==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-NOV-02 1N5L . COMPND 2 MOLECULE: THYMIDYLATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR E.FIORAVANTI,A.HAOUZ,T.URSBY,H.MUNIER-LEHMANN,M.DELARUE, . 398 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16427.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 301 75.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 10.8 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 . 28 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 43.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 3.8 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 0 0 1 0 2 0 6 2 1 2 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 5 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 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 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 75 0, 0.0 90,-2.8 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 132.3 54.5 22.6 95.4 2 2 A L E -a 91 0A 7 88,-0.2 132,-1.9 130,-0.1 133,-1.4 -0.931 360.0-176.6-109.8 122.2 51.2 23.0 93.5 3 3 A I E -ab 92 135A 0 88,-3.5 90,-3.8 -2,-0.6 2,-0.4 -0.965 9.6-162.1-122.7 133.8 48.1 21.5 95.1 4 4 A A E -ab 93 136A 0 131,-2.3 133,-3.4 -2,-0.4 2,-0.6 -0.951 7.1-153.4-116.6 132.3 44.6 21.4 93.6 5 5 A I E -ab 94 137A 0 88,-2.9 90,-2.3 -2,-0.4 2,-0.3 -0.924 23.1-175.4-103.8 119.3 41.5 20.8 95.8 6 6 A E E + b 0 138A 0 131,-2.8 133,-2.7 -2,-0.6 2,-0.2 -0.763 17.8 117.6-115.6 162.2 38.8 19.1 93.7 7 7 A G - 0 0 0 -2,-0.3 133,-0.1 131,-0.2 3,-0.1 -0.781 55.5 -78.0 155.8 160.0 35.2 18.2 94.4 8 8 A V > - 0 0 6 131,-0.3 3,-1.7 -2,-0.2 4,-0.2 -0.220 67.9 -69.7 -74.8 168.5 31.5 18.8 93.5 9 9 A D T 3 S+ 0 0 50 1,-0.3 -1,-0.2 2,-0.1 140,-0.1 -0.370 123.3 25.7 -61.2 134.3 29.5 21.8 94.6 10 10 A G T 3 S+ 0 0 34 -3,-0.1 -1,-0.3 -2,-0.1 -2,-0.1 0.471 83.5 116.9 90.8 2.5 28.9 21.7 98.3 11 11 A A S < S- 0 0 0 -3,-1.7 -2,-0.1 130,-0.1 173,-0.1 0.782 84.8-113.8 -73.0 -26.9 31.9 19.5 99.2 12 12 A G > + 0 0 30 -4,-0.2 4,-1.8 -5,-0.1 5,-0.1 0.825 58.2 155.8 95.0 41.2 33.5 22.3 101.3 13 13 A K H > S+ 0 0 20 -5,-0.2 4,-2.8 2,-0.2 5,-0.2 0.889 70.7 53.3 -66.6 -41.0 36.5 23.1 99.2 14 14 A R H > S+ 0 0 74 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.945 109.4 49.0 -59.5 -49.0 36.9 26.7 100.5 15 15 A T H > S+ 0 0 85 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.909 113.6 46.2 -57.2 -46.0 36.9 25.5 104.1 16 16 A L H X S+ 0 0 2 -4,-1.8 4,-2.9 2,-0.2 5,-0.3 0.888 109.6 54.3 -65.5 -40.4 39.5 22.8 103.3 17 17 A V H X S+ 0 0 13 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.962 110.8 47.7 -57.0 -49.1 41.6 25.3 101.4 18 18 A E H X S+ 0 0 140 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.921 114.6 44.0 -57.1 -50.5 41.6 27.5 104.5 19 19 A K H X S+ 0 0 58 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.912 113.1 50.0 -64.2 -46.4 42.5 24.8 106.9 20 20 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.925 110.4 51.4 -59.9 -43.9 45.2 23.2 104.8 21 21 A S H X S+ 0 0 2 -4,-2.4 4,-2.8 -5,-0.3 5,-0.2 0.937 110.1 48.5 -58.4 -49.2 46.8 26.7 104.3 22 22 A G H X S+ 0 0 37 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.906 110.7 52.4 -58.2 -41.1 46.9 27.4 108.0 23 23 A A H X S+ 0 0 14 -4,-2.4 4,-1.1 2,-0.2 -2,-0.2 0.940 111.2 45.4 -61.1 -48.0 48.4 23.9 108.5 24 24 A F H <>S+ 0 0 0 -4,-2.6 5,-1.3 2,-0.2 3,-0.5 0.919 112.4 51.6 -62.1 -43.7 51.2 24.6 106.0 25 25 A R H ><5S+ 0 0 134 -4,-2.8 3,-2.3 1,-0.3 -2,-0.2 0.934 107.1 52.7 -59.2 -44.5 51.9 28.0 107.4 26 26 A A H 3<5S+ 0 0 93 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.774 105.1 57.4 -62.6 -24.2 52.1 26.6 110.9 27 27 A A T 3<5S- 0 0 60 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.348 128.7 -98.4 -87.9 7.0 54.7 24.2 109.5 28 28 A G T < 5S+ 0 0 67 -3,-2.3 2,-0.4 1,-0.3 -3,-0.2 0.883 82.1 124.9 80.7 39.4 56.8 27.1 108.3 29 29 A R < - 0 0 94 -5,-1.3 2,-0.3 -4,-0.2 -1,-0.3 -0.982 58.1-122.5-132.0 144.4 55.8 27.3 104.7 30 30 A S - 0 0 42 -2,-0.4 60,-2.0 57,-0.1 2,-0.4 -0.628 30.6-162.9 -83.3 143.8 54.4 30.2 102.7 31 31 A V E -c 90 0A 7 -2,-0.3 2,-0.3 58,-0.2 60,-0.2 -0.990 14.8-179.7-135.9 133.4 51.0 29.6 101.0 32 32 A A E -c 91 0A 11 58,-2.2 60,-2.7 -2,-0.4 2,-0.3 -0.945 12.6-159.1-125.6 147.3 49.1 31.3 98.2 33 33 A T E -c 92 0A 71 -2,-0.3 2,-0.3 58,-0.2 60,-0.2 -0.938 10.0-177.2-130.1 153.2 45.7 30.3 96.9 34 34 A L E -c 93 0A 26 58,-1.7 60,-2.4 -2,-0.3 2,-0.4 -0.992 