==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 30-AUG-13 4MI2 . COMPND 2 MOLECULE: PUTATIVE ENOYL-COA HYDRATASE/ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM ABSCESSUS; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 782 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28850.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 590 75.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 84 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 3.5 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 . 3 0.4 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 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 308 39.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.6 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 3 0 6 0 3 9 3 0 4 2 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 9 3 0 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 PARALLEL BRIDGES PER LADDER . 0 3 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 3 0 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 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 8 A A 0 0 57 0, 0.0 16,-2.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -37.4 -1.7 36.0 56.1 2 9 A V E -A 16 0A 13 14,-0.2 2,-0.3 26,-0.1 14,-0.2 -0.940 360.0-148.9-124.7 114.5 -2.2 33.5 53.2 3 10 A A E -A 15 0A 47 12,-2.2 12,-2.4 -2,-0.4 2,-0.4 -0.596 14.8-173.7 -84.8 139.0 -3.9 35.0 50.2 4 11 A Y E +A 14 0A 78 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.999 13.7 149.4-134.1 130.4 -6.2 32.9 48.0 5 12 A S E -A 13 0A 74 8,-1.5 8,-3.5 -2,-0.4 2,-0.4 -0.978 30.5-146.2-154.0 154.7 -7.9 33.7 44.7 6 13 A V E -A 12 0A 52 -2,-0.3 6,-0.2 6,-0.3 43,-0.0 -0.994 25.0-148.0-121.7 121.5 -9.0 32.0 41.5 7 14 A N > - 0 0 86 4,-2.0 3,-2.0 -2,-0.4 -2,-0.0 -0.213 32.7 -90.2 -86.6 177.2 -8.8 34.0 38.3 8 15 A H T 3 S+ 0 0 118 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.781 125.1 54.7 -54.6 -33.6 -10.9 34.0 35.1 9 16 A A T 3 S- 0 0 56 2,-0.1 -1,-0.3 1,-0.0 38,-0.1 0.425 121.0-104.4 -85.2 1.2 -8.7 31.4 33.5 10 17 A G S < S+ 0 0 5 -3,-2.0 37,-3.0 1,-0.3 38,-1.4 0.671 70.7 145.2 83.3 19.0 -9.0 28.9 36.4 11 18 A V E - b 0 48A 12 35,-0.2 -4,-2.0 36,-0.2 2,-0.5 -0.816 39.2-149.1 -88.3 115.6 -5.6 29.5 38.0 12 19 A A E -Ab 6 49A 0 36,-2.9 38,-2.9 -2,-0.7 2,-0.5 -0.762 11.6-154.8 -83.9 127.0 -5.8 29.3 41.8 13 20 A A E -Ab 5 50A 23 -8,-3.5 -8,-1.5 -2,-0.5 2,-0.5 -0.912 12.3-174.7-107.5 122.4 -3.2 31.5 43.4 14 21 A I E -Ab 4 51A 0 36,-2.9 38,-2.7 -2,-0.5 2,-0.5 -0.961 8.8-175.3-116.9 111.9 -1.9 30.8 46.9 15 22 A V E -Ab 3 52A 41 -12,-2.4 -12,-2.2 -2,-0.5 2,-0.5 -0.936 23.1-139.8-112.9 119.0 0.4 33.5 48.3 16 23 A L E -Ab 2 53A 0 36,-2.7 38,-2.7 -2,-0.5 -14,-0.2 -0.680 26.1-174.2 -69.5 124.1 2.3 33.2 51.6 17 24 A D + 0 0 81 -16,-2.8 -1,-0.1 -2,-0.5 38,-0.1 -0.563 49.4 96.6-133.9 65.6 2.0 36.7 53.0 18 25 A R > > + 0 0 68 36,-0.2 5,-2.3 -2,-0.2 3,-1.6 -0.428 38.8 157.2-140.1 57.1 3.9 37.1 56.2 19 26 A P G > 5 + 0 0 61 0, 0.0 3,-1.7 0, 0.0 37,-0.2 0.762 64.3 66.5 -63.4 -28.2 7.1 38.7 54.7 20 27 A E G 3 5S+ 0 0 111 1,-0.3 35,-0.0 2,-0.1 -3,-0.0 0.756 110.1 38.8 -65.5 -23.0 8.3 40.4 57.9 21 28 A A G X 5S- 0 0 31 -3,-1.6 3,-1.4 3,-0.1 -1,-0.3 0.110 119.6-107.0-108.8 21.6 8.8 36.9 59.4 22 29 A S T < 5S- 0 0 35 -3,-1.7 38,-1.5 1,-0.3 39,-0.2 0.846 72.8 -65.9 51.8 38.2 10.2 35.3 56.1 23 30 A N T 3 - 0 0 26 -2,-1.0 4,-2.6 36,-0.2 5,-0.2 -0.461 57.8 -86.6 -94.3 178.8 2.8 30.0 62.8 27 34 A R H > S+ 0 0 138 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.899 128.8 53.3 -56.7 -44.6 -0.7 28.6 63.6 28 35 A T H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.935 112.8 44.4 -54.1 -49.4 -2.5 31.3 61.7 29 36 A M H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.909 114.5 48.7 -61.7 -44.7 -0.3 30.6 58.6 30 37 A K H X S+ 0 0 5 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.897 113.0 47.4 -65.7 -41.4 -0.7 26.8 58.9 31 38 A