==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 20-MAY-09 3HIN . COMPND 2 MOLECULE: PUTATIVE 3-HYDROXYBUTYRYL-COA DEHYDRATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOPSEUDOMONAS PALUSTRIS; . AUTHOR V.N.MALASHKEVICH,R.TORO,C.MORANO,J.M.SAUDER,S.K.BURLEY,S.C.A . 509 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26875.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 382 75.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 56 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 25 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 195 38.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.2 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 0 0 0 4 4 2 4 0 3 0 0 0 0 3 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 6 2 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 PARALLEL BRIDGES PER LADDER . 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 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 9 A A 0 0 161 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -26.9 71.7 40.3 89.5 2 10 A A - 0 0 91 2,-0.0 2,-0.2 1,-0.0 36,-0.0 0.738 360.0-100.0 63.5 139.9 70.7 38.9 86.0 3 11 A T - 0 0 70 31,-0.1 2,-0.3 1,-0.1 -1,-0.0 -0.597 37.2-114.8 -89.7 143.4 68.2 36.1 85.1 4 12 A I - 0 0 151 -2,-0.2 35,-0.2 1,-0.1 34,-0.2 -0.626 31.8-112.4 -81.6 137.2 69.5 32.7 84.2 5 13 A A - 0 0 25 -2,-0.3 31,-0.2 33,-0.3 30,-0.1 -0.329 16.2-153.2 -61.1 144.0 69.1 31.5 80.6 6 14 A D > + 0 0 63 29,-2.2 3,-2.5 1,-0.1 -1,-0.1 -0.782 15.7 179.5-110.0 83.5 66.7 28.6 80.0 7 15 A P G > S+ 0 0 96 0, 0.0 3,-1.4 0, 0.0 5,-0.1 0.638 71.5 74.8 -60.1 -13.4 68.2 27.2 76.8 8 16 A S G 3 S+ 0 0 82 1,-0.3 28,-0.1 3,-0.1 -3,-0.0 0.654 85.9 66.4 -75.1 -12.1 65.6 24.4 76.7 9 17 A T G < S+ 0 0 5 -3,-2.5 15,-2.3 26,-0.1 2,-0.3 0.315 101.6 55.3 -85.2 8.1 63.1 27.1 75.5 10 18 A L E < -A 23 0A 12 -3,-1.4 2,-0.5 13,-0.2 13,-0.2 -0.962 66.3-149.3-139.5 148.2 65.1 27.5 72.2 11 19 A V E -A 22 0A 68 11,-2.0 11,-3.0 -2,-0.3 2,-0.5 -0.942 24.3-172.3-122.4 111.9 66.2 25.2 69.5 12 20 A V E +A 21 0A 70 -2,-0.5 2,-0.3 9,-0.2 9,-0.2 -0.856 11.9 159.1-111.2 122.4 69.5 26.4 68.0 13 21 A D E -A 20 0A 96 7,-2.5 7,-3.0 -2,-0.5 2,-0.5 -0.858 32.9-132.8-132.0 176.0 71.2 25.0 64.9 14 22 A T E -A 19 0A 74 -2,-0.3 2,-0.6 5,-0.3 5,-0.2 -0.990 17.7-174.2-130.9 113.8 73.7 26.1 62.4 15 23 A V E > -A 18 0A 55 3,-3.2 3,-1.9 -2,-0.5 -2,-0.0 -0.932 67.1 -52.9-111.4 