14.7-144.4-146.9 141.2 43.7 30.9 93.6 35 35 A A E -c 94 0A 50 -2,-0.3 60,-0.2 58,-0.2 61,-0.1 -0.880 18.7-116.2-115.7 144.1 40.2 29.8 92.7 36 36 A F S S+ 0 0 8 58,-2.4 2,-0.2 -2,-0.4 34,-0.0 -0.962 89.2 41.3-127.6 144.2 38.7 28.7 89.4 37 37 A P S S- 0 0 27 0, 0.0 2,-1.8 0, 0.0 33,-0.1 0.545 81.4-142.7 -68.8 152.0 36.6 29.7 87.4 38 38 A R >> - 0 0 28 -2,-0.2 3,-2.2 32,-0.1 4,-1.2 -0.429 23.8-169.1 -84.8 65.0 37.9 33.2 87.8 39 39 A Y T 34 S+ 0 0 108 -2,-1.8 4,-0.1 1,-0.3 5,-0.0 -0.271 71.3 19.8 -55.5 136.9 34.5 34.9 87.7 40 40 A G T 34 S+ 0 0 62 2,-0.4 -1,-0.3 1,-0.1 3,-0.1 0.165 122.2 60.0 89.8 -19.4 34.9 38.7 87.3 41 41 A Q T <4 S+ 0 0 135 -3,-2.2 2,-0.4 1,-0.2 -2,-0.2 0.505 100.0 54.9-115.3 -12.4 38.5 38.5 86.1 42 42 A S X - 0 0 10 -4,-1.2 4,-2.5 1,-0.1 -2,-0.4 -0.986 57.4-156.1-131.1 134.7 38.0 36.4 82.9 43 43 A V H > S+ 0 0 66 -2,-0.4 4,-3.0 2,-0.2 5,-0.3 0.915 102.4 50.8 -69.8 -43.4 35.7 36.9 79.9 44 44 A A H > S+ 0 0 4 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.929 112.8 47.6 -59.7 -43.6 35.8 33.2 79.1 45 45 A A H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.943 114.0 45.9 -63.0 -47.8 34.9 32.5 82.7 46 46 A D H X S+ 0 0 41 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.903 111.9 49.7 -63.6 -43.3 32.0 35.1 82.8 47 47 A I H X S+ 0 0 3 -4,-3.0 4,-2.8 1,-0.2 -1,-0.2 0.892 110.4 53.2 -62.7 -37.1 30.6 34.0 79.4 48 48 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.931 110.8 44.7 -62.7 -47.0 30.6 30.4 80.7 49 49 A A H X S+ 0 0 17 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.949 114.5 49.5 -62.0 -49.1 28.7 31.3 83.9 50 50 A E H ><>S+ 0 0 57 -4,-2.9 5,-2.3 1,-0.2 3,-1.2 0.899 109.9 51.1 -55.8 -43.5 26.3 33.4 81.8 51 51 A A H ><5S+ 0 0 3 -4,-2.8 3,-1.7 1,-0.3 -1,-0.2 0.885 105.2 57.0 -62.7 -37.2 25.8 30.5 79.4 52 52 A L H 3<5S+ 0 0 8 -4,-2.1 100,-2.9 1,-0.3 -1,-0.3 0.647 103.7 54.7 -68.3 -14.4 25.1 28.3 82.4 53 53 A H T <<5S- 0 0 119 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.131 132.0 -89.5-103.8 18.1 22.3 30.7 83.3 54 54 A G T < 5S+ 0 0 66 -3,-1.7 -3,-0.2 1,-0.3 3,-0.2 0.494 87.2 125.9 91.6 3.8 20.6 30.3 79.9 55 55 A E < + 0 0 86 -5,-2.3 5,-0.4 1,-0.2 -1,-0.3 -0.419 49.6 43.6 -91.1 170.2 22.4 33.2 78.1 56 56 A H S > S- 0 0 18 -2,-0.1 3,-2.3 3,-0.1 -1,-0.2 0.919 100.1-105.2 62.9 49.4 24.3 33.0 74.8 57 57 A G T 3 S- 0 0 54 1,-0.3 3,-0.3 -3,-0.2 4,-0.1 -0.069 90.6 -6.7 44.2-116.7 21.9 30.9 72.8 58 58 A D T > S+ 0 0 43 1,-0.2 3,-0.8 2,-0.1 4,-0.4 0.218 98.5 110.4 -96.3 13.8 23.0 27.3 72.4 59 59 A L G X S+ 0 0 0 -3,-2.3 3,-1.8 1,-0.2 7,-0.3 0.936 78.0 48.6 -54.7 -51.4 26.5 27.7 73.8 60 60 A A G 3 S+ 0 0 19 -5,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.704 94.5 75.0 -64.6 -19.2 25.9 25.6 77.0 61 61 A S G < S+ 0 0 74 -3,-0.8 2,-0.6 -4,-0.1 -1,-0.3 0.698 85.3 78.4 -67.3 -16.0 24.3 22.8 74.9 62 62 A S <> - 0 0 0 -3,-1.8 4,-2.0 -4,-0.4 5,-0.2 -0.854 63.2-164.6 -99.7 120.8 27.9 21.9 73.9 63 63 A V H > S+ 0 0 7 -2,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.939 92.7 45.4 -64.8 -50.1 30.0 20.0 76.4 64 64 A Y H > S+ 0 0 20 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.812 110.3 54.4 -66.8 -30.7 33.3 20.7 74.6 65 65 A A H > S+ 0 0 4 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.950 111.4 44.4 -67.2 -48.5 32.5 24.4 74.2 66 66 A M H X S+ 0 0 1 -4,-2.0 4,-1.9 -7,-0.3 5,-0.2 0.937 114.7 50.7 -58.6 -44.9 31.8 24.8 77.9 67 67 A A H X S+ 0 0 1 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.891 107.9 52.4 -60.1 -42.1 35.0 22.8 78.5 68 68 A T H X S+ 0 0 2 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.874 107.4 52.8 -63.7 -36.4 37.0 25.0 76.2 69 69 A L H X S+ 0 0 4 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.912 109.7 46.3 -66.3 -44.6 35.8 28.2 78.0 70 70 A F H X S+ 0 0 23 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.868 114.8 49.6 -65.7 -35.5 36.9 27.0 81.4 71 71 A A H X S+ 0 0 1 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.895 109.0 50.5 -69.9 -40.5 40.2 25.9 79.9 72 72 A L H X S+ 0 0 28 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.828 108.1 55.1 -66.8 -29.3 40.7 29.3 78.2 73 73 A D H < S+ 0 0 0 -4,-1.7 4,-0.3 2,-0.2 -1,-0.2 0.931 110.0 45.0 -67.5 -44.7 40.0 30.9 81.6 74 74 A R H >< S+ 0 0 7 -4,-1.9 3,-1.8 1,-0.2 4,-0.3 0.893 107.9 58.4 -66.1 -37.1 42.8 28.8 83.1 75 75 A A H >< S+ 0 0 26 -4,-2.6 3,-1.5 1,-0.3 4,-0.3 0.888 100.5 57.0 -58.2 -39.3 45.1 29.6 80.2 76 