T H X S+ 0 0 61 -4,-2.9 4,-2.0 -5,-0.2 -2,-0.2 0.930 115.5 43.8 -64.2 -48.8 -4.5 27.1 59.3 32 39 A E H X S+ 0 0 64 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.810 111.7 54.2 -71.5 -29.2 -5.0 29.5 56.4 33 40 A L H X S+ 0 0 3 -4,-2.3 4,-2.6 -5,-0.2 5,-0.2 0.929 107.7 49.7 -67.9 -45.6 -2.6 27.5 54.2 34 41 A L H X S+ 0 0 43 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.942 112.1 48.7 -55.6 -49.2 -4.6 24.3 54.8 35 42 A Q H X S+ 0 0 119 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.903 111.3 49.5 -58.2 -44.9 -7.9 26.2 53.9 36 43 A A H X S+ 0 0 5 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.922 113.2 46.2 -61.6 -46.6 -6.3 27.6 50.7 37 44 A L H X S+ 0 0 1 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.875 112.1 50.4 -63.5 -41.5 -5.1 24.2 49.6 38 45 A L H X S+ 0 0 103 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.875 111.2 49.5 -65.4 -38.3 -8.4 22.4 50.4 39 46 A A H X S+ 0 0 40 -4,-2.1 4,-0.9 -5,-0.2 -2,-0.2 0.920 111.0 48.6 -66.4 -46.0 -10.3 25.1 48.4 40 47 A A H >< S+ 0 0 4 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.908 113.8 48.2 -58.3 -42.0 -8.0 24.7 45.4 41 48 A G H 3< S+ 0 0 42 -4,-2.1 56,-0.2 1,-0.2 -1,-0.2 0.769 114.6 44.3 -70.5 -27.8 -8.4 21.0 45.6 42 49 A G H 3< S+ 0 0 62 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.446 88.8 97.3-100.3 -3.0 -12.2 21.0 45.9 43 50 A D X< - 0 0 61 -4,-0.9 3,-1.2 -3,-0.5 -4,-0.0 -0.797 56.8-158.6 -94.6 116.7 -13.0 23.6 43.2 44 51 A P T 3 S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.678 91.0 60.6 -66.5 -17.8 -14.0 22.1 39.8 45 52 A A T 3 S+ 0 0 58 2,-0.0 2,-0.4 -34,-0.0 -2,-0.0 0.634 79.2 101.2 -81.6 -18.7 -13.1 25.4 38.0 46 53 A V < + 0 0 7 -3,-1.2 -35,-0.2 -6,-0.2 3,-0.1 -0.575 38.4 168.3 -72.4 119.7 -9.5 25.3 39.1 47 54 A R + 0 0 49 -37,-3.0 2,-0.3 -2,-0.4 -36,-0.2 0.485 68.1 7.7-110.8 -7.3 -7.3 24.0 36.2 48 55 A A E -b 11 0A 0 -38,-1.4 -36,-2.9 50,-0.2 2,-0.4 -0.957 63.7-141.3-165.0 158.6 -3.9 24.9 37.7 49 56 A V E -bc 12 100A 0 50,-2.4 52,-3.4 -2,-0.3 2,-0.5 -0.983 7.5-163.8-128.1 134.4 -2.4 26.2 41.0 50 57 A V E -bc 13 101A 1 -38,-2.9 -36,-2.9 -2,-0.4 2,-0.5 -0.982 5.7-162.2-120.3 126.6 0.4 28.6 41.6 51 58 A M E +bc 14 102A 0 50,-3.1 52,-2.5 -2,-0.5 2,-0.3 -0.908 23.3 154.8-109.5 125.3 2.1 28.8 45.0 52 59 A S E -b 15 0A 15 -38,-2.7 -36,-2.7 -2,-0.5 2,-0.3 -0.841 26.6-140.3-142.8 178.2 4.2 32.0 45.7 53 60 A A E -b 16 0A 16 -38,-0.3 -36,-0.2 -2,-0.3 2,-0.2 -0.999 15.2-122.0-149.0 145.0 5.4 34.1 48.6 54 61 A A S S+ 0 0 27 -38,-2.7 3,-0.3 -2,-0.3 -36,-0.2 -0.535 71.4 17.4 -86.0 153.7 5.9 37.7 49.5 55 62 A G S S- 0 0 50 -2,-0.2 -2,-0.1 1,-0.2 -35,-0.1 -0.391 108.2 -48.5 86.3-164.1 9.2 39.3 50.4 56 63 A K S S+ 0 0 75 -37,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.748 117.2 57.1 -79.5 -28.1 12.8 38.1 50.0 57 64 A N - 0 0 45 -3,-0.3 49,-0.3 49,-0.2 3,-0.2 -0.904 63.1-150.6-119.7 135.4 12.3 34.5 51.3 58 65 A F S S- 0 0 0 47,-2.4 2,-0.2 49,-0.6 50,-0.2 0.984 76.8 -34.8 -63.4 -60.5 9.9 31.8 50.3 59 66 A C B -g 108 0C 0 48,-2.1 50,-2.0 46,-0.2 -1,-0.2 -0.798 38.4-163.4-169.8 121.8 9.5 30.0 53.6 60 67 A V - 0 0 55 -38,-1.5 2,-0.2 1,-0.3 51,-0.2 0.370 49.0-128.2 -90.0 7.0 11.8 29.4 56.6 61 68 A G + 0 0 1 -38,-0.3 -36,-2.6 -39,-0.2 -1,-0.3 -0.494 67.6 27.7 83.9-154.7 9.5 26.7 58.0 62 69 A Q B S-f 25 0B 53 -38,-0.2 2,-0.3 -2,-0.2 -36,-0.2 -0.061 83.5-109.1 -50.2 133.7 8.2 26.5 61.6 63 70 A D > - 0 0 20 -38,-2.1 4,-1.6 1,-0.1 -1,-0.1 -0.516 26.8-149.1 -62.0 122.7 7.8 29.8 63.5 64 71 A L H > S+ 0 0 61 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.931 90.1 50.2 -65.0 -48.4 10.6 29.7 66.1 65 72 A A H > S+ 0 0 67 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.913 111.1 48.9 -60.7 -45.3 8.8 31.8 68.8 66 73 A E H > S+ 0 0 29 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.882 112.0 50.2 -62.0 -38.0 5.7 29.7 68.7 67 74 A H H X S+ 0 0 14 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.883 