==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE, ISOMERASE 06-JAN-10 3LAO . COMPND 2 MOLECULE: ENOYL-COA HYDRATASE/ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR Y.KIM,G.CHHOR,K.BUCK,A.JOACHIMIAK,MIDWEST CENTER FOR . 675 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25708.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 467 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 84 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 4 0.6 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 . 39 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 193 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.2 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 5 0 5 3 3 1 0 2 0 1 4 0 3 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 . 2 1 2 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 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 2 A S 0 0 161 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 151.5 56.8 52.2 100.0 2 3 A E + 0 0 186 2,-0.0 24,-0.1 0, 0.0 2,-0.1 0.448 360.0 107.7-124.9 -23.3 53.5 53.4 98.6 3 4 A A S S- 0 0 51 23,-0.1 2,-0.7 1,-0.1 21,-0.1 -0.394 72.1-129.9 -53.1 126.8 52.8 50.4 96.3 4 5 A N + 0 0 17 1,-0.1 23,-1.0 -2,-0.1 24,-0.6 -0.739 32.8 172.2 -90.0 116.0 50.0 48.4 97.9 5 6 A S + 0 0 65 -2,-0.7 -1,-0.1 22,-0.2 3,-0.1 0.309 58.2 83.3-103.0 6.5 50.8 44.6 98.2 6 7 A G S S- 0 0 25 1,-0.3 3,-0.1 3,-0.0 22,-0.1 -0.073 98.8 -35.4 -91.9-159.9 47.7 44.0 100.3 7 8 A P S S- 0 0 93 0, 0.0 -1,-0.3 0, 0.0 -2,-0.0 -0.275 78.4 -97.8 -58.3 145.7 44.2 43.3 99.2 8 9 A G + 0 0 5 23,-0.1 2,-0.3 -3,-0.1 17,-0.1 -0.156 50.0 158.3 -66.5 159.3 43.2 45.3 96.2 9 10 A R - 0 0 113 15,-0.1 15,-2.6 -3,-0.1 2,-0.4 -0.933 30.6-120.9-166.7 177.9 41.3 48.6 96.2 10 11 A V E -A 23 0A 8 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.979 18.1-129.7-135.6 136.9 40.7 51.7 94.1 11 12 A T E -A 22 0A 48 11,-2.7 11,-1.6 -2,-0.4 2,-0.4 -0.686 18.9-156.0 -85.2 152.7 41.4 55.4 94.7 12 13 A R E +A 21 0A 85 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.995 16.8 167.9-131.0 128.4 38.7 58.0 94.1 13 14 A E E -A 20 0A 96 7,-1.7 7,-3.2 -2,-0.4 2,-0.6 -0.972 23.3-149.1-142.3 122.2 39.3 61.7 93.3 14 15 A Q E -A 19 0A 78 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.861 16.7-179.6 -84.8 119.0 36.7 64.3 92.1 15 16 A R E > -A 18 0A 107 3,-2.8 3,-2.0 -2,-0.6 2,-0.5 -0.790 59.9 -71.8-118.3 85.8 38.5 66.9 90.0 16 17 A G T 3 S- 0 0 53 -2,-0.4 -1,-0.1 1,-0.3 36,-0.0 -0.548 118.1 -8.6 66.7-119.4 35.8 69.3 88.9 17 18 A H T 3 S+ 0 0 70 -2,-0.5 37,-3.6 36,-0.1 38,-1.3 0.413 122.2 90.1 -91.9 2.3 33.7 67.5 86.4 18 19 A L E < -Ab 15 55A 5 -3,-2.0 -3,-2.8 35,-0.2 2,-0.5 -0.771 59.5-157.5-102.5 142.9 36.1 64.6 86.2 19 20 A F E -Ab 14 56A 13 36,-2.1 38,-2.9 -2,-0.3 2,-0.4 -0.973 14.8-157.2-121.9 110.0 35.9 61.5 88.4 20 21 A L E -Ab 13 57A 3 -7,-3.2 -7,-1.7 -2,-0.5 2,-0.5 -0.776 8.7-171.6 -95.2 131.4 39.3 59.7 88.6 21 22 A I E -Ab 12 58A 0 36,-3.4 38,-2.4 -2,-0.4 2,-0.5 -0.964 5.4-167.8-127.1 113.6 39.5 56.0 89.5 22 23 A G E -Ab 11 59A 0 -11,-1.6 -11,-2.7 -2,-0.5 2,-0.4 -0.885 23.8-128.3-107.3 124.8 42.9 54.5 90.1 23 24 A L E -Ab 10 60A 0 36,-3.0 38,-2.7 -2,-0.5 2,-0.5 -0.561 29.5-163.8 -66.0 121.3 43.6 50.8 90.4 24 25 A D + 0 0 20 -15,-2.6 -15,-0.1 -2,-0.4 -1,-0.1 -0.537 56.9 88.5-117.1 65.2 45.6 50.6 93.7 25 26 A R > > + 0 0 15 -2,-0.5 5,-2.3 36,-0.3 3,-2.2 -0.214 37.5 149.5-149.5 49.7 47.4 47.4 94.1 26 27 A A G > 5 + 0 0 22 1,-0.3 3,-2.0 3,-0.2 37,-0.2 0.766 64.8 68.2 -63.7 -29.9 50.7 48.1 92.5 27 28 A G G 3 5S+ 0 0 34 -23,-1.0 -1,-0.3 1,-0.3 -22,-0.2 0.653 109.4 39.5 -64.2 -16.0 52.7 45.7 94.7 28 29 A K G X 5S- 0 0 98 -3,-2.2 3,-1.7 -24,-0.6 -1,-0.3 0.028 119.7-108.6-116.4 26.9 50.8 42.9 92.9 29 30 A R T < 5S- 0 0 134 -3,-2.0 38,-1.5 1,-0.3 -3,-0.2 0.818 70.2 -69.0 43.4 36.8 50.9 44.5 89.5 30 31 A N T 3 - 0 0 4 -2,-0.7 4,-2.6 36,-0.2 5,-0.2 -0.457 51.3 -89.7 -97.3 179.5 41.2 40.0 93.7 34 35 A S H > S+ 0 0 23 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.808 125.9 56.7 -62.1 -29.9 37.6 40.1 94.9 35 36 A A H > S+ 0 0 36 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.926 110.5 42.3 -68.0 -46.3 38.3 43.3 96.9 36 37 A X H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.859 112.6 52.6 -75.1 -31.1 39.4 45.2 93.9 37 38 A L H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.957 113.6 45.0 -65.4 -44.7 36.7 43.9 91.7 38 39 A A H X S+ 0 0 32 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.938 115.2 47.1 -58.6 -48.4 34.1 45.0 94.3 39 40 A D H X S+ 0 0 36 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.907 110.8 50.6 -65.6 -39.4 35.7 48.4 94.9 40 41 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.901 