76 A G T 3< S+ 0 0 48 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.619 105.8 52.8 -68.1 -10.3 44.7 33.2 81.0 77 77 A A T <> S+ 0 0 0 -3,-1.8 4,-2.7 -4,-0.3 -1,-0.3 0.342 75.7 100.8-106.5 5.1 46.0 32.5 84.5 78 78 A V H <> S+ 0 0 24 -3,-1.5 4,-2.9 -4,-0.3 5,-0.2 0.928 84.1 48.4 -55.3 -48.2 49.2 30.7 83.6 79 79 A H H > S+ 0 0 139 -4,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.858 112.1 50.3 -62.1 -34.9 51.4 33.7 84.2 80 80 A T H > S+ 0 0 62 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.911 112.2 46.6 -69.6 -41.4 49.6 34.2 87.6 81 81 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.912 111.6 50.5 -66.6 -42.7 50.2 30.6 88.6 82 82 A Q H X S+ 0 0 83 -4,-2.9 4,-1.0 -5,-0.2 -1,-0.2 0.842 109.2 52.6 -65.2 -32.8 53.8 30.6 87.5 83 83 A G H X S+ 0 0 30 -4,-1.6 4,-1.9 -5,-0.2 3,-0.4 0.930 110.8 46.3 -68.4 -43.7 54.3 33.7 89.5 84 84 A L H X S+ 0 0 35 -4,-2.1 4,-3.3 1,-0.2 -2,-0.2 0.930 108.9 55.3 -63.1 -43.5 52.9 32.1 92.7 85 85 A C H < S+ 0 0 54 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.748 111.5 45.1 -61.4 -25.9 54.9 28.9 92.2 86 86 A R H < S+ 0 0 177 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.800 120.0 39.9 -86.5 -31.4 58.1 31.0 92.1 87 87 A G H < S+ 0 0 56 -4,-1.9 2,-0.3 -5,-0.1 -2,-0.2 0.776 113.2 48.3 -90.1 -27.7 57.1 33.1 95.1 88 88 A Y < - 0 0 103 -4,-3.3 3,-0.1 -5,-0.1 -57,-0.1 -0.873 65.4-137.6-120.4 149.4 55.5 30.6 97.5 89 89 A D S S+ 0 0 88 -2,-0.3 2,-0.4 1,-0.2 -58,-0.2 0.872 97.5 29.1 -66.5 -37.1 56.4 27.2 98.8 90 90 A V E - c 0 31A 2 -60,-2.0 -58,-2.2 -6,-0.1 2,-0.5 -0.992 62.6-171.0-132.3 129.9 52.8 26.0 98.4 91 91 A V E -ac 2 32A 1 -90,-2.8 -88,-3.5 -2,-0.4 2,-0.5 -0.984 11.8-163.8-119.2 118.0 50.2 27.1 95.9 92 92 A I E -ac 3 33A 0 -60,-2.7 -58,-1.7 -2,-0.5 2,-0.6 -0.915 2.3-158.5-108.1 121.4 46.7 25.7 96.5 93 93 A L E -ac 4 34A 0 -90,-3.8 -88,-2.9 -2,-0.5 2,-1.2 -0.878 12.1-144.4-103.9 119.0 44.2 25.9 93.7 94 94 A D E S-ac 5 35A 24 -60,-2.4 -58,-2.4 -2,-0.6 -88,-0.1 -0.714 85.1 -8.4 -81.5 99.5 40.5 25.7 94.6 95 95 A R S S+ 0 0 37 -90,-2.3 -59,-0.2 -2,-1.2 2,-0.2 0.574 82.2 171.2 79.0 129.0 39.3 23.7 91.6 96 96 A Y >> - 0 0 0 -3,-0.1 3,-1.5 -92,-0.1 4,-0.5 -0.554 51.8 -40.7-142.5-153.1 41.7 23.0 88.7 97 97 A V H >> S+ 0 0 0 1,-0.3 4,-1.2 -2,-0.2 3,-1.0 0.777 123.1 64.3 -54.8 -33.6 42.1 21.0 85.5 98 98 A A H 3> S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 -1,-0.3 0.781 91.4 66.7 -64.0 -26.2 40.4 17.8 86.9 99 99 A S H <> S+ 0 0 10 -3,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.826 100.0 50.0 -62.3 -33.4 37.2 19.7 87.3 100 100 A N H S+ 0 0 0 -4,-2.3 5,-2.6 -5,-0.3 4,-0.6 0.939 113.2 52.2 -60.6 -45.9 32.8 13.3 81.2 106 106 A A H ><5S+ 0 0 1 -4,-2.3 3,-0.8 -5,-0.3 -1,-0.2 0.881 107.6 51.3 -58.5 -40.5 29.8 13.4 83.5 107 107 A R H 3<5S+ 0 0 68 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.833 114.9 43.5 -65.5 -31.6 27.8 15.5 81.0 108 108 A L H 3<5S- 0 0 54 -4,-1.6 -1,-0.2 -3,-0.4 -2,-0.2 0.379 111.7-119.0 -93.5 1.8 28.6 13.0 78.3 109 109 A H T <<5S+ 0 0 133 -3,-0.8 -3,-0.2 -4,-0.6 2,-0.2 0.842 70.7 134.9 61.7 33.9 27.9 9.9 80.5 110 110 A E < - 0 0 61 -5,-2.6 2,-0.2 -6,-0.2 -1,-0.2 -0.512 49.9-123.3-102.8 174.1 31.5 8.8 80.0 111 111 A N > - 0 0 74 -2,-0.2 3,-3.0 -3,-0.1 6,-0.4 -0.690 35.3 -89.5-115.2 172.3 34.0 7.6 82.6 112 112 A A T 3 S+ 0 0 5 1,-0.3 54,-0.0 -2,-0.2 -10,-0.0 0.660 127.1 54.0 -54.7 -17.5 37.4 8.8 83.8 113 113 A A T 3 S+ 0 0 73 4,-0.1 -1,-0.3 62,-0.0 -3,-0.0 0.438 94.8 102.7 -98.3 2.2 39.0 6.5 81.2 114 114 A G S <> S- 0 0 18 -3,-3.0 4,-1.2 1,-0.0 5,-0.1 0.023 86.6 -90.7 -77.9-176.6 36.9 8.0 78.3 115 115 A K H > S+ 0 0 145 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.906 115.8 53.4 -61.0 -52.4 37.6 10.5 75.5 116 116 A A H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.887 109.0 48.7 -55.2 -45.5 36.6 13.8 77.2 117 117 A A H > S+ 0 0 1 -6,-0.4 4,-1.2 1,-0.2 -1,-0.2 0.853 114.0 46.9 -65.5 -34.4 38.9 13.3 80.2 118 118 A A H X S+ 0 0 41 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.877 110.7 53.5 -72.4 -37.4 41.8 12.4 77.8 119 119 A W H X S+ 0 0 8 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.918 104.3 54.6 -62.0 -45.4 40.9 15.4 75.7 120 120 A V H X>S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 5,-0.5 0.873 108.4 49.5 -57.0 -39.2 41.1 17.7 78.7 121 121 A Q H X>S+ 0 0 60 -4,-1.2 5,-1.0 1,-0.2 4,-0.9 0.898 110.9 48.7 -67.6 -42.5 44.6 16.5 79.5 122 