106.8 54.2 -65.5 -40.9 7.8 26.6 68.9 68 75 A V H X S+ 0 0 13 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.902 107.2 51.8 -57.8 -42.8 9.7 27.9 71.9 69 76 A E H X S+ 0 0 63 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.938 111.8 45.4 -61.5 -47.5 6.3 28.5 73.7 70 77 A A H X S+ 0 0 34 -4,-1.9 4,-2.5 2,-0.2 7,-0.2 0.857 113.3 50.6 -62.2 -37.8 5.2 24.9 73.0 71 78 A L H < S+ 0 0 15 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.907 113.4 43.4 -71.8 -42.5 8.6 23.5 74.1 72 79 A R H < S+ 0 0 188 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.813 116.7 49.7 -69.8 -29.8 8.7 25.4 77.4 73 80 A D H < S- 0 0 136 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.875 137.4 -11.4 -77.3 -41.3 5.0 24.5 78.0 74 81 A D >< - 0 0 59 -4,-2.5 3,-2.3 -5,-0.1 4,-0.3 -0.500 58.4-174.4-164.6 83.9 5.2 20.8 77.3 75 82 A P G > S+ 0 0 64 0, 0.0 3,-1.0 0, 0.0 4,-0.2 0.824 86.4 59.5 -58.4 -34.9 8.4 19.3 75.8 76 83 A A G 3 S+ 0 0 53 1,-0.2 686,-0.1 2,-0.1 685,-0.1 0.626 118.9 31.3 -66.5 -13.6 7.0 15.8 75.4 77 84 A H G X S+ 0 0 98 -3,-2.3 3,-1.6 -7,-0.2 -1,-0.2 0.178 80.9 113.3-129.0 19.2 4.2 17.2 73.2 78 85 A A T < S+ 0 0 7 -3,-1.0 3,-0.4 1,-0.3 -7,-0.1 0.647 76.0 57.4 -72.0 -15.7 5.9 20.2 71.5 79 86 A M T >> + 0 0 12 -4,-0.2 3,-1.7 1,-0.2 4,-0.6 0.134 66.6 113.0-101.1 17.4 5.6 18.5 68.1 80 87 A D H X> + 0 0 80 -3,-1.6 4,-2.5 1,-0.3 3,-0.5 0.842 66.8 71.8 -50.3 -35.3 1.8 18.1 68.2 81 88 A T H 3>>S+ 0 0 19 -3,-0.4 4,-2.9 1,-0.2 5,-1.9 0.775 84.2 66.5 -57.6 -27.4 1.8 20.6 65.3 82 89 A V H <4>S+ 0 0 0 -3,-1.7 5,-3.0 3,-0.2 -1,-0.2 0.967 113.2 30.6 -59.8 -49.5 3.2 17.9 62.9 83 90 A R H <<5S+ 0 0 103 -4,-0.6 -2,-0.2 -3,-0.5 -1,-0.2 0.876 125.4 46.2 -72.6 -39.8 -0.0 15.9 63.2 84 91 A E H <5S+ 0 0 127 -4,-2.5 -2,-0.2 3,-0.1 -3,-0.2 0.857 134.3 0.7 -73.2 -36.5 -2.4 18.8 63.8 85 92 A H T X5S+ 0 0 17 -4,-2.9 4,-1.6 -5,-0.2 -3,-0.2 0.772 124.6 48.7-123.0 -54.8 -1.1 21.1 61.0 86 93 A Y H > S+ 0 0 38 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.863 111.2 54.0 -64.9 -31.7 -3.0 17.8 56.7 89 96 A V H X S+ 0 0 6 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.958 111.2 44.9 -61.0 -49.8 -1.4 20.6 54.7 90 97 A L H X S+ 0 0 12 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.872 114.7 48.4 -64.7 -37.8 0.9 18.0 52.9 91 98 A E H X S+ 0 0 95 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.886 111.0 51.1 -66.9 -38.2 -2.1 15.7 52.3 92 99 A A H X S+ 0 0 6 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.889 111.2 47.7 -64.9 -41.2 -4.2 18.7 51.0 93 100 A L H >< S+ 0 0 3 -4,-2.5 3,-1.2 1,-0.2 -2,-0.2 0.945 112.5 49.5 -63.8 -46.5 -1.4 19.6 48.6 94 101 A D H 3< S+ 0 0 70 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.818 102.8 62.0 -61.6 -33.2 -1.1 16.0 47.5 95 102 A A H 3< S+ 0 0 62 -4,-2.0 2,-0.4 -5,-0.1 -1,-0.2 0.673 76.3 106.9 -70.5 -16.3 -4.9 15.7 47.0 96 103 A I << - 0 0 1 -3,-1.2 4,-0.1 -4,-0.6 -55,-0.1 -0.501 52.5-167.8 -68.8 121.3 -4.8 18.5 44.3 97 104 A K + 0 0 158 -2,-0.4 114,-0.2 -56,-0.2 -1,-0.2 0.742 61.7 72.8 -85.0 -25.9 -5.3 16.7 40.9 98 105 A V S S- 0 0 16 1,-0.2 -50,-0.2 -52,-0.1 -51,-0.1 -0.340 101.1 -71.4 -86.1 168.3 -4.4 19.6 38.6 99 106 A P - 0 0 0 0, 0.0 -50,-2.4 0, 0.0 2,-0.5 -0.344 44.4-153.4 -65.2 139.5 -0.8 20.8 38.0 100 107 A V E -c 49 0A 1 -52,-0.2 21,-2.3 -4,-0.1 20,-1.7 -0.968 9.4-169.8-117.1 122.1 0.8 22.8 40.9 101 108 A V E -cd 50 121A 0 -52,-3.4 -50,-3.1 -2,-0.5 2,-0.4 -0.858 3.2-162.5-108.3 143.9 3.5 25.4 40.1 102 109 A V E -cd 51 122A 0 19,-2.1 21,-3.0 -2,-0.3 2,-0.6 -0.995 10.8-151.1-131.6 138.4 5.7 27.0 42.8 103 110 A A E - d 0 123A 2 -52,-2.5 2,-0.7 -2,-0.4 -50,-0.2 -0.951 18.5-160.7-108.2 114.2 7.8 30.2 42.6 104 111 A I E + d 0 124A 0 19,-3.4 21,-2.9 -2,-0.6 2,-0.3 -0.884 12.7 176.1-112.2 110.0 10.7 30.0 45.0 105 112 A N - 0 0 19 -2,-0.7 -47,-2.4 19,-0.2 -46,-0.2 -0.817 53.9 -36.3-101.9 145.2 12.6 33.1 46.1 106 113 A G S S+ 0 