111.6 48.6 -63.5 -39.6 36.1 49.1 91.1 41 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 -5,-0.2 49,-1.4 0.951 112.1 48.9 -67.2 -45.2 32.4 48.3 90.5 42 43 A L H X S+ 0 0 54 -4,-2.5 4,-2.7 47,-0.2 -2,-0.2 0.894 109.8 50.8 -58.0 -46.1 31.3 50.5 93.5 43 44 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.913 109.8 51.1 -61.8 -41.4 33.4 53.4 92.3 44 45 A X H X S+ 0 0 3 -4,-2.1 4,-1.8 46,-0.2 -2,-0.2 0.870 110.3 50.4 -57.3 -41.8 31.8 53.0 88.8 45 46 A G H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.927 108.2 51.0 -62.5 -44.2 28.4 53.1 90.5 46 47 A E H X S+ 0 0 62 -4,-2.7 4,-0.8 1,-0.2 -2,-0.2 0.872 109.1 52.7 -63.2 -34.3 29.4 56.2 92.5 47 48 A Y H < S+ 0 0 1 -4,-1.9 3,-0.4 1,-0.2 -1,-0.2 0.894 106.5 53.0 -65.5 -41.9 30.4 57.8 89.2 48 49 A E H < S+ 0 0 45 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.888 114.0 40.4 -62.9 -41.3 27.1 57.0 87.6 49 50 A R H < S+ 0 0 146 -4,-1.8 2,-0.7 -5,-0.1 -1,-0.2 0.531 89.4 104.2 -90.7 -5.8 25.0 58.6 90.4 50 51 A S >< - 0 0 26 -4,-0.8 3,-0.6 -3,-0.4 -31,-0.0 -0.694 54.4-164.8 -79.9 110.5 27.4 61.7 90.8 51 52 A E T 3 S+ 0 0 184 -2,-0.7 -1,-0.2 1,-0.3 -4,-0.0 0.804 86.8 50.7 -72.2 -30.3 25.5 64.6 89.1 52 53 A E T 3 S+ 0 0 138 -3,-0.1 2,-0.5 -34,-0.0 -1,-0.3 0.704 88.4 93.1 -76.0 -24.9 28.6 66.7 88.9 53 54 A S < + 0 0 2 -3,-0.6 -35,-0.2 1,-0.2 -36,-0.1 -0.624 43.3 169.9 -81.0 121.8 30.8 64.0 87.3 54 55 A R + 0 0 80 -37,-3.6 2,-0.3 -2,-0.5 -36,-0.2 0.546 67.3 13.5-104.9 -15.2 30.7 64.4 83.5 55 56 A C E -b 18 0A 0 -38,-1.3 -36,-2.1 47,-0.1 -1,-0.3 -0.929 66.7-142.8-159.5 139.8 33.5 62.0 82.6 56 57 A A E -bc 19 104A 0 47,-1.6 49,-2.2 -2,-0.3 2,-0.4 -0.744 7.1-155.0-102.3 152.1 35.4 59.3 84.4 57 58 A V E -bc 20 105A 0 -38,-2.9 -36,-3.4 -2,-0.3 2,-0.4 -0.986 6.5-162.5-126.7 121.9 39.1 58.5 84.0 58 59 A L E +bc 21 106A 2 47,-3.0 49,-2.5 -2,-0.4 2,-0.3 -0.888 23.8 150.3-100.6 131.1 40.3 55.0 84.9 59 60 A F E -b 22 0A 22 -38,-2.4 -36,-3.0 -2,-0.4 2,-0.4 -0.889 37.2-116.0-149.8 171.9 44.0 54.5 85.4 60 61 A A E -b 23 0A 6 -2,-0.3 2,-0.2 -38,-0.3 -36,-0.2 -0.972 19.0-129.9-121.2 134.5 46.4 52.3 87.4 61 62 A H S S+ 0 0 63 -38,-2.7 3,-0.4 -2,-0.4 -36,-0.3 -0.518 76.4 18.2 -71.1 148.4 48.9 53.3 90.1 62 63 A G S S- 0 0 36 1,-0.2 -2,-0.1 -2,-0.2 -35,-0.0 -0.432 111.5 -52.0 89.3-161.7 52.4 52.0 89.5 63 64 A E S S+ 0 0 149 -37,-0.2 2,-0.4 -2,-0.1 48,-0.2 0.436 114.5 61.9 -95.0 -3.0 54.1 50.7 86.4 64 65 A H - 0 0 41 -3,-0.4 46,-0.2 46,-0.2 3,-0.2 -0.984 58.2-156.5-136.8 130.0 51.5 48.2 85.3 65 66 A F S S- 0 0 0 44,-2.6 2,-0.3 46,-0.5 47,-0.2 0.970 79.4 -30.6 -65.3 -55.1 47.9 48.5 84.4 66 67 A T B -g 112 0C 0 45,-2.8 47,-2.3 43,-0.2 -36,-0.2 -0.884 33.3-156.0-168.2 138.3 47.0 44.9 85.3 67 68 A A - 0 0 34 -38,-1.5 2,-0.2 1,-0.3 -36,-0.2 0.156 63.8-105.8 -99.3 18.3 48.6 41.4 85.4 68 69 A G - 0 0 1 -38,-0.3 -36,-2.6 45,-0.3 -1,-0.3 -0.624 64.5 -13.1 100.8-153.0 45.1 39.9 85.2 69 70 A L B -f 32 0B 20 -38,-0.3 2,-1.2 -2,-0.2 -36,-0.2 -0.597 51.6-129.7 -87.5 147.6 43.0 38.1 87.7 70 71 A D >> + 0 0 38 -38,-2.5 4,-2.6 -2,-0.2 3,-1.0 -0.683 36.8 173.5 -86.3 75.1 44.2 36.9 91.2 71 72 A L H 3> S+ 0 0 77 -2,-1.2 4,-2.2 1,-0.3 -1,-0.2 0.707 70.1 61.6 -59.6 -25.0 42.7 33.5 90.5 72 73 A X H 34 S+ 0 0 175 2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.831 114.3 33.9 -72.2 -35.1 44.3 32.1 93.7 73 74 A E H <4 S+ 0 0 50 -3,-1.0 4,-0.4 2,-0.1 -2,-0.2 0.800 120.9 50.1 -85.1 -35.3 42.3 34.5 95.9 74 75 A L H >< S+ 0 0 2 -4,-2.6 3,-2.2 1,-0.2 4,-0.4 0.928 94.1 70.4 -69.7 -48.5 39.2 34.6 93.6 75 76 A A G >< S+ 0 0 59 -4,-2.2 3,-1.6 1,-0.3 -1,-0.2 0.831 98.2 47.8 -39.7 -56.6 38.6 30.8 93.2 76 77 A P G 3 S+ 0 0 105 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.743 111.9 53.8 -58.4 -25.4 37.4 30.1 96.8 77 78 A K G < S+ 0 0 137 -3,-2.2 2,-0.4 -4,-0.4 -2,-0.2 0.312 82.3 96.6-101.4 4.9 35.1 33.1 96.7 78 79 A L < - 0 0 53 -3,-1.6 2,-0.2 -4,-0.4 5,-0.2 -0.792 67.6-135.5 -91.8 140.9 33.0 32.5 93.6 79 80 A A B > -J 82 0D 48 3,-1.3 3,-2.7 -2,-0.4 -2,-0.1 -0.533 31.1-103.0 -82.9 160.2 29.6 30.8 94.1 80 81 A A T 3 S+ 0 0 119 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 0.880 124.9 58.3 -49.2 -36.2 28.6 28.0 91.8 81 82 A S T 3 S- 0 0 95 1,-0.2 -1,-0.3 3,-0.0 2,-0.2 0.487 117.3-104.0 -75.5 -5.8 26.4 30.6 90.1 82 83 A G B < -J 79 0D 32 -3,-2.7 -3,-1.3 2,-0.1 2,-0.4 -0.608 52.1 -34.3 117.3-176.9 29.4 33.0 89.2 83 84 A F - 0 0 43 62,-0.4 2,-0.5 -2,-0.2 -5,-0.1 -0.719 55.8-157.2 -82.2 133.3 31.0 36.3 90.4 84 85 A R - 0 0 171 -2,-0.4 3,-0.1 3,-0.0 -2,-0.1 -0.945 8.5-135.7-119.5 129.4 28.5 38.8 91.7 85 86 A Y - 0 0 41 -2,-0.5 3,-0.1 1,-0.1 -47,-0.1 -0.462 35.9 -94.2 -81.6 152.6 29.1 42.6 91.8 86 87 A P > - 0 0 38 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 -0.266 46.7 -94.1 -63.7 146.4 28.1 44.5 94.9 87 88 A D T 3 S+ 0 0 162 1,-0.3 3,-0.1 -3,-0.1 -3,-0.0 -0.392 118.1 32.4 -52.7 135.8 24.7 46.1 95.0 88 89 A G T 3 S+ 0 0 41 1,-0.4 -1,-0.3 -3,-0.1 2,-0.1 0.246 99.4 119.3 95.4 -11.8 25.2 49.7 93.9 89 90 A G < - 0 0 9 -3,-2.3 2,-0.4 -44,-0.1 -1,-0.4 -0.290 55.3-144.6 -79.8 163.8 28.0 48.6 91.6 90 91 A V - 0 0 8 -49,-1.4 -46,-0.2 -50,-0.1 -45,-0.2 -0.994 33.7-105.3-125.0 138.9 28.3 48.9 87.8 91 92 A D > - 0 0 9 7,-0.7 3,-1.3 5,-0.5 9,-0.2 -0.494 23.6-154.7 -65.0 116.0 30.1 46.1 85.9 92 93 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.2 0, 0.0 30,-0.1 0.664 94.7 52.4 -68.5 -15.5 33.5 47.5 84.9 93 94 A W T 3 S- 0 0 2 28,-0.0 -2,-0.1 3,-0.0 28,-0.0 0.440 107.3-127.9 -97.7 -7.6 33.6 45.0 82.0 94 95 A G S < S+ 0 0 23 -3,-1.3 3,-0.1 2,-0.1 5,-0.1 0.834 77.7 107.6 70.6 35.7 30.2 46.1 80.7 95 96 A V + 0 0 108 1,-0.1 2,-0.2 3,-0.1 4,-0.1 0.774 66.6 56.7-103.7 -47.5 28.6 42.8 80.5 96 97 A V S S- 0 0 76 2,-0.1 -5,-0.5 1,-0.1 -2,-0.1 -0.634 93.8 -77.9 -94.5 142.7 26.1 42.7 83.3 97 98 A Q S S+ 0 0 163 -2,-0.2 2,-0.1 -7,-0.1 -1,-0.1 -0.531 98.6 66.0 -78.1 153.7 23.3 45.3 83.8 98 99 A P S S- 0 0 84 0, 0.0 -7,-0.7 0, 0.0 2,-0.2 0.462 76.5-152.4 -73.3 146.7 23.1 48.2 84.9 99 100 A R - 0 0 86 -9,-0.1 -2,-0.1 -2,-0.1 -4,-0.0 -0.617 24.1-103.7 -85.0 143.5 25.2 49.6 82.0 100 101 A R - 0 0 12 -2,-0.2 -1,-0.1 -9,-0.2 4,-0.1 -0.302 29.3-165.6 -59.9 153.5 27.2 52.8 82.6 101 102 A S + 0 0 35 2,-0.1 115,-0.2 -3,-0.1 114,-0.1 0.312 63.0 67.6-126.5 10.2 25.4 55.8 81.0 102 103 A K S S- 0 0 5 1,-0.1 -47,-0.1 113,-0.1 -48,-0.1 -0.871 90.6 -84.6-130.6 157.7 28.2 58.3 81.1 103 104 A P - 0 0 1 0, 0.0 -47,-1.6 0, 0.0 2,-0.4 -0.133 35.7-160.8 -67.4 162.6 31.6 58.5 79.3 104 105 A L E -c 56 0A 3 -49,-0.2 20,-2.3 -4,-0.1 21,-1.1 -0.997 6.3-166.0-145.3 133.7 34.8 56.8 80.4 105 106 A V E -cd 57 125A 0 -49,-2.2 -47,-3.0 -2,-0.4 2,-0.4 -0.935 12.6-161.2-117.3 144.2 38.4 57.4 79.5 106 107 A V E -cd 58 126A 0 19,-3.1 21,-2.2 -2,-0.4 2,-0.4 -0.986 10.8-164.1-134.7 139.2 41.2 54.9 80.2 107 108 A A E - d 0 127A 2 -49,-2.5 2,-0.4 -2,-0.4 -47,-0.3 -0.976 15.5-175.8-118.9 128.3 44.9 55.1 80.5 108 109 A V E + d 0 128A 0 19,-2.4 21,-2.0 -2,-0.4 2,-0.3 -0.954 4.7 172.1-129.2 147.5 47.0 51.9 80.4 109 110 A Q - 0 0 18 -2,-0.4 -44,-2.6 2,-0.3 2,-0.6 -0.983 49.0 -7.3-148.6 159.8 50.7 51.2 80.8 110 111 A G S S+ 0 0 21 -2,-0.3 23,-3.1 -46,-0.2 2,-0.4 -0.443 115.6 20.2 65.3-105.4 53.3 48.5 81.2 111 112 A T E + h 0 133C 5 -2,-0.6 -45,-2.8 21,-0.2 -46,-0.5 -0.849 52.3 169.8-105.8 133.2 51.4 45.2 81.5 112 113 A C E +gh 66 134C 0 21,-2.4 23,-1.1 -2,-0.4 -45,-0.2 -0.587 19.5 172.2-138.0 70.4 47.8 44.5 80.5 113 114 A W E > - 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0 0 23 -4,-2.1 -1,-0.4 287,-0.1 -2,-0.1 -0.911 65.7 -43.5 162.5 173.7 40.9 27.6 80.3 143 144 A I - 0 0 100 -2,-0.3 289,-0.1 -4,-0.1 -4,-0.0 -0.425 62.9-128.0 -67.9 130.4 37.8 29.8 80.4 144 145 A P - 0 0 32 0, 0.0 4,-0.2 0, 0.0 3,-0.1 -0.514 11.2-120.3 -86.2 159.0 38.2 32.6 82.9 145 146 A P S S- 0 0 58 0, 0.0 -62,-0.4 0, 0.0 2,-0.3 0.718 90.7 -17.0 -60.0 -34.9 35.7 33.5 85.7 146 147 A L S S+ 0 0 23 -64,-0.1 -31,-0.1 1,-0.0 -77,-0.1 -0.972 113.2 54.6-164.3 173.5 35.2 37.0 84.2 147 148 A G + 0 0 9 -2,-0.3 -29,-0.4 1,-0.2 -28,-0.2 0.638 67.9 157.2 69.3 17.0 36.8 39.5 81.9 148 149 A G - 0 0 26 -4,-0.2 -1,-0.2 1,-0.1 -5,-0.0 -0.218 50.4 -78.4 -70.8 162.8 36.8 37.0 79.0 149 150 A S + 0 0 10 17,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.157 51.6 179.2 -66.5 155.0 36.9 38.3 75.4 150 151 A T - 0 0 35 -3,-0.1 3,-0.5 289,-0.1 290,-0.1 -0.504 48.8 -73.1-131.9-158.4 33.8 39.6 73.6 151 152 A V S > S+ 0 0 21 1,-0.2 4,-2.6 288,-0.2 5,-0.2 0.571 108.4 86.6 -80.2 -10.9 32.9 41.1 70.3 152 153 A R H > S+ 0 0 48 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.852 87.0 50.3 -65.1 -31.9 34.5 44.4 71.1 153 154 A F H > S+ 0 0 0 -3,-0.5 4,-3.0 2,-0.2 3,-0.5 0.986 113.7 42.8 -70.8 -54.9 38.0 43.3 69.8 154 155 A P H > S+ 0 0 9 0, 0.0 4,-2.1 0, 0.0 -2,-0.2 0.884 112.1 56.5 -53.9 -42.2 36.7 41.9 66.4 155 156 A R H < S+ 0 0 99 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.1 0.863 117.0 33.8 -59.0 -40.1 34.5 45.0 66.0 156 157 A A H < S+ 0 0 10 -4,-1.5 -1,-0.2 -3,-0.5 -3,-0.1 0.932 130.8 29.7 -77.4 -55.0 37.5 47.3 66.4 157 158 A A H < S- 0 0 0 -4,-3.0 4,-0.4 1,-0.2 -2,-0.2 0.528 110.9-110.1 -88.6 -7.5 40.3 45.4 64.8 158 159 A G X - 0 0 3 -4,-2.1 4,-1.8 -5,-0.4 -1,-0.2 -0.030 40.7 -76.8 80.5 157.7 38.3 43.4 62.2 159 160 A W H > S+ 0 0 31 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.921 123.3 44.6 -59.4 -57.2 37.7 39.7 