105.9 72.8 25.5 58.7 16 24 A G T 3 S- 0 0 61 -2,-0.6 182,-0.0 1,-0.3 34,-0.0 -0.462 123.5 -20.6 57.2-127.1 75.9 26.5 56.6 17 25 A P T 3 S+ 0 0 20 0, 0.0 35,-3.6 0, 0.0 36,-1.2 0.234 118.8 100.6 -98.3 18.5 76.6 30.1 57.7 18 26 A V E < -Ab 15 53A 0 -3,-1.9 -3,-3.2 33,-0.2 2,-0.7 -0.915 61.0-150.3-106.7 116.9 73.1 30.7 59.2 19 27 A L E -Ab 14 54A 14 34,-2.7 36,-2.0 -2,-0.6 2,-0.5 -0.753 19.7-155.9 -79.2 114.6 72.5 30.4 62.9 20 28 A T E -Ab 13 55A 5 -7,-3.0 -7,-2.5 -2,-0.7 2,-0.5 -0.878 10.1-169.0-102.4 137.8 69.0 29.3 63.3 21 29 A I E -Ab 12 56A 0 34,-3.1 36,-2.4 -2,-0.5 2,-0.6 -0.907 2.9-166.1-128.8 103.1 67.1 30.1 66.4 22 30 A G E -Ab 11 57A 0 -11,-3.0 -11,-2.0 -2,-0.5 2,-0.4 -0.775 20.6-132.2-101.1 123.3 63.7 28.4 67.0 23 31 A L E -Ab 10 58A 0 34,-3.0 36,-3.0 -2,-0.6 -13,-0.2 -0.598 28.4-170.3 -70.7 127.0 61.4 29.7 69.7 24 32 A N + 0 0 46 -15,-2.3 -14,-0.1 -2,-0.4 -1,-0.1 -0.515 49.9 101.3-131.6 58.4 60.4 26.5 71.5 25 33 A R > > + 0 0 32 34,-0.2 5,-2.8 -2,-0.2 3,-1.4 -0.524 39.3 159.4-127.8 60.2 57.6 26.9 74.0 26 34 A P G > 5 + 0 0 62 0, 0.0 3,-2.0 0, 0.0 35,-0.2 0.792 61.9 66.3 -61.9 -27.6 54.9 25.5 71.7 27 35 A K G 3 5S+ 0 0 211 1,-0.3 33,-0.0 2,-0.1 -3,-0.0 0.761 114.6 34.0 -66.1 -25.1 52.4 24.5 74.4 28 36 A K G X 5S- 0 0 75 -3,-1.4 3,-1.8 3,-0.1 37,-0.3 -0.110 122.1-102.5-118.8 38.1 52.1 28.2 75.1 29 37 A R T < 5S- 0 0 105 -3,-2.0 36,-1.8 1,-0.3 37,-0.2 0.862 76.5 -60.1 51.9 38.5 52.6 29.5 71.5 30 38 A N T 3 - 0 0 17 34,-0.2 4,-2.5 -2,-0.2 3,-0.4 -0.906 49.1 -89.6-144.4 176.2 59.5 34.7 79.5 34 42 A D H > S+ 0 0 22 -2,-0.3 4,-2.4 1,-0.3 5,-0.1 0.849 122.0 47.4 -63.5 -34.7 62.7 35.8 81.3 35 43 A G H > S+ 0 0 14 2,-0.2 4,-2.4 1,-0.2 -29,-2.2 0.825 111.8 49.7 -78.2 -27.9 64.6 32.6 80.7 36 44 A L H > S+ 0 0 0 -3,-0.4 4,-2.8 2,-0.2 -2,-0.2 0.981 113.3 47.6 -71.3 -46.2 63.8 32.4 77.1 37 45 A M H X S+ 0 0 2 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.864 112.6 48.7 -57.5 -43.0 64.8 36.0 76.7 38 46 A A H X S+ 0 0 12 -4,-2.4 4,-2.2 -5,-0.2 -33,-0.3 0.916 111.5 48.9 -65.3 -42.5 68.1 35.4 78.6 39 47 A A H X S+ 0 0 5 -4,-2.4 4,-1.9 -35,-0.2 -2,-0.2 0.882 111.4 52.4 -60.4 -43.2 68.8 32.3 76.5 40 48 A L H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.935 106.7 49.9 -56.5 -52.9 68.1 34.5 73.4 41 49 A K H < S+ 0 0 72 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.911 109.6 54.2 -52.6 -44.6 70.5 37.2 74.5 42 50 A D H >< S+ 0 