0 7 -2,-0.3 23,-1.7 -49,-0.3 -49,-0.2 0.038 114.3 25.9 46.1-138.2 15.4 33.2 48.7 107 114 A A E + h 0 129C 22 21,-0.2 -48,-2.1 -49,-0.1 -49,-0.6 -0.329 54.1 171.5 -69.5 131.5 15.3 30.8 51.6 108 115 A C E +gh 59 130C 0 21,-2.3 23,-1.7 -50,-0.2 2,-0.3 -0.831 26.0 146.4-138.4 90.1 13.4 27.6 51.2 109 116 A V E > - h 0 131C 25 -50,-2.0 3,-2.2 -2,-0.3 23,-0.2 -0.917 47.0 -12.3-135.3 156.1 14.1 25.5 54.3 110 117 A G T >> S- 0 0 4 21,-1.7 4,-2.3 -2,-0.3 3,-0.8 -0.320 134.0 -1.6 60.9-132.5 12.5 22.9 56.6 111 118 A A H 3> S+ 0 0 4 1,-0.3 4,-2.7 2,-0.2 -1,-0.3 0.752 132.8 65.3 -58.8 -24.9 8.7 22.7 56.1 112 119 A G H <> S+ 0 0 0 -3,-2.2 4,-1.8 2,-0.2 -1,-0.3 0.889 105.7 42.0 -63.7 -40.8 9.2 25.5 53.5 113 120 A L H <> S+ 0 0 0 -3,-0.8 4,-2.6 18,-0.3 -2,-0.2 0.917 112.3 55.2 -67.9 -45.1 11.2 23.0 51.4 114 121 A G H X S+ 0 0 1 -4,-2.3 4,-0.6 1,-0.2 -2,-0.2 0.910 109.8 46.3 -52.1 -46.7 8.7 20.3 52.2 115 122 A L H >< S+ 0 0 3 -4,-2.7 3,-0.9 1,-0.2 4,-0.4 0.918 112.8 49.7 -62.6 -46.2 5.9 22.5 50.9 116 123 A A H >< S+ 0 0 0 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.858 106.2 54.9 -63.4 -39.9 7.8 23.4 47.8 117 124 A L H 3< S+ 0 0 11 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.590 95.4 69.3 -73.1 -11.5 8.7 19.9 46.9 118 125 A G T << S+ 0 0 21 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.639 84.4 89.4 -76.2 -16.9 5.0 18.9 47.0 119 126 A A S < S- 0 0 5 -3,-1.3 -18,-0.2 -4,-0.4 3,-0.1 -0.340 76.6-135.6 -73.7 162.9 4.4 21.0 43.8 120 127 A D S S+ 0 0 17 -20,-1.7 2,-0.4 1,-0.2 -19,-0.2 0.835 90.4 33.6 -84.9 -39.8 4.8 19.5 40.3 121 128 A I E S-d 101 0A 2 -21,-2.3 -19,-2.1 300,-0.1 2,-0.5 -0.983 71.0-164.2-124.8 133.3 6.8 22.3 38.7 122 129 A R E -d 102 0A 6 -2,-0.4 58,-2.2 -21,-0.2 59,-1.2 -0.966 5.0-170.3-127.0 121.9 9.3 24.5 40.6 123 130 A I E -de 103 181A 2 -21,-3.0 -19,-3.4 -2,-0.5 2,-0.4 -0.952 12.5-162.8-114.1 119.7 10.7 27.8 39.5 124 131 A A E -de 104 182A 0 57,-3.0 59,-2.6 -2,-0.5 -19,-0.2 -0.821 15.2-131.9-105.9 138.9 13.7 29.2 41.5 125 132 A G E > - 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0 0 9 -5,-2.7 -1,-0.3 -6,-0.2 595,-0.1 -0.583 56.4-143.6-111.7 179.5 15.3 17.1 64.7 140 147 A A - 0 0 0 1,-0.2 -5,-0.3 -2,-0.2 2,-0.3 0.816 52.9 -45.8-110.2 -71.0 15.0 14.7 61.7 141 148 A A + 0 0 0 612,-0.2 616,-0.3 -7,-0.1 2,-0.3 -0.958 46.3 161.1-169.5 145.3 12.2 15.4 59.2 142 149 A D > + 0 0 6 -2,-0.3 3,-1.4 614,-0.1 -28,-0.1 -0.893 56.0 65.5-152.7-173.7 8.6 16.3 58.7 143 150 A S T 3 S- 0 0 0 -2,-0.3 607,-0.1 1,-0.2 -1,-0.1 0.808 123.1 -71.3 61.3 31.3 6.4 17.8 55.9 144 151 A A T >> S+ 0 0 8 605,-0.1 4,-2.9 1,-0.1 3,-2.0 0.489 100.4 132.5 67.3 10.4 7.1 14.6 53.8 145 152 A L H <> + 0 0 0 -3,-1.4 4,-1.7 1,-0.3 -2,-0.1 0.771 61.0 65.5 -66.0 -28.0 10.7 15.8 53.3 146 153 A S H 34 S+ 0 0 0 1,-0.2 -1,-0.3 2,-0.1 595,-0.2 0.614 117.9 26.9 -69.4 -13.6 12.1 12.4 54.2 147 154 A A H <> S+ 0 0 4 -3,-2.0 4,-1.5 3,-0.1 -2,-0.2 0.715 121.1 50.3-107.6 -47.2 10.3 11.0 51.0 148 155 A S H X S+ 0 0 21 -4,-2.9 4,-0.9 2,-0.2 -3,-0.2 0.851 107.2 53.0 -70.4 -37.3 10.1 14.0 48.7 149 156 A L H >X S+ 0 0 0 -4,-1.7 4,-2.3 -5,-0.2 3,-1.0 0.977 112.8 40.9 -64.7 -56.0 13.7 15.1 48.8 150 157 A P H 3> S+ 0 0 18 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.808 111.2 58.7 -63.0 -27.3 15.3 11.7 47.9 151 158 A R H 3< S+ 0 0 116 -4,-1.5 266,-0.6 1,-0.2 -2,-0.2 0.750 113.9 38.1 -72.4 -22.1 12.7 11.1 45.3 152 159 A L H << S+ 0 0 26 -3,-1.0 266,-0.3 -4,-0.9 -1,-0.2 0.815 135.6 16.1 -95.3 -36.9 13.7 14.3 43.5 153 160 A I H < S- 0 0 12 -4,-2.3 4,-0.4 1,-0.2 -2,-0.2 0.385 111.9-100.6-118.4 1.3 17.5 14.3 43.9 154 161 A G X - 0 0 28 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.058 34.3 -83.9 91.1 154.9 18.3 10.7 44.9 155 162 A A H > S+ 0 0 46 520,-0.5 4,-2.7 1,-0.2 5,-0.2 0.852 121.4 56.8 -61.0 -41.3 19.0 9.0 48.3 156 163 A S H > S+ 0 0 9 519,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.936 112.8 36.6 -62.3 -49.6 22.7 9.9 48.3 157 164 A R H > S+ 0 0 54 -4,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.838 116.8 54.1 -74.6 -31.1 22.4 13.7 47.9 158 165 A A H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.935 108.8 49.2 -60.8 -47.3 19.3 13.8 50.1 159 166 A T H X S+ 0 0 19 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.933 110.3 51.1 -58.7 -49.1 21.2 12.0 52.8 160 167 A A H X>S+ 0 0 11 -4,-2.0 4,-2.9 1,-0.2 5,-0.8 0.919 109.1 50.0 -54.6 -48.0 24.1 14.5 52.5 161 168 A M H X5S+ 0 0 5 -4,-2.3 4,-0.9 1,-0.2 -29,-0.3 0.890 115.2 44.3 -60.6 -39.5 21.8 17.5 52.8 162 169 A F H <5S+ 0 0 0 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.900 121.7 36.7 -70.7 -45.2 20.2 15.9 56.0 163 170 A L H <5S+ 0 0 6 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.910 126.3 35.1 -77.0 -46.3 23.5 14.9 57.6 164 171 A L H <5S- 0 0 48 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.836 91.8-151.8 -78.4 -33.0 25.8 17.7 56.6 165 172 A G << + 0 0 34 -4,-0.9 2,-0.3 -5,-0.8 -32,-0.2 0.607 38.3 148.0 77.3 12.9 22.9 20.2 56.9 166 173 A D - 0 0 90 -6,-0.3 -1,-0.2 1,-0.1 -34,-0.2 -0.639 47.2-121.4 -89.0 138.5 24.3 22.7 54.3 167 174 A T - 0 0 78 -2,-0.3 2,-0.3 -36,-0.1 -36,-0.2 -0.356 24.1-146.5 -59.9 145.4 22.1 24.8 52.1 168 175 A I E -I 130 0C 20 -38,-2.4 -38,-2.6 -2,-0.1 2,-0.1 -0.888 14.9-120.4-113.8 158.4 22.5 24.4 48.3 169 176 A D E > -I 129 0C 81 -2,-0.3 4,-2.4 -40,-0.2 -40,-0.2 -0.353 29.9 -96.4 -94.4 173.7 22.1 27.2 45.8 170 177 A A H > S+ 0 0 0 -42,-0.8 4,-2.6 -44,-0.5 5,-0.2 0.899 119.6 49.2 -60.5 -47.0 19.7 27.5 42.8 171 178 A P H > S+ 0 0 73 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.892 112.6 48.5 -61.3 -39.9 22.1 26.2 40.0 172 179 A T H > S+ 0 0 43 2,-0.2 4,-2.6 1,-0.2 6,-0.2 0.927 111.2 51.3 -62.2 -42.5 23.1 23.2 42.1 173 180 A A H X>S+ 0 0 0 -4,-2.4 5,-2.5 2,-0.2 6,-1.0 0.908 110.8 48.4 -60.6 -43.5 19.3 22.6 42.7 174 181 A H H ><5S+ 0 0 80 -4,-2.6 3,-0.9 4,-0.2 -2,-0.2 0.947 113.4 46.4 -59.1 -50.3 18.7 22.8 39.0 175 182 A T H 3<5S+ 0 0 95 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.857 113.2 50.0 -63.0 -35.1 21.5 20.4 38.2 176 183 A W H 3<5S- 0 0 60 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.603 116.8-111.1 -80.3 -13.1 20.4 18.0 40.9 177 184 A G T <<5S+ 0 0 6 -3,-0.9 -3,-0.2 -4,-0.9 241,-0.2 0.561 83.4 121.9 92.9 11.2 16.8 17.9 39.7 178 185 A L S - 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0 0 31 -4,-2.2 4,-1.9 -5,-0.4 -1,-0.2 -0.014 36.1 -76.8 90.8 163.2 14.0 11.3 37.4 417 162 B A H > S+ 0 0 37 -266,-0.6 4,-2.0 1,-0.2 5,-0.2 0.829 121.8 54.5 -70.2 -36.5 10.6 12.6 38.5 418 163 B S H > S+ 0 0 5 -266,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.972 113.7 38.4 -61.8 -56.4 11.3 16.4 37.8 419 164 B R H > S+ 0 0 53 -4,-0.4 4,-2.6 1,-0.2 -2,-0.2 0.893 116.3 51.7 -66.4 -39.5 12.4 16.1 34.2 420 165 B A H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.894 109.3 51.6 -63.0 -39.5 9.9 13.4 33.4 421 166 B T H X S+ 0 0 22 -4,-2.0 4,-2.9 2,-0.2 5,-0.3 0.901 110.5 47.6 -65.6 -41.0 7.1 15.6 34.8 422 167 B A H X>S+ 0 0 7 -4,-2.1 4,-2.8 2,-0.2 6,-0.8 0.937 111.2 51.4 -64.5 -45.1 8.2 18.6 32.7 423 168 B M H X5S+ 0 0 0 -4,-2.6 4,-0.9 4,-0.2 -29,-0.2 0.928 117.3 38.7 -56.9 -47.2 8.4 16.5 29.6 424 169 B F H <5S+ 0 0 0 -4,-2.4 -27,-0.3 -5,-0.2 -2,-0.2 0.934 125.5 35.3 -69.5 -48.5 4.8 15.1 30.1 425 170 B L H <5S+ 0 0 6 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.866 128.6 30.6 -79.7 -39.0 3.2 18.3 31.4 426 171 B L H <5S- 0 0 52 -4,-2.8 -3,-0.2 -5,-0.3 -1,-0.2 0.575 98.3-124.5 -98.1 -10.2 5.0 21.0 29.4 427 172 B G << + 0 0 38 -4,-0.9 2,-0.2 -5,-0.6 -4,-0.2 0.716 41.8 178.8 73.4 22.3 5.7 19.0 26.2 428 173 B D - 0 0 72 -6,-0.8 2,-0.5 -35,-0.0 -34,-0.3 -0.396 13.7-155.9 -60.1 121.3 9.4 19.7 26.4 429 174 B T - 0 0 99 -2,-0.2 2,-0.3 -36,-0.1 -36,-0.2 -0.882 11.0-155.1 -99.9 131.9 11.2 18.0 23.5 430 175 B I E -R 392 0F 12 -38,-2.6 -38,-2.7 -2,-0.5 