62.6 160 161 A T H > S+ 0 0 11 243,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.923 113.5 47.5 -64.8 -45.9 41.0 38.2 61.4 161 162 A D H > S+ 0 0 11 -4,-0.4 4,-0.9 242,-0.2 -1,-0.2 0.913 114.3 49.4 -60.9 -37.5 43.4 40.5 63.3 162 163 A A H >X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 3,-1.3 0.969 111.6 46.7 -64.1 -50.6 41.3 40.0 66.4 163 164 A X H 3X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.3 5,-0.3 0.834 99.6 70.0 -60.5 -31.1 41.3 36.2 66.1 164 165 A R H 3< S+ 0 0 34 -4,-2.3 6,-0.3 -5,-0.2 -1,-0.3 0.874 117.0 22.8 -52.9 -35.1 45.1 36.3 65.4 165 166 A Y H -I 133 0C 74 -2,-0.3 4,-2.3 -40,-0.2 3,-0.4 -0.455 34.0 -89.9 -99.6 177.7 52.3 45.9 72.1 174 175 A A H > S+ 0 0 0 -42,-1.3 4,-2.4 1,-0.2 5,-0.2 0.782 122.6 54.7 -58.4 -34.2 50.7 49.4 72.1 175 176 A D H > S+ 0 0 72 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.900 109.3 47.8 -68.1 -38.8 51.7 50.2 68.5 176 177 A E H > S+ 0 0 45 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.940 111.7 51.2 -64.8 -43.0 50.0 47.0 67.3 177 178 A A H <>S+ 0 0 0 -4,-2.3 5,-2.8 1,-0.2 6,-0.6 0.868 111.1 47.0 -63.9 -41.8 47.0 47.9 69.4 178 179 A L H ><5S+ 0 0 59 -4,-2.4 3,-2.3 4,-0.2 -1,-0.2 0.919 109.3 54.4 -57.5 -49.9 46.8 51.4 67.9 179 180 A R H 3<5S+ 0 0 122 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.883 109.2 49.8 -55.6 -35.2 47.2 49.9 64.3 180 181 A X T 3<5S- 0 0 2 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.357 118.0-113.3 -88.0 5.9 44.2 47.7 65.2 181 182 A R T < 5S+ 0 0 32 -3,-2.3 436,-0.4 2,-0.1 437,-0.3 0.710 83.8 119.8 74.3 20.4 42.1 50.7 66.3 182 183 A L S - 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0 0 81 1,-0.1 -2,-0.1 -9,-0.1 -4,-0.0 -0.516 26.9-100.1 -84.6 150.1 27.8 27.3 62.1 322 101 B R - 0 0 10 -9,-0.3 -1,-0.1 -2,-0.2 4,-0.1 -0.180 27.6-166.2 -58.0 165.0 31.2 25.9 62.8 323 102 B S + 0 0 40 2,-0.1 115,-0.2 -3,-0.1 114,-0.2 0.288 63.6 68.0-139.8 5.9 32.4 26.2 66.4 324 103 B K S S- 0 0 7 113,-0.1 -46,-0.1 1,-0.0 -53,-0.1 -0.815 92.2 -79.7-124.1 166.2 36.1 25.5 66.0 325 104 B P - 0 0 2 0, 0.0 -46,-1.9 0, 0.0 2,-0.4 -0.315 35.9-163.6 -75.4 149.0 38.8 27.6 64.3 326 105 B L E -m 279 0E 3 -48,-0.2 20,-3.0 18,-0.1 21,-1.1 -0.996 4.0-171.5-131.8 132.8 39.5 27.8 60.6 327 106 B V E -mn 280 347E 0 -48,-2.6 -46,-2.8 -2,-0.4 2,-0.4 -0.944 12.4-158.1-117.4 140.9 42.7 29.1 59.0 328 107 B V E -mn 281 348E 0 19,-3.3 21,-2.9 -2,-0.4 2,-0.5 -0.978 10.7-161.3-129.4 137.6 42.8 29.6 55.2 329 108 B A E - n 0 349E 1 -48,-2.3 2,-0.4 -2,-0.4 -46,-0.3 -0.959 17.2-175.2-111.3 127.8 45.6 29.8 52.7 330 109 B V E + n 0 350E 0 19,-2.9 21,-2.1 -2,-0.5 2,-0.3 -0.962 6.6 172.9-129.2 145.3 45.0 31.3 49.2 331 110 B Q - 0 0 17 -2,-0.4 -43,-2.7 2,-0.2 2,-1.1 -0.981 51.7 -10.0-145.9 152.9 47.0 31.8 46.0 332 111 B G S S+ 0 0 21 -2,-0.3 23,-3.3 -45,-0.2 2,-0.4 -0.508 114.4 23.0 71.9 -97.0 46.6 32.9 42.5 333 112 B T E + r 0 355G 7 -2,-1.1 -44,-2.2 21,-0.2 -45,-0.4 -0.900 52.4 172.9-116.5 135.3 43.0 33.4 41.6 334 113 B C E +qr 289 356G 0 21,-1.8 23,-1.1 -2,-0.4 5,-0.3 -0.556 17.1 179.1-143.8 71.3 40.2 34.1 44.1 335 114 B W E > - r 0 357G 40 -46,-2.5 3,-3.0 21,-0.2 23,-0.2 -0.458 50.0 -54.2 -82.9 144.4 36.9 34.9 42.3 336 115 B T T 3> S+ 0 0 25 21,-2.5 4,-1.2 1,-0.3 3,-0.5 0.082 132.5 38.7 45.6 -92.9 33.5 35.7 43.8 337 116 B A H 3> S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.664 110.6 60.9 -73.8 -16.9 32.9 32.7 46.0 338 117 B G H <> S+ 0 0 0 -3,-3.0 4,-2.9 -49,-0.2 -1,-0.2 0.873 98.7 55.2 -79.9 -39.9 36.5 32.4 47.2 339 118 B I H > S+ 0 0 0 -3,-0.5 4,-2.0 -5,-0.3 -2,-0.2 0.964 112.1 43.6 -48.8 -57.2 36.5 35.9 48.8 340 119 B E H X S+ 0 0 2 -4,-1.2 4,-0.5 29,-0.3 -1,-0.2 0.847 112.2 53.7 -63.7 -32.1 33.5 35.1 50.9 341 120 B L H >< S+ 0 0 2 -4,-1.2 3,-1.0 1,-0.2 -1,-0.2 0.934 109.3 49.4 -68.9 -41.3 35.0 31.7 51.7 342 121 B X H >< S+ 0 0 2 -4,-2.9 3,-1.2 1,-0.2 -2,-0.2 0.844 106.4 54.6 -64.5 -35.7 38.1 33.4 52.9 343 122 B L H 3< S+ 0 0 16 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.527 96.4 66.9 -80.5 -5.3 36.2 35.9 55.1 344 123 B N T << S+ 0 0 7 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.419 90.9 84.4 -89.3 -0.7 34.5 33.1 56.9 345 124 B A S < S- 0 0 5 -3,-1.2 -18,-0.2 -4,-0.1 3,-0.1 -0.480 76.7-133.3 -97.4 170.9 37.8 32.0 58.4 346 125 B D S S+ 0 0 0 -20,-3.0 2,-0.4 1,-0.3 -182,-0.2 0.710 93.6 26.0 -95.6 -25.2 39.7 33.3 61.4 347 126 B I E -n 327 0E 0 -21,-1.1 -19,-3.3 -184,-0.1 2,-0.5 -0.989 69.1-170.6-140.1 132.2 43.1 33.6 59.8 348 127 B A E -n 328 0E 2 -2,-0.4 58,-3.8 -21,-0.2 59,-1.5 -0.987 2.2-175.1-129.5 120.3 43.7 34.2 56.1 349 128 B V E -no 329 407E 0 -21,-2.9 -19,-2.9 -2,-0.5 2,-0.4 -0.970 7.0-172.2-117.3 130.8 47.1 34.1 54.4 