122 A R H <>S+ 0 0 133 -4,-1.9 5,-1.4 3,-0.2 -2,-0.2 0.828 119.9 38.7 -65.8 -36.1 45.8 17.0 75.8 123 123 A I H <>S+ 0 0 6 -4,-2.3 5,-2.4 3,-0.2 6,-0.3 0.971 121.3 34.5 -80.7 -63.3 44.4 20.5 75.8 124 124 A E H <5S+ 0 0 1 -4,-2.3 6,-2.6 3,-0.2 5,-0.2 0.926 124.4 36.6 -62.5 -49.9 45.0 22.1 79.2 125 125 A F T < - 0 0 73 -2,-0.4 4,-2.6 1,-0.1 5,-0.3 -0.326 30.9-110.9 -69.2 156.6 28.3 11.2 98.3 143 143 A A H > S+ 0 0 42 1,-0.2 4,-3.6 2,-0.2 5,-0.2 0.900 118.3 53.3 -55.7 -41.5 25.4 12.5 96.2 144 144 A E H > S+ 0 0 81 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.901 111.6 42.3 -62.5 -43.8 23.2 12.2 99.3 145 145 A L H > S+ 0 0 93 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.872 119.1 45.8 -72.0 -35.4 25.4 14.3 101.5 146 146 A A H >< S+ 0 0 15 -4,-2.6 3,-0.6 2,-0.2 -2,-0.2 0.933 110.6 52.7 -70.4 -46.2 26.1 16.8 98.7 147 147 A G H 3< S+ 0 0 70 -4,-3.6 -1,-0.2 -5,-0.3 -2,-0.2 0.797 105.6 56.6 -59.3 -28.1 22.4 16.9 97.9 148 148 A E H 3< 0 0 85 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.860 360.0 360.0 -72.0 -35.1 21.8 17.7 101.5 149 149 A R << 0 0 144 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.2 0.120 360.0 360.0-117.2 360.0 24.1 20.7 101.4 150 ! 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 0.0 151 163 A D > 0 0 75 0, 0.0 4,-1.9 0, 0.0 -98,-0.2 0.000 360.0 360.0 360.0-179.2 22.5 27.4 86.8 152 164 A N T 4 + 0 0 57 -100,-2.9 4,-0.4 1,-0.2 -99,-0.1 0.854 360.0 42.8 -56.1 -39.7 22.2 24.4 84.4 153 165 A Y T >4 S+ 0 0 32 2,-0.2 3,-1.9 -101,-0.1 7,-0.3 0.980 112.0 47.2 -74.0 -60.6 24.8 22.5 86.3 154 166 A E T 34 S+ 0 0 61 1,-0.3 -2,-0.2 5,-0.1 -1,-0.1 0.866 110.7 55.5 -49.9 -41.4 24.0 23.0 90.0 155 167 A R T 3< S+ 0 0 87 -4,-1.9 2,-1.1 1,-0.1 -1,-0.3 0.673 89.8 85.3 -67.7 -18.4 20.3 22.3 89.3 156 168 A D <> + 0 0 64 -3,-1.9 4,-2.6 -4,-0.4 5,-0.2 -0.710 50.5 176.8 -91.8 94.7 21.2 18.9 87.8 157 169 A A H > S+ 0 0 72 -2,-1.1 4,-2.7 1,-0.2 -1,-0.2 0.873 83.4 55.3 -62.9 -37.4 21.5 16.4 90.7 158 170 A E H > S+ 0 0 136 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.912 109.8 46.7 -61.4 -42.4 22.1 13.6 88.2 159 171 A L H > S+ 0 0 9 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.929 111.5 50.4 -65.5 -45.7 25.0 15.5 86.8 160 172 A Q H X S+ 0 0 29 -4,-2.6 4,-2.0 -7,-0.3 -2,-0.2 0.906 112.0 48.8 -59.3 -41.8 26.4 16.3 90.2 161 173 A Q H X S+ 0 0 119 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.975 113.3 44.4 -62.5 -54.6 26.1 12.6 91.1 162 174 A R H X S+ 0 0 57 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.818 110.7 56.6 -60.1 -31.7 27.9 11.4 88.0 163 175 A T H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.916 105.6 50.2 -66.0 -43.0 30.5 14.1 88.4 164 176 A G H X S+ 0 0 21 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.910 109.8 52.6 -60.7 -38.7 31.3 12.8 91.8 165 177 A A H X S+ 0 0 50 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.898 108.6 47.7 -65.7 -42.0 31.6 9.3 90.3 166 178 A V H X S+ 0 0 5 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.908 110.3 53.9 -66.5 -38.8 34.1 10.5 87.6 167 179 A Y H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.952 105.6 52.8 -57.7 -49.5 36.1 12.3 90.3 168 180 A A H X S+ 0 0 56 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.874 114.1 43.5 -54.9 -37.3 36.3 9.1 92.4 169 181 A E H X S+ 0 0 73 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.865 108.6 55.4 -77.6 -37.7 37.7 7.3 89.3 170 182 A L H X>S+ 0 0 0 -4,-2.9 5,-2.4 1,-0.2 4,-0.5 0.930 110.9 48.1 -58.8 -43.8 40.1 10.1 88.3 171 183 A A H ><5S+ 0 0 13 -4,-2.6 3,-1.0 -5,-0.2 8,-0.3 0.927 111.5 48.0 -62.4 -47.2 41.6 9.8 91.8 172 184 A A H 3<5S+ 0 0 88 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.856 114.7 46.5 -63.7 -35.5 41.9 6.0 91.7 173 185 A Q H 3<5S- 0 0 103 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.436 108.5-122.0 -88.4 0.3 43.5 6.0 88.2 174 186 A G T X<5 - 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0 0 0 -2,-0.2 133,-0.1 131,-0.2 3,-0.1 -0.786 56.0 -67.3 152.5 164.0 32.5 37.9 52.1 205 8 B V > - 0 0 15 131,-0.3 3,-1.6 -2,-0.2 5,-0.3 -0.127 69.0 -70.3 -71.0 171.9 31.7 34.2 51.7 206 9 B D T 3 S+ 0 0 23 1,-0.3 141,-0.2 2,-0.1 -1,-0.2 -0.413 122.2 17.4 -65.3 135.5 34.3 31.4 51.4 207 10 B G T 3 S+ 0 0 23 139,-0.1 -1,-0.3 -2,-0.1 139,-0.1 0.578 84.9 127.8 78.6 9.2 36.1 31.4 48.1 208 11 B A S < S- 0 0 2 -3,-1.6 -2,-0.1 130,-0.1 131,-0.1 0.786 80.4-111.6 -68.1 -26.5 35.0 35.0 