2,-0.1 -0.789 5.0-136.6-113.5 153.5 14.9 17.2 24.1 431 176 B D E > -R 391 0F 81 -2,-0.3 4,-2.6 -40,-0.2 5,-0.2 -0.397 38.5 -89.2 -97.9 177.2 17.8 16.7 21.7 432 177 B A H > S+ 0 0 0 -42,-0.8 4,-2.5 -44,-0.5 5,-0.2 0.884 121.7 48.1 -60.4 -46.9 20.6 14.1 21.9 433 178 B P H > S+ 0 0 73 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.903 113.9 47.5 -65.0 -38.1 23.1 16.0 24.1 434 179 B T H > S+ 0 0 47 2,-0.2 4,-2.8 1,-0.2 6,-0.2 0.939 112.3 51.1 -60.2 -46.4 20.4 16.9 26.6 435 180 B A H X>S+ 0 0 0 -4,-2.6 5,-2.4 2,-0.2 6,-1.1 0.872 110.9 49.2 -56.9 -40.9 19.3 13.3 26.5 436 181 B H H ><5S+ 0 0 77 -4,-2.5 3,-1.0 4,-0.2 -2,-0.2 0.959 111.8 46.3 -64.7 -52.0 22.9 12.2 27.2 437 182 B T H 3<5S+ 0 0 102 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.903 113.8 49.9 -57.3 -41.1 23.4 14.5 30.1 438 183 B W H 3<5S- 0 0 56 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.612 114.9-115.8 -73.8 -14.5 20.0 13.5 31.6 439 184 B G T <<5S+ 0 0 6 -3,-1.0 -3,-0.2 -4,-0.8 -4,-0.1 0.638 78.7 127.1 85.1 17.2 20.8 9.7 31.3 440 185 B L S - 0 0 115 -2,-0.2 3,-2.1 -59,-0.2 -1,-0.1 -0.344 65.5 -97.8 -56.1 138.9 27.3 10.7 14.5 447 192 B E T 3 S+ 0 0 30 1,-0.3 -1,-0.1 -60,-0.2 -80,-0.1 -0.392 115.6 32.7 -62.2 136.9 23.8 10.5 12.9 448 193 B G T 3 S+ 0 0 64 -3,-0.1 -1,-0.3 -130,-0.1 4,-0.1 0.495 106.4 76.3 84.2 0.4 23.9 7.5 10.6 449 194 B S <> + 0 0 41 -3,-2.1 4,-2.8 2,-0.1 5,-0.3 0.464 65.0 90.5-104.7 -8.6 26.2 5.6 12.9 450 195 B P H > S+ 0 0 5 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.897 90.0 44.9 -62.2 -42.1 23.8 4.5 15.7 451 196 B A H > S+ 0 0 37 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.900 113.4 51.9 -62.9 -41.2 22.8 1.2 14.1 452 197 B D H > S+ 0 0 101 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.950 114.7 41.7 -58.9 -48.8 26.5 0.5 13.3 453 198 B V H X S+ 0 0 41 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.922 113.7 52.3 -67.3 -43.3 27.5 1.2 16.9 454 199 B A H X S+ 0 0 0 -4,-3.0 4,-3.2 -5,-0.3 -1,-0.2 0.900 109.0 50.9 -57.4 -43.5 24.5 -0.7 18.3 455 200 B N H X S+ 0 0 76 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.877 110.8 48.5 -61.8 -39.7 25.3 -3.7 16.2 456 201 B S H X S+ 0 0 86 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.928 113.9 46.0 -66.2 -45.6 28.9 -3.7 17.5 457 202 B V H X S+ 0 0 32 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.944 114.3 47.8 -61.1 -49.8 27.7 -3.4 21.1 458 203 B A H X S+ 0 0 0 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.867 110.9 52.4 -58.5 -40.1 25.1 -6.1 20.6 459 204 B G H X S+ 0 0 31 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.909 109.9 47.7 -63.0 -43.6 27.8 -8.3 19.0 460 205 B R H < S+ 0 0 75 -4,-2.3 3,-0.2 1,-0.2 -2,-0.2 0.916 113.5 47.8 -64.4 -44.2 30.2 -7.9 21.9 461 206 B L H >< S+ 0 0 6 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.861 107.5 57.0 -62.6 -36.9 27.4 -8.7 24.4 462 207 B A H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.830 105.8 49.8 -66.1 -31.5 26.4 -11.7 22.3 463 208 B G T 3< S+ 0 0 44 -4,-1.4 56,-0.7 -3,-0.2 -1,-0.3 0.391 102.8 89.1 -84.5 2.6 29.9 -13.2 22.7 464 209 B G S < S- 0 0 7 -3,-1.2 2,-2.1 -4,-0.2 3,-0.1 -0.173 102.3 -64.5 -92.6-174.3 29.8 -12.6 26.4 465 210 B P >> - 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0 0 111 -2,-0.2 3,-1.6 -59,-0.2 -1,-0.1 -0.296 63.7 -94.7 -58.4 146.5 43.6 14.7 45.8 709 192 C E T 3 S+ 0 0 70 1,-0.2 -1,-0.1 -60,-0.2 -80,-0.1 -0.384 115.4 31.0 -63.6 142.5 44.8 11.1 46.0 710 193 C G T 3 S+ 0 0 61 -3,-0.1 4,-0.3 -130,-0.1 3,-0.3 -0.021 107.5 77.5 91.9 -29.0 46.3 10.4 49.5 711 194 C S <> + 0 0 43 -3,-1.6 4,-2.3 1,-0.2 5,-0.3 0.599 61.4 91.8 -85.4 -14.4 43.8 12.9 51.0 712 195 C P H > S+ 0 0 4 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.874 89.2 49.3 -52.3 -40.1 40.6 10.8 51.0 713 196 C A H > S+ 0 0 37 -3,-0.3 4,-2.7 2,-0.2 5,-0.2 0.919 110.8 48.4 -61.6 -47.8 41.3 9.5 54.5 714 197 C D H > S+ 0 0 108 -4,-0.3 