350 129 B A E -no 330 408E 0 57,-2.0 59,-2.6 -2,-0.4 -19,-0.2 -0.921 25.4-116.4-124.2 144.8 47.6 35.0 50.8 351 130 B A E > - o 0 409E 5 -21,-2.1 3,-1.9 -2,-0.4 45,-0.2 -0.529 46.4 -97.7 -68.2 135.7 50.5 34.7 48.3 352 131 B R T 3 S+ 0 0 98 57,-3.0 -20,-0.2 1,-0.3 -1,-0.1 -0.346 113.9 30.7 -49.3 134.2 51.7 38.1 47.0 353 132 B G T 3 S+ 0 0 48 1,-0.3 -1,-0.3 -3,-0.1 2,-0.1 0.496 80.3 147.1 88.2 1.3 50.1 38.6 43.7 354 133 B T < - 0 0 0 -3,-1.9 42,-1.0 -24,-0.1 2,-0.4 -0.489 40.6-138.9 -66.5 145.8 46.9 36.7 44.4 355 134 B R E -rS 333 395G 108 -23,-3.3 -21,-1.8 40,-0.2 2,-0.4 -0.914 20.2-174.0-117.9 139.4 44.0 38.3 42.6 356 135 B F E +rS 334 394G 0 38,-3.0 38,-2.5 -2,-0.4 2,-0.3 -0.945 8.7 161.8-129.1 143.6 40.5 38.9 43.9 357 136 B A E -rS 335 393G 1 -23,-1.1 -21,-2.5 -2,-0.4 2,-1.0 -0.946 38.3-138.8-161.0 148.8 37.4 40.2 42.4 358 137 B H > + 0 0 3 34,-0.5 3,-1.0 29,-0.3 4,-0.3 -0.641 35.8 165.7 -94.5 72.2 33.7 40.3 42.9 359 138 B L T 3> + 0 0 66 -2,-1.0 4,-0.6 1,-0.2 3,-0.5 0.573 50.9 89.9 -70.0 -11.3 32.8 39.6 39.3 360 139 B E H >> S+ 0 0 14 1,-0.2 3,-1.7 2,-0.2 4,-0.8 0.865 78.1 61.3 -54.3 -42.4 29.1 38.8 40.0 361 140 B V H <4 S+ 0 0 0 -3,-1.0 303,-1.5 27,-0.3 306,-0.2 0.911 93.8 62.9 -54.2 -45.4 28.0 42.4 39.7 362 141 B L H 34 S+ 0 0 96 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.2 0.770 122.3 18.2 -53.1 -25.3 29.1 42.5 36.1 363 142 B R H << S- 0 0 206 -3,-1.7 2,-0.3 -4,-0.6 304,-0.2 0.757 114.0 -60.3-110.1 -81.3 26.5 39.8 35.3 364 143 B G S < S- 0 0 29 -4,-0.8 -1,-0.3 303,-0.1 300,-0.0 -0.887 71.9 -38.4-156.5-172.5 23.6 39.1 37.8 365 144 B I - 0 0 115 -2,-0.3 302,-0.1 1,-0.1 303,-0.1 -0.322 61.9-119.6 -60.3 141.7 22.8 38.0 41.3 366 145 B P - 0 0 27 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 -0.789 10.4-148.3 -89.8 124.3 25.1 35.3 42.7 367 146 B P S S- 0 0 60 0, 0.0 2,-0.3 0, 0.0 -62,-0.2 0.558 79.4 -2.1 -65.5 -15.1 23.5 31.9 43.7 368 147 B L S S+ 0 0 21 -64,-0.1 -76,-0.2 -76,-0.0 3,-0.1 -0.946 124.5 35.6-175.2 152.4 26.0 31.2 46.5 369 148 B G S S+ 0 0 6 -2,-0.3 -29,-0.3 1,-0.1 3,-0.1 0.686 83.7 165.2 61.4 14.7 29.1 32.8 48.0 370 149 B G - 0 0 19 -4,-0.3 -1,-0.1 1,-0.2 -5,-0.0 -0.070 47.9 -64.0 -54.6 164.1 27.2 36.0 47.2 371 150 B S - 0 0 8 1,-0.1 2,-0.2 -3,-0.1 -1,-0.2 -0.161 62.1-165.7 -60.3 147.6 28.4 39.2 48.8 372 151 B T - 0 0 14 -3,-0.1 3,-0.1 1,-0.0 -1,-0.1 -0.593 38.1-106.7-127.2 179.3 28.2 39.5 52.5 373 152 B V S > S+ 0 0 4 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.611 107.3 77.3 -79.5 -17.5 28.3 41.9 55.4 374 153 B R H > S+ 0 0 16 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.917 88.8 55.4 -61.4 -43.6 31.8 40.4 56.3 375 154 B F H > S+ 0 0 0 1,-0.2 4,-3.5 2,-0.2 5,-0.4 0.963 112.0 41.3 -55.6 -54.4 33.4 42.4 53.5 376 155 B P H > S+ 0 0 3 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.877 113.2 55.4 -64.5 -36.4 32.0 45.8 54.8 377 156 B R H < S+ 0 0 57 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.929 117.9 35.1 -56.8 -48.3 32.8 44.7 58.5 378 157 B A H < S+ 0 0 10 -4,-3.2 -3,-0.2 -5,-0.2 -1,-0.1 0.986 132.8 25.9 -67.9 -58.1 36.4 44.1 57.5 379 158 B A H < S- 0 0 1 -4,-3.5 4,-0.3 -5,-0.3 -2,-0.2 0.639 110.5-106.5 -85.0 -13.6 37.0 46.9 54.9 380 159 B G X - 0 0 2 -4,-2.4 4,-1.6 -5,-0.4 5,-0.2 -0.069 40.0 -82.0 89.0 149.5 34.5 49.5 56.0 381 160 B W H > S+ 0 0 40 2,-0.2 4,-2.5 1,-0.2 3,-0.3 0.963 124.9 45.4 -48.9 -62.0 31.3 50.2 54.0 382 161 B T H > S+ 0 0 11 256,-0.3 4,-2.8 1,-0.2 5,-0.2 0.920 112.6 46.6 -57.2 -53.7 32.8 52.4 51.3 383 162 B D H > S+ 0 0 12 -4,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.839 114.9 49.7 -59.3 -29.7 36.0 50.4 50.5 384 163 B A H >X S+ 0 0 0 -4,-1.6 4,-2.7 -3,-0.3 3,-0.7 0.903 110.1 49.6 -76.0 -36.7 33.9 47.4 50.3 385 164 B X H 3X S+ 0 0 0 -4,-2.5 4,-2.5 196,-0.2 5,-0.3 0.915 100.5 65.1 -65.6 -38.8 31.3 49.1 48.0 386 165 B R H 3< S+ 0 0 54 -4,-2.8 6,-0.3 195,-0.3 -1,-0.2 0.727 116.9 26.9 -56.1 -25.5 34.1 50.3 45.7 387 166 B Y H -S 355 0G 70 -2,-0.3 4,-2.5 -40,-0.2 3,-0.5 -0.503 37.0 -85.9-108.2-178.5 45.6 42.1 44.8 396 175 B A H > S+ 0 0 0 -42,-1.0 4,-2.2 1,-0.2 5,-0.2 0.806 123.7 53.8 -54.3 -36.4 46.9 40.6 48.0 397 176 B D H > S+ 0 0 70 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.885 110.1 46.1 -73.3 -34.1 48.3 43.9 49.2 398 177 B E H > S+ 0 0 45 -3,-0.5 4,-1.3 2,-0.2 -2,-0.2 0.877 110.5 53.8 -72.3 -39.4 45.1 45.8 48.8 399 178 B A H <>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 6,-0.6 0.919 109.5 48.7 -60.2 -40.6 43.2 42.9 50.5 400 179 B L H ><5S+ 0 0 68 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.905 106.8 56.0 -63.2 -40.8 45.6 43.3 53.5 401 180 B R H 3<5S+ 0 0 132 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.789 