47.4 209 12 B G > + 0 0 26 -4,-0.2 4,-2.2 -5,-0.1 3,-0.3 0.613 65.3 148.3 103.7 18.1 38.5 36.1 46.7 210 13 B K H > + 0 0 15 -5,-0.3 4,-3.1 1,-0.2 5,-0.3 0.887 68.3 57.8 -50.8 -49.5 39.1 38.3 49.7 211 14 B R H > S+ 0 0 152 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.930 110.4 45.6 -47.7 -50.8 42.8 37.6 50.0 212 15 B T H > S+ 0 0 64 -3,-0.3 4,-2.6 2,-0.2 5,-0.3 0.927 111.1 50.7 -60.3 -48.8 43.2 38.8 46.5 213 16 B L H X S+ 0 0 10 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.912 110.3 50.8 -56.0 -44.3 41.1 41.9 47.0 214 17 B V H X S+ 0 0 10 -4,-3.1 4,-2.1 2,-0.2 -1,-0.2 0.876 110.3 51.1 -61.1 -38.6 43.1 42.8 50.1 215 18 B E H X S+ 0 0 130 -4,-1.9 4,-2.0 -5,-0.3 -2,-0.2 0.970 112.4 43.3 -63.3 -56.0 46.3 42.4 48.1 216 19 B K H X S+ 0 0 106 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.875 114.9 51.0 -57.8 -40.8 45.3 44.7 45.2 217 20 B L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 0.875 106.6 53.6 -67.4 -38.4 43.9 47.2 47.7 218 21 B S H X S+ 0 0 8 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.920 110.9 46.9 -62.7 -43.3 47.1 47.3 49.7 219 22 B G H X S+ 0 0 36 -4,-2.0 4,-3.1 2,-0.2 5,-0.2 0.960 111.3 50.1 -62.7 -51.9 49.1 48.1 46.6 220 23 B A H X S+ 0 0 18 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.939 112.3 48.0 -51.0 -52.9 46.8 50.8 45.4 221 24 B F H <>S+ 0 0 1 -4,-2.5 5,-2.7 1,-0.2 -1,-0.2 0.921 114.6 45.2 -54.8 -48.6 46.8 52.5 48.8 222 25 B R H ><5S+ 0 0 131 -4,-2.4 3,-1.8 3,-0.2 -1,-0.2 0.849 108.0 59.0 -65.0 -33.5 50.6 52.3 49.0 223 26 B A H 3<5S+ 0 0 86 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.868 102.9 52.0 -62.5 -36.6 50.7 53.5 45.4 224 27 B A T 3<5S- 0 0 71 -4,-1.9 -1,-0.3 -3,-0.2 -2,-0.2 0.152 130.2-102.2 -85.3 19.2 48.9 56.6 46.6 225 28 B G T < 5S+ 0 0 64 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.587 77.8 136.9 73.3 14.5 51.6 56.9 49.2 226 29 B R < - 0 0 97 -5,-2.7 2,-0.3 -6,-0.2 -1,-0.2 -0.784 55.4-122.7 -98.1 134.9 49.6 55.5 52.2 227 30 B S - 0 0 44 -2,-0.4 60,-2.6 -5,-0.0 59,-0.5 -0.577 34.1-162.4 -74.4 131.8 51.2 53.1 54.6 228 31 B V E -g 287 0B 8 -2,-0.3 2,-0.4 58,-0.2 60,-0.2 -0.939 18.1-179.8-124.4 142.0 49.2 49.9 54.8 229 32 B A E -g 288 0B 11 58,-2.7 60,-3.6 -2,-0.4 2,-0.4 -0.987 12.2-159.3-133.7 140.9 49.0 47.0 57.2 230 33 B T E -g 289 0B 68 -2,-0.4 2,-0.3 58,-0.2 60,-0.2 -0.944 9.1-177.7-125.6 147.7 46.8 43.9 56.9 231 34 B L E -g 290 0B 34 58,-2.8 60,-2.2 -2,-0.4 2,-0.4 -0.995 11.9-152.0-142.9 134.5 45.5 41.4 59.4 232 35 B A E -g 291 0B 45 -2,-0.3 60,-0.2 58,-0.3 61,-0.1 -0.872 19.0-111.6-114.4 143.7 43.3 38.4 58.8 233 36 B F S S+ 0 0 9 58,-2.6 2,-0.1 -2,-0.4 34,-0.0 -0.930 93.8 46.1-117.1 143.8 40.9 36.6 61.1 234 37 B P S S- 0 0 25 0, 0.0 2,-2.2 0, 0.0 -1,-0.1 0.513 84.7-139.8 -73.2 151.2 40.8 34.0 62.4 235 38 B R > - 0 0 34 -2,-0.1 3,-2.2 3,-0.1 4,-0.5 -0.434 22.9-164.6 -79.6 70.1 44.4 34.5 63.5 236 39 B Y T 3 S+ 0 0 122 -2,-2.2 4,-0.1 1,-0.3 -4,-0.1 -0.278 74.5 15.7 -55.6 136.6 45.6 30.9 62.9 237 40 B G T 3 S+ 0 0 55 2,-0.4 -1,-0.3 1,-0.1 3,-0.1 0.182 120.8 66.3 84.5 -18.6 48.9 30.3 64.7 238 41 B Q S < S+ 0 0 149 -3,-2.2 2,-0.3 1,-0.2 -2,-0.2 0.256 101.7 43.8-115.8 8.8 48.5 33.4 66.9 239 42 B S > - 0 0 18 -4,-0.5 4,-2.3 1,-0.1 -2,-0.4 -0.918 55.7-155.3-158.8 126.2 45.5 32.2 68.9 240 43 B V H > S+ 0 0 47 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.881 103.8 57.0 -66.3 -37.4 44.6 29.0 70.5 241 44 B A H > S+ 0 0 6 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.909 109.3 45.4 -59.6 -41.9 41.0 30.0 70.2 242 45 B A H > S+ 0 0 0 -7,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.927 113.3 48.9 -67.1 -46.5 41.4 30.4 66.4 243 46 B D H X S+ 0 0 42 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.888 111.1 48.7 -61.7 -42.5 43.3 27.1 66.1 244 47 B I H X S+ 0 0 2 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.866 109.8 54.5 -66.8 -33.5 40.7 25.1 68.0 245 48 B A H X S+ 0 0 0 -4,-1.5 4,-2.0 -5,-0.3 -2,-0.2 0.924 109.7 45.9 -65.1 -45.0 38.0 26.8 65.9 246 49 B A H X S+ 0 0 21 -4,-2.2 4,-0.6 2,-0.2 -2,-0.2 0.924 113.2 48.5 -64.4 -45.3 39.6 25.6 62.7 247 50 B E H ><>S+ 0 0 48 -4,-2.4 5,-2.3 1,-0.2 3,-0.6 0.854 110.4 53.9 -62.8 -33.9 40.2 22.1 64.0 248 51 B A H ><5S+ 0 0 0 -4,-2.0 3,-1.9 1,-0.2 -1,-0.2 0.875 101.0 57.3 -68.3 -39.8 36.6 22.1 65.1 249 52 B L H 3<5S+ 0 0 6 -4,-2.0 108,-3.0 1,-0.3 -1,-0.2 0.658 104.3 56.2 -66.8 -12.9 35.3 23.0 61.6 250 53 B H T <<5S- 