4,-1.9 -3,-0.2 -1,-0.2 0.898 115.9 43.1 -64.5 -42.8 42.0 13.0 56.0 715 198 C V H X S+ 0 0 47 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.909 113.5 51.7 -70.0 -42.2 38.9 14.5 54.5 716 199 C A H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.3 -2,-0.2 0.900 109.7 51.3 -59.0 -41.5 36.8 11.5 55.5 717 200 C N H X S+ 0 0 78 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.878 108.7 49.5 -64.1 -42.1 38.2 11.8 59.1 718 201 C S H X S+ 0 0 84 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.943 113.3 47.6 -58.4 -48.0 37.2 15.5 59.3 719 202 C V H X S+ 0 0 26 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.906 112.4 47.7 -63.7 -44.5 33.7 14.7 58.0 720 203 C A H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.915 112.2 51.2 -60.2 -43.7 33.3 11.8 60.5 721 204 C G H X S+ 0 0 34 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.903 110.9 47.9 -60.0 -43.9 34.5 14.1 63.3 722 205 C R H >< S+ 0 0 135 -4,-2.6 3,-0.6 1,-0.2 4,-0.3 0.932 114.8 45.2 -61.3 -47.5 32.0 16.7 62.3 723 206 C L H >< S+ 0 0 2 -4,-2.7 3,-1.1 1,-0.2 -2,-0.2 0.832 107.6 58.1 -67.3 -34.1 29.2 14.2 62.1 724 207 C A H 3< S+ 0 0 1 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.742 105.3 51.5 -67.1 -24.2 30.3 12.6 65.4 725 208 C G T << S+ 0 0 40 -4,-1.0 56,-0.7 -3,-0.6 -1,-0.2 0.468 99.7 89.1 -88.5 -4.0 29.9 16.0 67.1 726 209 C G S < S- 0 0 8 -3,-1.1 2,-1.9 -4,-0.3 3,-0.1 -0.126 101.7 -64.6 -86.8-175.0 26.3 16.4 65.7 727 210 C P >> - 0 0 5 0, 0.0 4,-2.5 0, 0.0 3,-0.5 -0.477 53.7-176.4 -74.8 83.6 22.9 15.4 67.0 728 211 C T H 3> S+ 0 0 12 -2,-1.9 4,-2.3 1,-0.3 5,-0.2 0.804 78.0 52.3 -55.8 -40.1 23.4 11.7 66.9 729 212 C A H 3> S+ 0 0 32 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.915 112.4 47.0 -63.9 -39.8 19.9 10.7 68.0 730 213 C A H <> S+ 0 0 1 -3,-0.5 4,-2.8 2,-0.2 5,-0.3 0.910 110.4 52.3 -65.9 -43.2 18.5 12.9 65.2 731 214 C F H X S+ 0 0 9 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.909 110.4 48.0 -59.1 -45.5 20.9 11.5 62.6 732 215 C S H X S+ 0 0 30 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.874 113.7 48.4 -61.2 -40.5 19.8 7.9 63.5 733 216 C E H X S+ 0 0 38 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.943 113.1 44.9 -65.0 -49.7 16.2 8.9 63.3 734 217 C V H X S+ 0 0 0 -4,-2.8 4,-3.1 1,-0.2 5,-0.2 0.877 110.1 54.8 -68.7 -36.1 16.4 10.6 59.9 735 218 C K H X S+ 0 0 9 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.914 110.9 46.3 -60.1 -41.5 18.5 7.8 58.4 736 219 C E H X S+ 0 0 93 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.888 112.1 51.4 -68.6 -38.8 15.8 5.3 59.4 737 220 C L H X S+ 0 0 6 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.950 108.8 50.5 -61.8 -49.8 13.1 7.7 58.0 738 221 C L H X S+ 0 0 18 -4,-3.1 4,-0.6 1,-0.2 -2,-0.2 0.914 114.8 44.4 -54.4 -45.5 14.9 8.0 54.6 739 222 C R H < S+ 0 0 93 -4,-2.0 3,-0.4 -5,-0.2 4,-0.2 0.911 118.6 41.2 -65.7 -44.5 15.2 4.2 54.4 740 223 C R H < S+ 0 0 124 -4,-2.7 3,-0.3 1,-0.2 -2,-0.2 0.780 117.1 47.1 -76.4 -28.0 11.6 3.4 55.4 741 224 C N H >< S+ 0 0 0 -4,-2.7 3,-0.7 -5,-0.2 -1,-0.2 0.438 75.7 105.3 -97.4 1.7 10.0 6.2 53.4 742 225 C A T 3< S+ 0 0 47 -4,-0.6 -1,-0.2 -3,-0.4 -2,-0.1 0.866 105.5 5.0 -52.3 -45.9 11.7 5.7 50.1 743 226 C V T 3 S+ 0 0 76 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.104 100.7 129.5-125.5 23.3 8.6 4.2 48.4 744 227 C A < - 0 0 13 -3,-0.7 -3,-0.1 1,-0.1 5,-0.0 -0.426 65.4 -97.8 -82.5 150.9 6.0 4.4 51.2 745 228 C P >> - 0 0 88 0, 0.0 4,-2.1 0, 0.0 3,-0.6 -0.317 39.9-110.0 -57.8 149.7 2.5 5.8 50.8 746 229 C L H 3> S+ 0 0 41 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.853 115.7 57.8 -53.8 -42.8 2.2 9.5 52.0 747 230 C G H 3> S+ 0 0 37 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.882 109.4 44.8 -59.5 -40.8 0.1 8.6 55.1 748 231 C D H <> S+ 0 0 72 -3,-0.6 4,-2.3 2,-0.2 5,-0.2 0.897 111.4 53.7 -67.8 -41.6 2.8 6.3 56.3 749 232 C V H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.946 