109.5 46.6 -63.7 -28.3 45.1 47.0 53.6 402 181 B X T 3<5S- 0 0 2 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.309 118.3-113.7 -96.9 4.3 41.4 46.5 53.9 403 182 B R T < 5S+ 0 0 19 -3,-1.8 -243,-0.4 -5,-0.1 -3,-0.2 0.809 81.2 122.4 69.8 32.1 41.9 43.8 56.6 404 183 B L S - 0 0 108 -2,-0.3 3,-2.2 -59,-0.2 4,-0.2 -0.281 65.8 -87.7 -59.7 141.8 56.0 35.1 49.1 411 190 B P T 3 S+ 0 0 88 0, 0.0 -1,-0.1 0, 0.0 -80,-0.1 -0.256 117.9 28.0 -57.7 136.6 54.4 32.9 46.5 412 191 B G T 3 S+ 0 0 58 -3,-0.1 4,-0.3 0, 0.0 -2,-0.1 0.272 106.0 79.8 94.4 -10.1 54.7 29.2 47.6 413 192 B E <> + 0 0 101 -3,-2.2 4,-1.9 2,-0.1 5,-0.2 0.381 60.7 94.3-108.7 0.1 54.8 30.1 51.3 414 193 B E H > S+ 0 0 21 -4,-0.2 4,-2.6 1,-0.2 5,-0.2 0.889 88.0 43.1 -69.5 -35.4 51.1 30.6 52.0 415 194 B L H > S+ 0 0 50 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.929 112.3 52.3 -78.1 -38.7 50.4 27.1 53.3 416 195 B A H > S+ 0 0 40 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.892 114.6 45.0 -59.0 -37.5 53.5 26.8 55.4 417 196 B R H X S+ 0 0 70 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.933 109.8 52.0 -74.2 -47.5 52.5 30.1 57.0 418 197 B A H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.911 109.2 53.9 -51.6 -44.1 48.9 29.1 57.5 419 198 B L H X S+ 0 0 20 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.927 103.8 53.2 -57.2 -48.9 50.1 26.0 59.2 420 199 B E H X S+ 0 0 85 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.915 110.7 48.0 -54.9 -43.6 52.3 27.9 61.7 421 200 B Y H X S+ 0 0 13 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.862 112.5 48.9 -61.8 -39.0 49.2 30.0 62.7 422 201 B A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.867 108.4 52.4 -73.3 -40.9 47.1 26.8 63.0 423 202 B E H X S+ 0 0 104 -4,-3.1 4,-0.7 2,-0.2 -2,-0.2 0.907 108.7 52.8 -57.1 -39.7 49.8 25.1 65.1 424 203 B R H >X S+ 0 0 96 -4,-2.1 3,-0.7 -5,-0.3 4,-0.6 0.902 110.3 45.3 -63.6 -40.3 49.7 28.2 67.3 425 204 B I H >< S+ 0 0 3 -4,-1.6 3,-0.8 1,-0.2 -1,-0.2 0.845 107.9 60.4 -70.8 -35.7 45.9 28.1 67.8 426 205 B A H 3< S+ 0 0 8 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.667 97.3 58.1 -68.4 -14.2 46.2 24.3 68.4 427 206 B R H << S+ 0 0 196 -4,-0.7 -1,-0.2 -3,-0.7 -2,-0.2 0.715 90.0 92.0 -86.3 -18.1 48.4 25.0 71.5 428 207 B A S << S- 0 0 1 -3,-0.8 -288,-0.3 -4,-0.6 -289,-0.1 -0.202 98.8 -85.9 -63.4 159.9 45.7 27.0 73.1 429 208 B A > - 0 0 17 -290,-2.6 4,-2.9 1,-0.1 3,-0.2 -0.606 36.6-141.7 -69.0 123.9 43.2 25.4 75.5 430 209 B P H > S+ 0 0 38 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.883 98.4 49.7 -61.5 -43.6 40.4 24.0 73.3 431 210 B L H > S+ 0 0 113 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.892 114.0 46.3 -59.5 -38.5 37.6 24.8 75.7 432 211 B A H > S+ 0 0 7 -3,-0.2 4,-2.3 -293,-0.2 -1,-0.2 0.933 112.7 49.8 -72.7 -39.3 38.9 28.3 76.0 433 212 B V H X S+ 0 0 5 -4,-2.9 4,-2.6 -294,-0.3 5,-0.2 0.964 111.6 49.4 -59.6 -51.7 39.3 28.7 72.2 434 213 B R H X S+ 0 0 92 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.890 111.7 47.6 -54.1 -45.3 35.8 27.4 71.6 435 214 B A H X S+ 0 0 32 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.843 109.2 54.6 -71.3 -32.2 34.3 29.8 74.2 436 215 B A H X S+ 0 0 6 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.964 110.2 46.2 -58.8 -49.3 36.2 32.7 72.6 437 216 B L H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.893 110.2 54.0 -61.3 -44.0 34.7 31.9 69.1 438 217 B Q H < S+ 0 0 92 -4,-2.2 4,-0.3 -5,-0.2 -1,-0.2 0.899 109.7 46.7 -62.0 -41.5 31.3 31.6 70.6 439 218 B S H >< S+ 0 0 49 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.929 114.1 47.8 -62.8 -42.3 31.5 35.1 72.2 440 219 B A H 3< S+ 0 0 2 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.927 99.5 67.0 -66.0 -41.6 32.9 36.6 69.0 441 220 B F T >< S+ 0 0 9 -4,-2.9 3,-1.0 -5,-0.2 2,-0.5 0.531 73.4 118.7 -59.3 -7.8 30.2 35.0 66.8 442 221 B Q T < S- 0 0 101 -3,-1.3 -3,-0.0 -4,-0.3 4,-0.0 -0.498 97.8 -22.6 -65.0 112.5 27.6 37.2 68.6 443 222 B G T > S+ 0 0 33 -2,-0.5 3,-1.2 1,-0.1 -1,-0.3 0.688 90.8 146.0 62.2 20.0 25.9 39.4 66.0 444 223 B R T < S+ 0 0 27 -3,-1.0 -2,-0.1 1,-0.3 -1,-0.1 0.887 77.1 31.0 -53.9 -44.2 28.9 39.1 63.7 445 224 B D T 3 S+ 0 0 36 -4,-0.3 234,-2.7 233,-0.1 -1,-0.3 0.252 84.8 138.0-102.6 11.6 26.8 39.2 60.6 446 225 B E B < -T 678 0H 35 -3,-1.2 232,-0.2 233,-0.2 231,-0.0 -0.392 54.4-122.9 -60.3 126.0 24.0 41.5 62.0 447 226 B G >> - 0 0 2 230,-1.1 3,-1.6 -2,-0.1 4,-1.1 -0.273 14.3-112.3 -77.0 160.4 23.2 44.0 59.2 448 227 B D H 3> S+ 0 0 11 227,-0.7 4,-1.6 228,-0.3 229,-0.2 0.574 112.3 66.0 -69.7 -6.7 23.4 47.7 59.6 449 228 B D H 3> S+ 0 0 51 227,-1.5 4,-0.8 2,-0.2 -1,-0.3 0.619 97.6 55.0 -89.4 -10.8 19.6 48.1 