 0 0 3 -80,-1.8 -79,-0.1 -2,-0.4 3,-0.1 0.540 103.6 128.5 85.3 3.6 2.6 77.7 49.5 303 86 B F + 0 0 0 -81,-0.4 -81,-0.3 1,-0.3 2,-0.1 -0.969 57.0 26.6-150.3 133.4 2.9 81.1 51.1 304 87 B P + 0 0 2 0, 0.0 -1,-0.3 0, 0.0 -2,-0.2 0.593 68.5 155.7 -78.5 160.5 4.9 82.3 52.7 305 88 B R + 0 0 63 -2,-0.1 2,-0.3 1,-0.1 94,-0.1 0.233 62.9 50.4-130.4 11.4 7.8 80.1 51.5 306 89 B T S > S- 0 0 7 93,-0.1 4,-1.9 1,-0.1 3,-0.2 -0.970 85.3-116.9-142.9 152.0 10.7 82.5 52.3 307 90 B V H > S+ 0 0 37 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.869 115.6 55.4 -59.4 -37.3 11.6 84.3 55.5 308 91 B A H > S+ 0 0 49 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.898 108.0 48.1 -63.1 -40.3 11.1 87.6 53.8 309 92 B Q H > S+ 0 0 4 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.865 110.9 52.8 -67.4 -34.2 7.6 86.7 52.8 310 93 B A H X S+ 0 0 1 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.925 108.9 47.5 -67.2 -44.7 6.9 85.5 56.3 311 94 B E H X S+ 0 0 101 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.886 112.1 51.6 -64.5 -36.2 8.0 88.8 57.8 312 95 B A H X S+ 0 0 20 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.919 107.0 52.4 -65.5 -44.2 5.9 90.6 55.3 313 96 B L H X S+ 0 0 2 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.857 101.1 61.8 -60.7 -37.6 2.8 88.6 56.1 314 97 B E H X S+ 0 0 65 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.946 108.3 42.9 -52.7 -50.7 3.2 89.4 59.9 315 98 B E H X S+ 0 0 133 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.927 113.4 51.1 -61.5 -48.6 2.7 93.1 59.1 316 99 B I H X S+ 0 0 13 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.904 112.8 45.9 -56.8 -44.7 -0.1 92.4 56.7 317 100 B L H X>S+ 0 0 4 -4,-3.1 5,-2.5 2,-0.2 4,-0.9 0.796 107.5 57.6 -71.5 -28.5 -2.0 90.3 59.2 318 101 B E H <5S+ 0 0 137 -4,-1.8 3,-0.3 -5,-0.3 -1,-0.2 0.937 110.4 44.3 -65.3 -45.1 -1.3 92.8 62.0 319 102 B E H <5S+ 0 0 147 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.893 116.5 45.1 -66.1 -42.2 -3.1 95.5 59.9 320 103 B Y H <5S- 0 0 63 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.594 109.2-125.6 -77.9 -10.6 -6.0 93.1 58.9 321 104 B G T <5S+ 0 0 56 -4,-0.9 -3,-0.2 -3,-0.3 -4,-0.1 0.863 76.4 115.8 68.9 36.7 -6.2 92.0 62.5 322 105 B K < - 0 0 44 -5,-2.5 -4,-0.1 -6,-0.1 3,-0.1 -0.446 43.6-176.1-135.4 62.5 -5.9 88.3 61.6 323 106 B P - 0 0 85 0, 0.0 -104,-0.3 0, 0.0 -9,-0.1 -0.233 38.1 -91.2 -60.6 147.2 -2.6 87.0 63.1 324 107 B I - 0 0 21 1,-0.1 -104,-0.2 -106,-0.1 3,-0.1 -0.282 29.5-164.6 -60.1 137.9 -1.6 83.4 62.3 325 108 B D - 0 0 60 -106,-3.6 2,-0.3 1,-0.4 -105,-0.2 0.915 70.0 -16.6 -86.3 -61.1 -2.8 80.7 64.7 326 109 B Y E -j 220 0D 91 -107,-0.9 -105,-1.4 2,-0.0 2,-0.5 -0.990 51.8-138.1-146.5 154.0 -0.5 77.9 63.5 327 110 B V E -jl 221 409D 0 81,-2.8 83,-3.1 -2,-0.3 2,-0.6 -0.965 22.1-152.6-110.6 123.1 1.8 77.0 60.6 328 111 B I E -jl 222 410D 1 -107,-2.9 -105,-2.6 -2,-0.5 2,-0.6 -0.887 4.5-160.9-102.4 118.2 1.5 73.4 59.6 329 112 B N E -jl 223 411D 9 81,-2.8 83,-2.8 -2,-0.6 2,-1.1 -0.882 8.4-150.2 -99.2 118.8 4.6 71.9 58.0 330 113 B I E - l 0 412D 2 -107,-2.7 2,-0.5 -2,-0.6 -105,-0.4 -0.777 19.4-149.9 -91.6 98.6 3.9 68.7 56.1 331 114 B E E + l 0 413D 92 81,-2.3 83,-2.5 -2,-1.1 84,-0.5 -0.579 26.8 161.1 -76.8 120.8 7.1 66.8 56.4 332 115 B V - 0 0 14 -2,-0.5 -107,-0.2 82,-0.2 5,-0.1 -0.986 45.3-105.4-143.2 128.4 8.1 64.5 53.5 333 116 B D > - 0 0 78 -2,-0.4 3,-2.1 1,-0.2 4,-0.4 -0.265 24.9-136.6 -52.3 125.5 11.5 63.1 52.6 334 117 B K G >> S+ 0 0 73 1,-0.3 3,-1.3 2,-0.2 4,-0.6 0.805 98.7 73.2 -54.5 -30.9 12.8 64.9 49.6 335 118 B D G 34 S+ 0 0 136 1,-0.3 -1,-0.3 2,-0.1 4,-0.1 0.580 101.4 40.2 -63.3 -11.6 13.9 61.5 48.2 336 119 B V G <> S+ 0 0 49 -3,-2.1 4,-1.1 2,-0.1 -1,-0.3 0.380 92.4 84.8-117.3 1.4 10.2 60.5 47.4 337 120 B L H <> S+ 0 0 0 -3,-1.3 4,-1.7 -4,-0.4 5,-0.2 0.819 81.0 61.9 -74.3 -31.0 8.9 63.9 46.1 338 121 B M H X S+ 0 0 59 -4,-0.6 4,-2.3 1,-0.2 5,-0.2 0.929 106.0 48.1 -59.8 -42.9 10.1 63.3 42.5 339 122 B E H > S+ 0 0 85 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.852 107.6 55.2 -65.6 -36.1 7.9 60.3 42.3 340 123 B R H < S+ 0 0 57 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.828 113.7 40.5 -67.6 -31.1 4.9 62.2 43.8 341 124 B L H >< S+ 0 0 1 -4,-1.7 3,-1.0 -3,-0.2 -2,-0.2 0.855 111.6 51.6 -87.9 -36.6 5.1 64.9 41.1 342 125 B T H 3< S+ 0 0 51 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.1 0.824 113.4 46.6 -69.6 -30.4 5.9 62.8 38.0 343 126 B G T 3< S+ 0 0 6 -4,-1.4 13,-2.7 -5,-0.2 2,-0.3 0.334 91.7 117.8 -92.1 8.7 2.9 60.5 38.7 344 127 B R E < -M 355 0E 29 -3,-1.0 2,-0.4 11,-0.2 11,-0.2 -0.575 41.0-174.4 -83.1 139.0 0.7 63.5 39.3 345 128 B R E -M 354 0E 51 9,-2.2 9,-2.6 -2,-0.3 2,-0.3 -0.998 8.4-157.9-130.8 131.2 -2.4 64.3 37.2 346 129 B I E -MN 353 375E 8 29,-3.3 29,-2.5 -2,-0.4 2,-0.5 -0.837 20.7-113.2-113.0 148.7 -4.5 67.4 37.7 347 130 B C E > - 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