112.5 44.2 -55.2 -49.3 5.5 8.8 55.5 750 233 C L H X S+ 0 0 3 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.860 112.5 50.5 -69.5 -38.8 3.7 11.5 57.5 751 234 C E H X S+ 0 0 95 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.922 112.4 47.2 -62.4 -46.8 2.9 9.3 60.5 752 235 C R H X S+ 0 0 54 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.886 112.2 50.5 -64.6 -40.3 6.5 8.1 60.8 753 236 C E H X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.2 -612,-0.2 0.945 109.0 51.3 -61.7 -48.1 7.8 11.7 60.6 754 237 C A H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.905 112.3 46.4 -54.8 -46.2 5.4 12.9 63.3 755 238 C S H X S+ 0 0 28 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.882 112.4 49.6 -65.2 -42.6 6.5 10.1 65.7 756 239 C A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.912 111.6 48.3 -63.9 -45.4 10.2 10.7 65.0 757 240 C Q H X S+ 0 0 0 -4,-2.6 4,-2.6 -616,-0.3 -2,-0.2 0.918 110.7 51.8 -60.9 -43.2 9.9 14.4 65.6 758 241 C Q H X S+ 0 0 37 -4,-2.2 4,-0.8 -5,-0.2 -2,-0.2 0.924 109.4 49.3 -63.8 -43.8 8.0 13.9 68.8 759 242 C R H >< S+ 0 0 139 -4,-2.3 3,-0.9 1,-0.2 -1,-0.2 0.945 116.1 43.3 -56.0 -47.5 10.7 11.5 70.2 760 243 C L H >< S+ 0 0 4 -4,-2.2 3,-1.8 1,-0.2 6,-0.4 0.793 99.6 70.0 -72.8 -29.0 13.4 14.1 69.3 761 244 C G H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.752 102.8 47.2 -57.9 -24.5 11.4 17.0 70.7 762 245 C A T << S+ 0 0 63 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.421 90.8 110.1 -94.3 -3.2 12.1 15.5 74.1 763 246 C S S <> S- 0 0 11 -3,-1.8 4,-1.2 -625,-0.1 5,-0.1 -0.337 74.0-126.9 -70.9 155.9 15.8 15.0 73.4 764 247 C R H > S+ 0 0 56 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.874 108.5 59.2 -66.3 -39.9 18.5 17.1 75.3 765 248 C D H > S+ 0 0 4 19,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.851 102.9 51.9 -59.1 -36.3 20.1 18.0 71.9 766 249 C H H > S+ 0 0 0 -6,-0.4 4,-2.1 -628,-0.2 -1,-0.2 0.906 110.5 46.4 -71.1 -42.1 16.9 19.6 70.7 767 250 C S H X S+ 0 0 44 -4,-1.2 4,-2.3 2,-0.2 5,-0.2 0.945 113.1 50.3 -62.0 -47.2 16.5 21.8 73.7 768 251 C A H X S+ 0 0 30 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.894 111.5 48.8 -56.3 -40.9 20.2 22.8 73.6 769 252 C A H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.2 -1,-0.2 0.869 108.1 53.7 -69.8 -35.6 19.7 23.7 69.9 770 253 C V H X S+ 0 0 7 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.940 111.9 43.7 -65.6 -46.5 16.6 25.8 70.5 771 254 C E H X S+ 0 0 125 -4,-2.3 4,-1.1 2,-0.2 -2,-0.2 0.870 113.3 52.3 -69.3 -32.4 18.4 27.9 73.2 772 255 C A H ><>S+ 0 0 15 -4,-2.2 5,-3.4 -5,-0.2 3,-0.5 0.928 108.8 50.6 -61.9 -45.6 21.4 28.2 70.9 773 256 C F H ><5S+ 0 0 79 -4,-2.7 3,-1.3 3,-0.3 -2,-0.2 0.844 103.3 58.8 -60.5 -37.3 19.2 29.4 68.0 774 257 C L H 3<5S+ 0 0 82 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.841 112.5 40.0 -61.4 -33.0 17.6 32.0 70.3 775 258 C A T <<5S- 0 0 63 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.308 118.1-115.5 -93.1 6.8 21.1 33.4 70.8 776 259 C K T < 5S+ 0 0 195 -3,-1.3 -3,-0.3 1,-0.2 2,-0.2 0.822 71.0 138.3 56.5 35.1 21.9 32.8 67.1 777 260 C D < - 0 0 103 -5,-3.4 -1,-0.2 -6,-0.1 -2,-0.1 -0.661 62.4-112.0 -98.4 161.0 24.6 30.3 68.1 778 261 C K - 0 0 91 -2,-0.2 2,-0.0 -3,-0.1 -642,-0.0 -0.800 48.0-116.8 -82.3 133.6 25.5 26.9 66.6 779 262 C P - 0 0 26 0, 0.0 2,-0.5 0, 0.0 -10,-0.1 -0.323 9.3-127.0 -73.7 156.1 24.5 24.4 69.2 780 263 C V - 0 0 124 -12,-0.1 2,-0.4 -15,-0.0 -54,-0.1 -0.929 31.8-158.2 -97.9 124.1 26.8 21.9 71.1 781 264 C F - 0 0 29 -56,-0.7 -16,-0.0 -2,-0.5 -15,-0.0 -0.827 25.5-179.8-109.0 140.3 25.4 18.4 70.7 782 265 C V - 0 0 60 -2,-0.4 -1,-0.1 2,-0.3 -56,-0.1 0.514 53.9-105.9-112.4 -11.4 26.0 15.3 72.9 783 266 C G 0 0 20 1,-0.4 -57,-0.1 -58,-0.1 -2,-0.0 0.693 360.0 360.0 96.6 23.0 23.9 12.8 71.0 784 267 C R 0 0 188 -56,-0.1 -19,-2.8 -55,-0.1 -1,-0.4 -0.917 360.0 360.0-154.6 360.0 20.8 12.3 73.2