59.3 450 229 B A H <> S+ 0 0 31 -3,-1.6 4,-1.5 226,-0.3 -2,-0.2 0.892 110.0 45.3 -79.7 -46.3 19.2 46.2 62.6 451 230 B A H X S+ 0 0 0 -4,-1.1 4,-1.2 1,-0.2 3,-0.2 0.946 112.6 52.0 -54.1 -50.6 21.5 48.7 64.4 452 231 B L H X S+ 0 0 11 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.738 107.0 51.2 -66.0 -28.4 19.8 51.7 62.8 453 232 B S H X S+ 0 0 43 -4,-0.8 4,-1.3 2,-0.2 -1,-0.2 0.868 107.3 52.6 -75.1 -39.2 16.3 50.7 63.8 454 233 B R H X S+ 0 0 55 -4,-1.5 4,-0.9 -3,-0.2 -2,-0.2 0.803 114.4 46.6 -60.2 -30.6 17.3 50.2 67.5 455 234 B V H X S+ 0 0 0 -4,-1.2 4,-0.6 2,-0.2 -2,-0.2 0.899 101.8 58.4 -83.3 -46.9 18.7 53.8 67.2 456 235 B N H >< S+ 0 0 62 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.865 107.2 51.5 -55.8 -34.7 15.9 55.6 65.6 457 236 B E H 3< S+ 0 0 152 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.891 99.5 63.3 -66.4 -41.4 13.7 54.6 68.5 458 237 B S H 3< 0 0 40 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.613 360.0 360.0 -58.8 -12.4 16.2 55.9 71.0 459 238 B L << 0 0 95 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.221 360.0 360.0-120.7 360.0 15.6 59.4 69.6 460 !* 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 0.0 461 3 C E 0 0 246 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -49.1 23.2 82.8 41.9 462 4 C A - 0 0 70 23,-0.1 2,-0.5 22,-0.1 21,-0.1 -0.664 360.0-127.8 -77.0 131.2 24.1 81.7 45.5 463 5 C N + 0 0 17 -2,-0.4 23,-2.5 1,-0.1 24,-0.6 -0.722 35.5 168.7 -89.2 128.9 20.9 81.0 47.3 464 6 C S + 0 0 74 -2,-0.5 -1,-0.1 22,-0.2 3,-0.1 0.331 59.5 71.9-113.4 -0.5 20.4 82.7 50.6 465 7 C G S S- 0 0 24 1,-0.3 22,-0.1 0, 0.0 -2,-0.0 0.085 101.0 -23.6 -96.6-151.1 16.7 82.0 51.0 466 8 C P S S- 0 0 91 0, 0.0 -1,-0.3 0, 0.0 -2,-0.0 -0.282 80.6-100.9 -60.5 143.8 14.8 78.8 51.8 467 9 C G + 0 0 8 -3,-0.1 2,-0.3 23,-0.1 17,-0.2 -0.154 47.9 155.8 -73.8 163.6 16.8 75.6 50.9 468 10 C R - 0 0 111 15,-0.4 15,-2.3 -5,-0.1 2,-0.3 -0.953 30.0-123.0-167.4 171.0 16.4 73.4 47.8 469 11 C V E -U 482 0I 8 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.972 16.8-130.9-128.1 147.5 18.3 71.0 45.6 470 12 C T E -U 481 0I 47 11,-2.0 11,-1.5 -2,-0.3 2,-0.4 -0.664 16.5-154.8 -82.3 153.7 19.0 70.9 41.9 471 13 C R E +U 480 0I 80 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.991 15.7 172.6-126.6 126.8 18.4 67.8 39.9 472 14 C E E -U 479 0I 94 7,-1.8 7,-2.9 -2,-0.4 2,-0.7 -0.997 23.0-146.9-129.5 128.4 20.3 67.1 36.6 473 15 C Q E +U 478 0I 81 -2,-0.4 2,-0.6 5,-0.2 5,-0.2 -0.834 21.0 180.0 -90.9 114.8 20.0 63.8 34.8 474 16 C R E > -U 477 0I 103 3,-3.1 3,-1.7 -2,-0.7 2,-0.5 -0.797 59.8 -61.1-123.7 95.3 23.4 63.2 33.2 475 17 C G T 3 S- 0 0 55 -2,-0.6 36,-0.0 1,-0.2 0, 0.0 -0.605 117.8 -22.1 65.5-118.8 23.4 60.0 31.3 476 18 C H T 3 S+ 0 0 71 -2,-0.5 37,-3.1 36,-0.1 38,-1.2 0.245 119.9 99.7-104.5 10.3 22.6 57.3 33.8 477 19 C L E < -Uv 474 514I 0 -3,-1.7 -3,-3.1 35,-0.2 2,-0.7 -0.854 62.3-150.9 -99.8 130.4 23.8 59.5 36.7 478 20 C F E -Uv 473 515I 15 36,-2.6 38,-2.5 -2,-0.4 2,-0.6 -0.913 18.0-156.3-102.5 105.7 21.2 61.4 38.8 479 21 C L E -Uv 472 516I 1 -7,-2.9 -7,-1.8 -2,-0.7 2,-0.6 -0.758 11.2-173.7 -92.2 115.3 23.0 64.5 40.1 480 22 C I E -Uv 471 517I 0 36,-3.2 38,-2.7 -2,-0.6 2,-0.6 -0.909 4.1-168.6-112.4 119.5 21.6 66.2 43.2 481 23 C G E -Uv 470 518I 0 -11,-1.5 -11,-2.0 -2,-0.6 2,-0.3 -0.909 22.7-129.8-111.7 122.2 23.1 69.5 44.4 482 24 C L E -Uv 469 519I 0 36,-2.6 38,-2.9 -2,-0.6 2,-0.4 -0.556 28.4-167.6 -65.9 128.3 22.6 71.2 47.7 483 25 C D + 0 0 17 -15,-2.3 -15,-0.4 -2,-0.3 -1,-0.1 -0.728 55.2 90.4-127.8 73.2 21.6 74.7 46.8 484 26 C R > > + 0 0 17 -2,-0.4 5,-2.6 36,-0.2 3,-1.8 -0.155 38.1 150.2-154.7 46.2 21.6 77.1 49.7 485 27 C A G > 5 + 0 0 27 1,-0.3 3,-2.2 3,-0.3 -21,-0.2 0.773 63.0 70.6 -55.0 -32.5 25.2 78.2 49.5 486 28 C G G 3 5S+ 0 0 36 -23,-2.5 -1,-0.3 1,-0.3 -22,-0.2 0.798 108.1 36.1 -56.0 -31.9 24.3 81.6 51.0 487 29 C K G X 5S- 0 0 113 -3,-1.8 3,-1.5 -24,-0.6 -1,-0.3 -0.107 122.8-103.7-107.8 31.9 23.7 79.9 54.3 488 30 C R T < 5S- 0 0 120 -3,-2.2 38,-1.3 1,-0.2 -3,-0.3 0.813 71.2 -68.3 47.1 31.8 26.6 77.5 53.7 489 31 C N T 3 - 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0 0 43 -6,-0.4 -34,-0.6 -5,-0.2 -1,-0.2 -0.289 37.2-115.7 -67.9 153.6 36.5 68.2 67.8 628 172 C E E -C 592 0K 102 -36,-0.2 2,-0.3 -3,-0.1 -36,-0.2 -0.526 30.5-175.0 -91.1 148.5 37.3 69.0 64.2 629 173 C F E -C 591 0K 8 -38,-2.6 -38,-2.9 -2,-0.2 2,-0.1 -0.985 18.4-121.8-144.8 154.1 39.3 66.7 61.9 630 174 C D E > -C 590 0K 76 -2,-0.3 4,-2.5 -40,-0.2 3,-0.2 -0.309 34.4 -96.2 -92.6 175.3 40.6 67.0 58.4 631 175 C A H > S+ 0 0 0 -42,-0.8 4,-1.9 1,-0.2 5,-0.1 0.832 121.7 55.0 -60.7 -34.9 40.0 65.0 55.2 632 176 C D H > S+ 0 0 68 