0 100 -4,-2.2 3,-1.9 1,-0.2 -1,-0.2 0.913 104.3 52.4 -55.0 -49.6 73.1 34.4 75.0 43 51 A C H 3< S+ 0 0 30 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.856 112.3 47.1 -60.1 -36.4 72.7 33.0 71.5 44 52 A L T 3< S+ 0 0 9 -4,-1.9 2,-0.5 -5,-0.1 3,-0.3 0.275 93.4 95.1 -87.4 11.9 73.3 36.6 70.1 45 53 A T S < S- 0 0 47 -3,-1.9 52,-0.0 1,-0.2 48,-0.0 -0.894 102.6 -7.6-102.0 130.8 76.4 37.2 72.3 46 54 A D S S- 0 0 155 -2,-0.5 -1,-0.2 1,-0.2 3,-0.1 0.932 82.8-160.0 56.3 50.5 79.8 36.5 70.8 47 55 A I - 0 0 15 -3,-0.3 -1,-0.2 1,-0.1 -3,-0.1 -0.508 28.1-103.9 -65.6 122.1 78.2 35.0 67.7 48 56 A P > - 0 0 64 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.001 24.9-112.0 -55.0 155.9 81.0 32.9 66.2 49 57 A D T 3 S+ 0 0 143 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.781 110.3 65.2 -58.3 -34.5 82.9 34.2 63.1 50 58 A Q T 3 S+ 0 0 122 2,-0.0 2,-0.5 -32,-0.0 -1,-0.3 0.565 83.4 93.4 -66.1 -10.2 81.5 31.5 60.7 51 59 A I < + 0 0 2 -3,-1.8 -33,-0.2 1,-0.1 3,-0.1 -0.765 40.7 167.0 -92.2 130.4 78.0 32.8 61.1 52 60 A R + 0 0 111 -35,-3.6 2,-0.3 -2,-0.5 -34,-0.2 0.376 65.5 20.7-122.3 2.7 76.9 35.4 58.5 53 61 A A E -b 18 0A 0 -36,-1.2 -34,-2.7 46,-0.2 2,-0.4 -0.960 59.5-145.2-163.1 157.8 73.1 35.4 59.2 54 62 A V E -bc 19 101A 0 46,-2.1 48,-3.1 -2,-0.3 2,-0.5 -0.999 8.1-165.8-127.1 125.6 70.6 34.6 61.9 55 63 A V E -bc 20 102A 0 -36,-2.0 -34,-3.1 -2,-0.4 2,-0.5 -0.974 6.3-163.5-108.2 122.0 67.0 33.3 61.3 56 64 A I E +bc 21 103A 2 46,-2.7 48,-2.7 -2,-0.5 2,-0.3 -0.911 23.6 158.8-102.7 131.9 64.7 33.5 64.2 57 65 A H E -b 22 0A 22 -36,-2.4 -34,-3.0 -2,-0.5 2,-0.4 -0.892 36.3-106.4-149.2 166.0 61.6 31.3 63.8 58 66 A G E -b 23 0A 1 46,-0.4 2,-0.4 -2,-0.3 -34,-0.2 -0.845 16.4-140.6-108.1 139.1 58.9 29.5 65.8 59 67 A I S S+ 0 0 55 -36,-3.0 3,-0.4 -2,-0.4 -34,-0.2 -0.816 78.7 18.0 -85.8 137.8 58.5 25.8 66.5 60 68 A G S S- 0 0 36 -2,-0.4 -2,-0.1 1,-0.2 -33,-0.0 -0.607 120.0 -45.7 102.8-163.5 54.8 24.9 66.2 61 69 A D S S+ 0 0 131 -2,-0.2 2,-0.3 -35,-0.2 -1,-0.2 0.660 115.9 62.5 -81.1 -13.6 52.1 26.8 64.5 62 70 A H - 0 0 40 -3,-0.4 45,-0.2 45,-0.2 47,-0.1 -0.815 59.1-151.4-122.5 151.9 53.0 30.2 66.0 63 71 A F S S- 0 0 0 43,-1.7 2,-0.3 45,-0.9 -4,-0.2 0.966 80.9 -45.0 -71.0 -70.7 55.8 32.7 66.0 64 72 A S B -g 109 0C 0 44,-2.4 46,-2.0 42,-0.2 -34,-0.2 -0.890 32.5-153.1-165.8 134.7 55.1 34.1 69.5 65 73 A A - 0 0 18 -36,-1.8 47,-0.2 1,-0.3 -34,-0.2 0.200 53.7-127.4 -87.0 10.5 52.0 35.2 71.4 66 74 A G + 0 0 0 -36,-0.3 -34,-2.0 -37,-0.2 -1,-0.3 -0.478 67.7 28.5 79.5-148.0 54.2 37.5 73.4 67 75 A L B S-f 32 0B 82 -36,-0.2 2,-0.6 -2,-0.2 -34,-0.2 -0.263 80.8-112.4 -66.6 128.9 54.4 37.7 77.2 68 76 A D > - 0 0 5 -36,-2.2 3,-1.4 1,-0.2 -1,-0.1 -0.459 26.7-165.7 -60.1 107.5 53.6 34.5 79.2 69 77 A L G > S+ 0 0 99 -2,-0.6 3,-0.5 1,-0.3 -1,-0.2 0.688 85.7 57.7 -79.0 -15.5 50.4 35.4 80.9 70 78 A S G 3 S+ 0 0 85 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.1 0.446 105.0 53.2 -83.9 -4.3 50.7 32.4 83.3 71 79 A E G < S+ 0 0 89 -3,-1.4 -1,-0.2 2,-0.1 -2,-0.2 0.106 71.4 149.1-125.4 21.8 54.1 33.7 84.5 72 80 A L < - 0 0 125 -3,-0.5 2,-0.4 -5,-0.1 -3,-0.1 -0.364 30.7-156.7 -55.0 132.3 53.3 37.3 85.5 73 81 A R - 0 0 143 -2,-0.1 2,-0.2 2,-0.0 -2,-0.1 -0.955 21.0-115.9-115.2 132.8 55.4 38.5 88.3 74 82 A E + 0 0 186 -2,-0.4 2,-0.4 5,-0.0 0, 0.0 -0.531 42.3 178.1 -71.2 134.3 54.2 41.3 90.5 75 83 A R - 0 0 87 -2,-0.2 2,-0.1 4,-0.0 -2,-0.0 -1.000 24.7-134.1-148.6 129.2 56.5 44.4 90.2 76 84 A D > - 0 0 88 -2,-0.4 4,-3.1 1,-0.1 5,-0.3 -0.313 46.8 -88.2 -77.1 171.0 56.6 47.9 91.6 77 85 A A H > S+ 0 0 72 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.884 129.8 46.0 -44.1 -48.9 57.2 50.9 89.4 78 86 A T H > S+ 0 0 93 1,-0.2 4,-2.6 2,-0.2 3,-0.4 0.951 112.0 50.7 -66.9 -45.8 61.0 50.6 89.8 79 87 A E H > S+ 0 0 96 1,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.928 108.8 50.8 -59.5 -44.0 61.0 46.9 89.2 80 88 A G H X S+ 0 0 31 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.804 109.2 51.9 -66.2 -28.7 58.9 47.3 86.0 81 89 A L H X S+ 0 0 114 -4,-1.6 4,-2.5 -3,-0.4 -1,-0.2 0.949 112.6 45.4 -64.2 -52.0 61.4 49.9 84.8 82 90 A V H X S+ 0 0 89 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.916 114.5 49.3 -57.2 -43.5 64.3 47.5 85.5 83 91 A H H X S+ 0 0 32 -4,-3.0 4,-1.8 -5,-0.2 -1,-0.2 0.918 109.6 49.5 -67.6 -45.4 62.4 44.7 83.8 84 92 A S H X S+ 0 0 28 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.946 110.7 51.6 -53.3 -49.6 61.5 46.6 80.7 85 93 A Q H X S+ 0 0 83 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.905 104.6 57.2 -56.7 -45.7 65.2 47.7 80.4 86 94 A T H X S+ 0 0 55 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.921 107.9 46.4 -45.0 -51.1 66.3 44.1 80.7 87 95 A W H X S+ 0 0 15 -4,-1.8 4,-2.1 1,-0.2 3,-0.2 0.899 108.0 57.1 -68.1 -35.6 64.1 43.1 77.7 88 96 A H H X S+ 0 0 46 