0 0 91 -3,-0.6 -1,-0.3 -4,-0.6 -2,-0.2 0.070 131.8 -91.4-104.5 22.6 37.1 19.9 60.5 251 54 B G T < 5S+ 0 0 54 -3,-1.9 -3,-0.2 1,-0.3 3,-0.2 0.358 86.0 126.3 89.7 -5.8 35.2 17.6 62.9 252 55 B E < + 0 0 108 -5,-2.3 5,-0.4 1,-0.2 -1,-0.3 -0.240 47.4 46.7 -82.4 173.9 37.6 17.7 65.9 253 56 B H S > S- 0 0 14 3,-0.1 3,-2.3 2,-0.1 -1,-0.2 0.910 100.0-102.5 62.8 49.6 36.8 18.6 69.5 254 57 B G T 3 S- 0 0 51 1,-0.3 3,-0.3 -3,-0.2 4,-0.1 -0.090 92.1 -8.0 46.0-124.2 33.6 16.6 70.0 255 58 B D T >> S+ 0 0 42 1,-0.2 3,-0.9 2,-0.1 4,-0.5 0.248 100.6 111.5 -89.6 12.9 30.4 18.6 69.8 256 59 B L G X4 S+ 0 0 1 -3,-2.3 3,-1.9 1,-0.2 7,-0.2 0.944 76.7 46.0 -50.2 -62.1 32.1 21.9 69.7 257 60 B A G 34 S+ 0 0 18 -5,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.647 97.3 74.8 -58.7 -18.5 31.2 22.9 66.1 258 61 B S G <4 S+ 0 0 77 -3,-0.9 2,-0.6 -4,-0.1 -1,-0.3 0.710 82.9 78.2 -70.3 -18.8 27.6 21.8 66.7 259 62 B S S+ 0 0 9 -2,-0.6 4,-2.4 1,-0.2 -1,-0.2 0.947 93.7 44.3 -61.4 -49.1 26.5 28.1 66.6 261 64 B Y H > S+ 0 0 19 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.784 108.6 57.2 -69.0 -27.3 27.2 30.4 69.6 262 65 B A H > S+ 0 0 2 2,-0.2 4,-2.0 -6,-0.2 -1,-0.2 0.908 110.4 44.6 -69.5 -40.2 30.2 28.4 70.8 263 66 B M H X S+ 0 0 1 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.934 113.2 49.8 -68.5 -43.7 31.8 28.9 67.4 264 67 B A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.900 109.6 53.9 -60.2 -39.2 30.9 32.6 67.3 265 68 B T H X S+ 0 0 3 -4,-2.3 4,-3.4 1,-0.2 5,-0.2 0.926 106.0 50.2 -62.1 -46.6 32.4 32.9 70.8 266 69 B L H X S+ 0 0 4 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.894 112.5 47.2 -60.2 -40.4 35.7 31.4 69.9 267 70 B F H X S+ 0 0 22 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.904 114.2 47.8 -67.7 -39.2 36.0 33.8 66.9 268 71 B A H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.907 110.8 51.0 -66.7 -40.4 35.0 36.7 69.2 269 72 B L H X S+ 0 0 21 -4,-3.4 4,-1.7 2,-0.2 -1,-0.2 0.855 107.7 54.6 -64.8 -33.5 37.5 35.5 71.8 270 73 B D H < S+ 0 0 0 -4,-1.9 3,-0.3 -5,-0.2 -2,-0.2 0.963 110.3 44.4 -63.5 -51.4 40.2 35.4 69.1 271 74 B R H >< S+ 0 0 7 -4,-2.1 3,-2.3 1,-0.2 4,-0.4 0.897 107.6 59.6 -60.8 -39.5 39.5 39.1 68.1 272 75 B A H >< S+ 0 0 26 -4,-2.5 3,-1.3 1,-0.3 4,-0.3 0.899 103.2 51.5 -55.7 -41.6 39.4 40.1 71.8 273 76 B G T 3< S+ 0 0 54 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.472 107.7 56.4 -74.8 1.8 43.0 38.9 72.1 274 77 B A T <> S+ 0 0 0 -3,-2.3 4,-2.7 -4,-0.1 -1,-0.2 0.384 74.4 101.6-111.3 0.2 43.7 41.0 69.1 275 78 B V H <> S+ 0 0 24 -3,-1.3 4,-2.0 -4,-0.4 5,-0.2 0.904 86.2 42.1 -52.3 -51.3 42.5 44.4 70.4 276 79 B H H > S+ 0 0 157 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.850 113.1 55.5 -68.1 -31.3 46.0 45.7 71.3 277 80 B T H > S+ 0 0 63 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.931 110.1 44.7 -64.6 -45.7 47.3 44.4 68.0 278 81 B I H X S+ 0 0 1 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.848 114.4 48.2 -67.7 -36.8 44.7 46.2 66.0 279 82 B Q H X S+ 0 0 104 -4,-2.0 4,-1.1 -5,-0.2 -1,-0.2 0.855 110.7 53.6 -71.1 -34.2 45.2 49.4 67.9 280 83 B G H X S+ 0 0 45 -4,-2.1 4,-1.4 -5,-0.2 -2,-0.2 0.869 109.8 46.7 -67.8 -37.0 48.9 49.0 67.4 281 84 B L H X S+ 0 0 36 -4,-1.9 4,-1.5 2,-0.2 3,-0.2 0.928 108.2 54.1 -70.6 -46.2 48.5 48.7 63.7 282 85 B C H < S+ 0 0 49 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.784 110.6 49.8 -58.6 -26.5 46.2 51.7 63.4 283 86 B R H < S+ 0 0 91 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.826 114.2 42.9 -81.5 -33.8 48.9 53.7 65.2 284 87 B G H < S+ 0 0 51 -4,-1.4 2,-0.3 -3,-0.2 -2,-0.2 0.532 117.2 36.8 -92.1 -7.1 51.7 52.6 63.0 285 88 B Y < - 0 0 108 -4,-1.5 -57,-0.1 1,-0.1 3,-0.1 -0.972 68.3-129.3-143.4 158.6 50.1 52.8 59.5 286 89 B D S S+ 0 0 93 -59,-0.5 2,-0.4 -2,-0.3 -58,-0.2 0.846 99.3 32.0 -73.5 -36.3 47.6 55.1 57.7 287 90 B V E - g 0 228B 1 -60,-2.6 -58,-2.7 -6,-0.1 2,-0.5 -0.981 62.9-170.4-130.8 123.9 45.5 52.1 56.6 288 91 B V E -eg 199 229B 0 -90,-3.3 -88,-3.2 -2,-0.4 2,-0.5 -0.956 12.4-162.8-111.6 123.5 44.9 48.9 58.4 289 92 B I E -eg 200 230B 0 -60,-3.6 -58,-2.8 -2,-0.5 2,-0.5 -0.936 1.4-159.0-113.6 125.7 43.1 46.2 56.3 290 93 B L E -eg 201 231B 0 -90,-3.3 -88,-3.3 -2,-0.5 2,-1.1 -0.891 12.9-145.7-107.4 125.0 41.4 43.2 57.9 291 94 B D E S-eg 202 232B 26 -60,-2.2 -58,-2.6 -2,-0.5 -88,-0.1 -0.796 84.0 -12.2 -87.1 100.3 40.7 40.1 56.0 292 95 B R S S+ 0 0 30 -90,-2.3 -59,-0.2 -2,-1.1 2,-0.2 0.368 78.8 169.0 78.6 145.4 37.4 39.1 57.7 293 96 B Y >> - 0 0 0 -92,-0.1 3,-1.9 -61,-0.1 4,-0.8 -0.788 53.2 -36.4-160.1-158.2 36.2 40.8 60.9 294 97 B V H >> S+ 0 0 0 1,-0.3 4,-1.5 -2,-0.2 3,-0.5 0.812 124.3 62.4 -47.2 -42.9 33.1 41.1 63.2 295 98 B A H 3> S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 -1,-0.3 0.787 94.1 64.7 -58.6 -27.6 30.6 41.0 60.4 296 99 B S H <> S+ 0 0 11 -3,-1.9 4,-2.8 1,-0.2 5,-0.4 0.952 101.9 48.7 -59.2 -48.7 31.8 37.5 59.5 297 100 B N H <>S+ 0 0 0 -4,-2.1 5,-2.8 -5,-0.3 3,-0.6 0.951 113.5 51.0 -60.6 -48.7 22.7 34.1 61.4 303 106 B A H ><5S+ 0 0 0 -4,-2.5 3,-1.6 -5,-0.3 -2,-0.2 0.916 107.4 52.2 -55.4 -46.8 23.1 31.9 58.4 304 107 B R H 3<5S+ 0 0 60 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.787 113.9 44.8 -62.6 -25.1 23.7 28.7 60.5 305 108 B L T <<5S- 0 0 53 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.333 112.3-118.1 -99.7 7.3 20.5 29.5 62.5 306 109 B H T < 5S+ 0 0 133 -3,-1.6 2,-0.2 -4,-0.3 -3,-0.2 0.896 72.4 134.0 55.7 39.2 18.4 30.3 59.4 307 110 B E < - 0 0 61 -5,-2.8 -1,-0.2 -6,-0.2 2,-0.2 -0.702 46.3-140.9-111.0 166.1 18.0 33.9 60.7 308 111 B N > - 0 0 76 -2,-0.2 3,-1.8 -3,-0.1 6,-0.4 -0.390 46.6 -71.8-112.0-165.2 18.4 37.1 58.8 309 112 B A T 3 S+ 0 0 9 1,-0.3 6,-0.1 -2,-0.2 62,-0.0 0.707 131.3 57.6 -63.7 -21.3 19.9 40.5 59.9 310 113 B A T 3 S+ 0 0 95 4,-0.1 -1,-0.3 5,-0.0 2,-0.0 0.367 88.6 107.3 -91.0 5.1 17.0 41.1 62.2 311 114 B G S <> S- 0 0 17 -3,-1.8 4,-1.4 1,-0.1 5,-0.2 -0.254 83.9-105.8 -80.7 169.7 17.6 37.9 64.1 312 115 B K H > S+ 0 0 133 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.853 112.8 59.6 -63.4 -37.5 18.9 37.4 67.6 313 116 B A H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.909 103.8 49.4 -59.8 -46.2 22.4 36.2 66.6 314 117 B A H > S+ 0 0 0 -6,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.940 115.2 43.9 -58.8 -48.7 23.3 39.3 64.6 315 118 B A H X S+ 0 0 40 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.892 112.6 54.1 -63.4 -40.0 22.3 41.6 67.5 316 119 B W H X S+ 0 0 14 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.928 107.4 48.8 -60.7 -47.4 24.1 39.2 69.9 317 120 B V H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 5,-0.5 0.909 109.6 54.7 -59.2 -41.0 27.3 39.4 68.0 318 121 B Q H X>S+ 0 0 54 -4,-2.0 4,-1.5 -5,-0.2 5,-1.0 0.927 112.2 41.3 -56.9 -50.8 27.0 43.2 67.9 319 122 B R H X>S+ 0 0 118 -4,-2.3 5,-2.0 3,-0.2 4,-0.6 0.908 116.1 49.6 -64.6 -46.7 26.6 43.5 71.7 320 123 B I H <>S+ 0 0 9 -4,-2.6 5,-2.1 3,-0.2 6,-0.2 0.946 122.1 26.6 -59.5 -55.6 29.3 40.9 72.5 321 124 B E H <5S+ 0 0 0 -4,-2.4 6,-2.7 -5,-0.2 -3,-0.2 0.905 129.9 32.6 -82.1 -44.0 32.1 42.2 70.3 322 125 B F H <5S+ 0 0 17 -4,-1.5 -3,-0.2 -5,-0.5 -2,-0.1 0.873 130.7 28.9 -83.3 -37.0 31.6 45.9 69.9 323 126 B A T < - 0 0 58 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 -0.460 35.7-142.2 -65.5 131.4 28.7 34.1 42.4 340 143 B A H > S+ 0 0 35 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.862 102.3 48.8 -63.0 -37.2 27.8 31.4 44.9 341 144 B E H > S+ 0 0 139 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.930 113.0 45.7 -68.1 -47.9 28.7 28.8 42.3 342 145 B L H > S+ 0 0 64 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.887 114.1 49.3 -64.5 -38.6 32.0 30.3 41.5 343 146 B A H X S+ 0 0 3 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.950 111.4 49.2 -65.1 -48.2 32.8 30.8 45.2 344 147 B G H X S+ 0 0 27 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.908 112.9 47.4 -57.2 -43.1 31.9 27.2 45.9 345 148 B E H X S+ 0 0 106 -4,-2.5 4,-3.1 2,-0.2 -1,-0.2 0.868 107.6 56.3 -67.0 -37.7 34.1 26.0 43.0 346 149 B R H X S+ 0 0 109 -4,-2.3 4,-3.5 2,-0.2 -1,-0.2 0.912 109.7 45.2 -60.1 -44.8 37.0 28.2 44.1 347 150 B S H < S+ 0 0 8 -4,-2.2 -1,-0.2 -141,-0.2 -2,-0.2 0.923 113.1 51.1 -64.2 -45.4 37.0 26.6 47.6 348 151 B R H < S+ 0 0 129 -4,-2.1 3,-0.4 -5,-0.2 -2,-0.2 0.928 117.5 39.5 -57.4 -46.5 36.7 23.2 46.0 349 152 B G H < S+ 0 0 56 -4,-3.1 2,-2.7 1,-0.3 -2,-0.2 0.956 109.4 57.8 -69.2 -52.4 39.6 24.0 43.7 350 153 B R < 0 0 65 -4,-3.5 -1,-0.3 -5,-0.2 -2,-0.1 -0.284 360.0 360.0 -76.2 54.8 41.8 25.8 46.2 351 154 B A 0 0 60 -2,-2.7 -2,-0.2 -3,-0.4 -3,-0.2 -0.107 360.0 360.0-169.4 360.0 41.6 22.7 48.4 352 ! 