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.888 109.7 46.1 -68.7 -36.2 43.2 62.9 55.8 633 177 C E H > S+ 0 0 45 -3,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.905 111.1 53.2 -72.4 -39.5 42.1 61.9 59.3 634 178 C A H <>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.2 6,-0.7 0.859 109.8 49.0 -59.7 -35.5 38.6 61.1 57.9 635 179 C L H ><5S+ 0 0 65 -4,-1.9 3,-1.6 1,-0.2 -2,-0.2 0.924 107.0 54.0 -73.0 -42.8 40.3 58.9 55.3 636 180 C R H 3<5S+ 0 0 116 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.784 109.2 50.3 -57.9 -26.8 42.4 57.1 57.9 637 181 C X T 3<5S- 0 0 0 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.414 116.7-115.3 -98.1 -1.0 39.2 56.3 59.8 638 182 C R T < 5S+ 0 0 24 -3,-1.6 -256,-0.3 -4,-0.2 -3,-0.2 0.821 82.2 120.9 73.2 33.4 37.5 55.0 56.7 639 183 C L S - 0 0 110 -2,-0.3 3,-2.9 -59,-0.2 4,-0.3 -0.253 63.7 -84.4 -65.7 148.5 42.9 68.0 45.3 646 190 C P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -80,-0.1 -0.330 120.5 27.6 -57.6 132.9 40.5 71.0 45.8 647 191 C G T 3 S+ 0 0 57 -3,-0.1 4,-0.4 0, 0.0 3,-0.1 0.093 105.9 81.4 100.7 -17.1 38.4 71.3 42.7 648 192 C E <> + 0 0 102 -3,-2.9 4,-3.1 1,-0.1 5,-0.3 0.533 62.1 90.3 -92.6 -9.8 38.6 67.6 41.9 649 193 C E H > S+ 0 0 24 -4,-0.3 4,-2.4 1,-0.2 5,-0.1 0.903 90.7 41.6 -67.2 -42.4 36.0 66.1 44.2 650 194 C L H > S+ 0 0 49 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.960 116.7 48.0 -69.5 -46.9 33.0 66.3 41.9 651 195 C A H > S+ 0 0 52 -4,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.960 114.9 46.7 -54.1 -52.3 35.0 65.1 38.8 652 196 C R H X S+ 0 0 73 -4,-3.1 4,-1.7 1,-0.2 -1,-0.2 0.877 110.2 53.5 -58.8 -41.7 36.5 62.2 40.8 653 197 C A H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 5,-0.2 0.906 106.0 52.3 -60.7 -43.8 33.1 61.3 42.2 654 198 C L H X S+ 0 0 24 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.916 104.2 58.1 -60.1 -39.7 31.5 61.1 38.7 655 199 C E H X S+ 0 0 117 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.939 110.1 43.0 -56.0 -44.1 34.3 58.8 37.7 656 200 C Y H X S+ 0 0 21 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.919 115.2 48.0 -66.4 -42.3 33.2 56.4 40.6 657 201 C A H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.840 109.2 55.3 -67.8 -31.8 29.5 56.8 39.8 658 202 C E H X S+ 0 0 92 -4,-2.8 4,-0.5 -5,-0.2 -1,-0.2 0.921 106.8 49.4 -63.4 -47.2 30.3 56.2 36.2 659 203 C R H >X S+ 0 0 98 -4,-1.7 3,-0.7 1,-0.2 4,-0.6 0.842 110.0 51.4 -61.7 -37.8 32.0 52.9 37.0 660 204 C I H >< S+ 0 0 3 -4,-1.8 3,-0.6 1,-0.2 -1,-0.2 0.816 100.3 64.0 -69.8 -32.4 29.0 51.8 39.1 661 205 C A H 3< S+ 0 0 7 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.624 95.9 59.8 -68.7 -15.5 26.6 52.6 36.2 662 206 C R H << S+ 0 0 178 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.766 85.6 90.0 -82.7 -30.1 28.2 49.9 34.1 663 207 C A S << S- 0 0 1 -4,-0.6 -301,-0.2 -3,-0.6 -302,-0.1 -0.203 99.6 -83.7 -64.7 162.3 27.4 47.0 36.5 664 208 C A >> - 0 0 24 -303,-1.5 4,-2.7 1,-0.1 3,-0.9 -0.568 35.9-141.8 -70.6 120.2 24.1 45.2 36.1 665 209 C P H 3> S+ 0 0 42 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.854 99.3 51.4 -57.9 -36.9 21.4 47.3 37.9 666 210 C L H 3> S+ 0 0 133 2,-0.2 4,-1.5 1,-0.2 -302,-0.1 0.803 114.6 43.4 -67.5 -30.5 19.5 44.2 39.2 667 211 C A H <> S+ 0 0 0 -3,-0.9 4,-2.9 -306,-0.2 -1,-0.2 0.817 111.6 53.8 -80.0 -36.7 22.8 42.7 40.6 668 212 C V H X S+ 0 0 7 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.931 110.5 47.6 -61.0 -45.6 23.8 46.1 42.0 669 213 C R H X S+ 0 0 90 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.942 110.9 52.8 -59.0 -47.9 20.5 46.3 43.8 670 214 C A H X S+ 0 0 18 -4,-1.5 4,-2.6 1,-0.2 5,-0.2 0.949 107.5 48.6 -53.3 -59.0 21.0 42.8 45.0 671 215 C A H X S+ 0 0 5 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.906 112.1 50.9 -50.5 -46.4 24.4 43.4 46.6 672 216 C L H >X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 3,-1.0 0.971 109.7 47.4 -55.4 -58.0 23.1 46.5 48.3 673 217 C Q H 3X S+ 0 0 113 -4,-2.5 4,-2.1 1,-0.3 5,-0.3 0.885 112.4 52.5 -54.4 -38.4 20.1 44.8 49.9 674 218 C S H 3X S+ 0 0 44 -4,-2.6 4,-1.4 -5,-0.2 -1,-0.3 0.822 110.9 45.9 -66.0 -31.9 22.4 42.0 51.0 675 219 C A H << S+ 0 0 0 -4,-1.8 -227,-0.7 -3,-1.0 -2,-0.2 0.888 112.7 49.2 -83.7 -36.8 24.8 44.4 52.7 676 220 C F H < S+ 0 0 7 -4,-2.7 -227,-1.5 -5,-0.2 -228,-0.3 0.981 119.9 34.8 -60.7 -59.1 22.1 46.5 54.5 677 221 C Q H < S+ 0 0 89 -4,-2.1 -230,-1.1 -5,-0.2 2,-0.3 0.930 83.1 175.2 -62.2 -46.9 20.2 43.5 55.9 678 222 C G B < T 446 0H 14 -4,-1.4 -232,-0.2 -5,-0.3 -1,-0.2 -0.565 360.0 360.0 66.4-134.8 23.1 41.2 56.6 679 223 C R 0 0 212 -234,-2.7 -233,-0.2 -2,-0.3 -1,-0.1 0.451 360.0 360.0-147.5 360.0 22.1 37.9 58.4