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.893 102.5 55.0 -60.9 -34.8 65.5 46.1 75.8 89 97 A R H X S+ 0 0 98 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.876 106.4 51.2 -69.9 -31.0 69.0 44.8 76.2 90 98 A V H >< S+ 0 0 5 -4,-1.4 3,-1.0 -3,-0.2 4,-0.5 0.956 111.4 46.8 -64.9 -49.6 68.0 41.5 74.7 91 99 A F H >X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.3 3,-0.8 0.771 100.4 66.7 -68.1 -24.7 66.5 43.2 71.6 92 100 A D H 3X S+ 0 0 44 -4,-2.1 4,-2.8 1,-0.2 -1,-0.3 0.866 95.3 58.6 -60.8 -33.9 69.5 45.4 71.2 93 101 A K H << S+ 0 0 72 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.718 110.7 43.0 -71.0 -17.9 71.5 42.2 70.4 94 102 A I H X4 S+ 0 0 0 -3,-0.8 3,-1.7 -4,-0.5 -2,-0.2 0.908 117.9 41.9 -81.6 -60.4 69.0 41.7 67.5 95 103 A Q H 3< S+ 0 0 49 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.900 126.1 34.6 -49.5 -48.1 68.9 45.3 66.2 96 104 A Y T 3< S+ 0 0 110 -4,-2.8 -1,-0.3 -5,-0.2 -3,-0.1 0.079 85.8 142.5-103.5 22.7 72.6 45.9 66.5 97 105 A C < - 0 0 6 -3,-1.7 4,-0.1 1,-0.1 -3,-0.1 -0.298 58.8-126.5 -59.3 147.1 73.6 42.3 65.6 98 106 A R S S+ 0 0 105 -5,-0.1 -1,-0.1 2,-0.1 114,-0.1 0.814 95.2 42.4 -73.5 -20.0 76.8 42.2 63.6 99 107 A V S S- 0 0 3 -5,-0.1 -46,-0.2 113,-0.1 2,-0.1 -0.806 104.3 -85.5-116.6 162.9 75.0 40.1 61.0 100 108 A P - 0 0 6 0, 0.0 -46,-2.1 0, 0.0 2,-0.5 -0.423 37.0-146.2 -71.9 146.4 71.5 40.5 59.6 101 109 A V E -c 54 0A 0 -48,-0.2 20,-1.8 -7,-0.2 21,-1.7 -0.917 11.0-166.7-110.2 128.5 68.6 38.9 61.5 102 110 A I E -cd 55 122A 0 -48,-3.1 -46,-2.7 -2,-0.5 2,-0.5 -0.959 7.1-152.7-115.0 130.9 65.6 37.5 59.6 103 111 A A E -cd 56 123A 1 19,-2.7 21,-2.6 -2,-0.5 2,-0.7 -0.892 5.5-149.6-105.6 126.9 62.4 36.6 61.4 104 112 A A E - d 0 124A 6 -48,-2.7 2,-0.4 -2,-0.5 -46,-0.4 -0.868 22.7-157.8 -93.8 112.6 60.2 33.9 59.9 105 113 A L E + d 0 125A 0 19,-4.3 21,-2.6 -2,-0.7 24,-0.3 -0.795 25.2 146.6-102.2 134.0 56.6 34.8 60.9 106 114 A K - 0 0 45 -2,-0.4 -43,-1.7 2,-0.3 -42,-0.2 -0.964 57.3 -9.3-148.9 162.1 53.6 32.5 61.1 107 115 A G S S+ 0 0 5 -2,-0.3 23,-2.2 -45,-0.2 -45,-0.2 -0.052 118.1 19.5 50.6-141.2 50.5 32.2 63.3 108 116 A A E + h 0 130C 0 21,-0.2 -44,-2.4 1,-0.1 -45,-0.9 -0.303 54.7 163.8 -68.5 128.3 50.5 34.5 66.3 109 117 A V E +gh 64 131C 0 21,-1.8 23,-1.0 -46,-0.2 2,-0.4 -0.704 34.3 143.0-135.2 77.5 52.9 37.5 66.2 110 118 A I E > - 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0 0 98 -5,-1.8 -1,-0.2 0, 0.0 -2,-0.2 -0.923 53.8-141.8-130.6 148.8 49.0 48.4 79.7 141 149 A F - 0 0 142 -2,-0.4 2,-0.2 1,-0.1 -3,-0.0 -0.260 42.8 -86.7 -85.9 171.4 51.5 50.0 77.2 142 150 A V - 0 0 11 1,-0.1 -1,-0.1 -2,-0.1 3,-0.1 -0.574 36.6-179.6 -79.0 147.7 54.3 48.1 75.3 143 151 A G + 0 0 34 -2,-0.2 -55,-0.2 1,-0.0 -56,-0.2 0.167 63.8 78.3-132.4 16.5 57.7 47.7 77.2 144 152 A G S S- 0 0 0 -57,-0.1 -1,-0.0 -56,-0.1 -59,-0.0 -0.033 115.9 -84.2-121.4 23.3 59.7 45.8 74.6 145 153 A G S >> S+ 0 0 8 -3,-0.1 4,-2.5 4,-0.0 3,-1.8 0.326 91.8 124.8 96.2 -8.8 60.7 48.5 72.1 146 154 A G H 3> + 0 0 2 1,-0.3 4,-1.6 2,-0.2 -3,-0.0 0.822 67.7 57.2 -58.6 -35.7 57.5 48.4 70.1 147 155 A S H 34 S+ 0 0 51 1,-0.2 -1,-0.3 3,-0.2 12,-0.0 0.688 116.9 38.0 -73.3 -10.2 56.7 52.1 70.5 148 156 A V H <> S+ 0 0 75 -3,-1.8 4,-0.5 3,-0.1 -2,-0.2 0.818 124.5 33.4 -99.9 -48.7 60.1 52.8 68.9 149 157 A R H X S+ 0 0 23 -4,-2.5 4,-0.8 2,-0.1 3,-0.3 0.886 113.8 54.5 -82.2 -39.5 60.5 50.1 66.2 150 158 A L H >X>S+ 0 0 2 -4,-1.6 4,-2.6 -5,-0.3 3,-1.8 0.948 101.8 53.5 -69.5 -46.6 57.0 49.6 65.1 151 159 A P H 3>5S+ 0 0 26 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.830 104.6 59.5 -57.2 -26.4 56.0 53.1 64.1 152 160 A R H 3<5S+ 0 0 148 -4,-0.5 -2,-0.2 -3,-0.3 -3,-0.1 0.783 113.5 38.2 -70.3 -23.6 59.1 53.2 61.9 153 161 A L H <<5S+ 0 0 54 -3,-1.8 -1,-0.2 -4,-0.8 -3,-0.1 0.860 139.3 8.7 -87.0 -40.9 57.6 50.2 60.1 154 162 A I H <5S- 0 0 17 -4,-2.6 4,-0.5 1,-0.1 -2,-0.2 0.417 103.8-110.5-128.2 -4.7 53.9 51.1 59.9 155 163 A G X< - 0 0 32 -4,-1.8 4,-1.5 -5,-0.6 5,-0.1 0.148 31.1 -86.9 85.6 157.3 53.6 54.7 61.2 156 164 A V H > S+ 0 0 103 1,-0.2 4,-3.8 2,-0.2 5,-0.3 0.917 119.7 63.0 -66.3 -41.6 52.1 56.0 64.5 157 165 A A H > S+ 0 0 80 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.888 107.5 41.5 -52.9 -46.6 48.5 56.3 63.1 158 166 A R H > S+ 0 0 88 -4,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.841 116.8 49.5 -73.4 -33.3 48.2 52.5 62.5 159 167 A M H X S+ 0 0 9 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.916 109.1 51.0 -66.2 -47.4 50.0 51.6 65.8 160 168 A A H X S+ 0 0 40 -4,-3.8 4,-2.8 1,-0.2 5,-0.2 0.917 111.3 48.7 -59.4 -44.8 47.8 54.0 67.8 161 169 A D H X S+ 0 0 48 -4,-1.8 4,-2.0 -5,-0.3 6,-0.5 0.945 109.3 52.1 -61.2 -46.2 44.7 52.4 66.2 162 170 A M H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 5,-0.3 0.910 114.6 43.8 -54.2 -46.2 45.9 48.8 67.0 163 171 A M