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 0.0 353 160 B R 0 0 178 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 129.6 44.3 21.2 52.9 354 161 B A - 0 0 60 -4,-0.0 2,-0.1 1,-0.0 -6,-0.0 -0.913 360.0 -91.4-129.1 155.6 40.6 20.1 52.8 355 162 B R - 0 0 76 -2,-0.3 2,-0.1 -7,-0.1 -4,-0.0 -0.368 40.9-135.1 -67.5 142.1 37.3 22.0 53.0 356 163 B D > - 0 0 14 -2,-0.1 4,-1.8 1,-0.1 -106,-0.2 -0.323 33.4 -88.0 -89.8 178.3 35.8 22.4 56.4 357 164 B N T 4 S+ 0 0 86 -108,-3.0 4,-0.1 1,-0.2 -107,-0.1 0.632 125.9 51.3 -62.8 -16.6 32.2 21.9 57.4 358 165 B Y T >4 S+ 0 0 24 2,-0.1 3,-0.9 -109,-0.1 7,-0.3 0.890 109.9 48.3 -84.9 -43.9 31.2 25.5 56.6 359 166 B E T 34 S+ 0 0 22 1,-0.2 -2,-0.2 -3,-0.1 -1,-0.1 0.783 108.6 53.3 -65.5 -31.9 32.7 25.4 53.0 360 167 B R T 3< S+ 0 0 68 -4,-1.8 2,-1.3 1,-0.2 -1,-0.2 0.603 89.5 88.3 -80.7 -9.6 31.1 22.1 52.2 361 168 B D <> + 0 0 67 -3,-0.9 4,-2.4 -5,-0.2 5,-0.2 -0.665 55.1 179.9 -92.3 84.9 27.7 23.5 53.2 362 169 B A H > S+ 0 0 76 -2,-1.3 4,-1.7 1,-0.2 -1,-0.2 0.854 81.9 48.2 -53.0 -40.6 26.5 25.1 49.9 363 170 B E H > S+ 0 0 139 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.887 107.9 54.0 -71.6 -36.6 23.3 26.3 51.4 364 171 B L H > S+ 0 0 3 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.945 109.4 50.0 -59.6 -44.6 25.0 27.8 54.5 365 172 B Q H X S+ 0 0 22 -4,-2.4 4,-1.8 -7,-0.3 -1,-0.2 0.866 110.3 49.2 -61.1 -39.6 27.2 29.8 52.0 366 173 B Q H X S+ 0 0 108 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.927 113.4 45.8 -66.9 -46.0 24.2 31.1 50.0 367 174 B R H X S+ 0 0 53 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.863 110.5 54.1 -65.3 -35.0 22.4 32.2 53.2 368 175 B T H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.882 107.0 51.6 -66.9 -35.6 25.6 33.8 54.5 369 176 B G H X S+ 0 0 27 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.928 112.1 46.9 -64.6 -42.8 25.8 35.7 51.3 370 177 B A H X S+ 0 0 51 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.889 110.9 49.4 -65.6 -44.3 22.2 36.9 51.7 371 178 B V H X S+ 0 0 6 -4,-2.7 4,-2.4 1,-0.2 3,-0.2 0.928 108.9 55.1 -62.5 -42.7 22.7 37.9 55.4 372 179 B Y H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.911 104.7 53.0 -54.0 -46.5 25.8 39.8 54.4 373 180 B A H X S+ 0 0 55 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.862 109.6 48.7 -59.9 -36.8 23.8 41.8 51.8 374 181 B E H X S+ 0 0 79 -4,-1.6 4,-1.5 -3,-0.2 -1,-0.2 0.897 110.5 50.5 -70.0 -41.5 21.3 42.7 54.5 375 182 B L H <>S+ 0 0 0 -4,-2.4 5,-2.3 1,-0.2 4,-0.4 0.950 113.1 46.2 -60.3 -49.2 24.0 43.8 56.9 376 183 B A H ><5S+ 0 0 12 -4,-2.8 3,-1.1 1,-0.2 8,-0.4 0.901 109.7 54.0 -59.8 -44.7 25.6 46.0 54.2 377 184 B A H 3<5S+ 0 0 93 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.790 113.9 41.5 -62.2 -31.3 22.3 47.5 53.1 378 185 B Q T 3<5S- 0 0 111 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.322 110.1-116.0-101.0 7.3 21.5 48.7 56.6 379 186 B G T X 5 - 0 0 32 -3,-1.1 3,-2.4 -4,-0.4 -3,-0.2 0.865 39.3-165.8 62.3 37.3 24.9 49.9 57.6 380 187 B W T 3 - 0 0 24 -2,-0.3 3,-1.1 -52,-0.2 -50,-0.1 -0.615 37.4-100.7-109.0 170.9 32.4 42.8 42.7 389 196 B A T 3 S+ 0 0 58 -52,-0.4 -51,-0.1 1,-0.3 -1,-0.0 0.785 119.1 61.8 -62.1 -27.5 35.6 40.8 41.8 390 197 B D T 3 S+ 0 0 153 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 -0.099 76.4 135.9 -91.4 35.3 36.2 43.1 38.8 391 198 B V < - 0 0 32 -3,-1.1 3,-0.1 1,-0.1 -4,-0.0 -0.631 60.9-114.9 -85.9 141.8 36.5 46.2 41.0 392 199 B D > - 0 0 82 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 -0.656 18.9-153.0 -78.7 118.4 39.3 48.7 40.2 393 200 B P H > S+ 0 0 33 0, 0.0 4,-3.4 0, 0.0 5,-0.3 0.950 94.0 49.8 -53.5 -56.8 41.8 48.8 43.2 394 201 B G H > S+ 0 0 40 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.856 114.8 44.2 -52.9 -40.8 43.0 52.3 42.5 395 202 B R H > S+ 0 0 177 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.891 114.1 49.2 -72.7 -40.6 39.4 53.6 42.3 396 203 B L H X S+ 0 0 5 -4,-2.8 4,-3.2 2,-0.2 5,-0.3 0.943 112.8 48.1 -62.3 -47.8 38.3 51.6 45.4 397 204 B A H X S+ 0 0 6 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.917 111.8 48.6 -58.2 -46.9 41.2 52.9 47.3 398 205 B A H < S+ 0 0 71 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.831 113.5 50.4 -63.5 -31.2 40.6 56.5 46.2 399 206 B T H < S+ 0 0 79 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.960 113.5 41.3 -70.9 -53.5 36.9 55.9 47.2 400 207 B L H < 0 0 9 -4,-3.2 -2,-0.2 -5,-0.1 -3,-0.2 0.871 360.0 360.0 -63.6 -38.8 37.6 54.5 50.7 401 208 B A < 0 0 45 -4,-2.8 -3,-0.2 -5,-0.3 -4,-0.1 0.700 360.0 360.0-118.8 360.0 40.4 57.1 51.4