H < S+ 0 0 31 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.894 115.8 45.4 -69.3 -41.3 46.5 49.7 70.7 164 172 A L H < S+ 0 0 149 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.791 130.0 20.7 -74.7 -26.6 43.3 51.6 71.2 165 173 A T H < S- 0 0 95 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.505 96.4-117.1-120.0 -13.8 41.0 49.1 69.5 166 174 A G < - 0 0 36 -4,-2.0 -4,-0.2 -5,-0.3 -3,-0.2 0.742 47.0-177.7 77.0 24.6 42.8 45.7 69.5 167 175 A R - 0 0 97 -6,-0.5 -34,-0.4 -5,-0.3 2,-0.3 -0.333 11.7-150.4 -61.0 138.6 42.8 45.7 65.7 168 176 A V - 0 0 78 -36,-0.1 2,-0.4 -34,-0.0 -36,-0.2 -0.857 6.0-158.6-109.0 145.8 44.4 42.6 64.1 169 177 A Y E -I 131 0C 0 -38,-1.9 -38,-2.5 -2,-0.3 2,-0.1 -0.970 11.6-136.3-119.4 135.2 46.1 42.4 60.7 170 178 A S E > -I 130 0C 46 -2,-0.4 4,-2.7 -40,-0.2 -40,-0.2 -0.329 34.0-101.5 -74.0 172.1 46.7 39.3 58.6 171 179 A A H > S+ 0 0 0 -42,-1.2 4,-2.1 -44,-0.7 5,-0.2 0.920 124.3 51.7 -59.4 -45.1 50.0 38.5 56.8 172 180 A A H > S+ 0 0 57 -45,-0.3 4,-1.0 1,-0.2 -1,-0.2 0.961 113.6 42.2 -58.7 -56.0 48.4 39.8 53.5 173 181 A E H > S+ 0 0 77 1,-0.2 4,-1.7 2,-0.2 3,-0.5 0.914 113.3 56.9 -50.8 -41.5 47.3 43.1 55.0 174 182 A G H X>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.3 4,-1.9 0.868 97.2 56.6 -70.0 -35.8 50.6 43.3 56.9 175 183 A V H <5S+ 0 0 47 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.866 111.8 47.6 -63.8 -28.2 53.0 43.1 53.9 176 184 A V H <5S+ 0 0 120 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.869 113.1 44.8 -78.8 -38.6 51.1 46.2 52.6 177 185 A H H <5S- 0 0 45 -4,-1.7 -2,-0.2 -19,-0.0 -1,-0.2 0.638 123.4 -97.0 -85.3 -12.1 51.2 48.2 55.8 178 186 A G T <5S+ 0 0 24 -4,-1.9 -3,-0.2 2,-0.2 -4,-0.1 0.483 86.3 123.1 117.6 6.3 54.8 47.5 56.5 179 187 A F S - 0 0 34 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.643 22.4-155.5-117.9 132.2 57.1 28.2 54.5 189 197 A A H > S+ 0 0 0 -2,-0.4 4,-3.6 1,-0.2 5,-0.2 0.907 103.8 57.6 -60.4 -36.4 58.4 31.4 56.0 190 198 A Y H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.938 106.3 47.4 -57.6 -50.2 61.3 29.3 57.5 191 199 A D H > S+ 0 0 102 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.948 116.2 44.2 -57.9 -50.5 62.3 28.1 54.0 192 200 A K H X S+ 0 0 51 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.944 112.5 51.8 -60.3 -45.2 62.2 31.6 52.6 193 201 A A H X S+ 0 0 0 -4,-3.6 4,-2.3 1,-0.3 -1,-0.2 0.882 109.2 51.7 -63.5 -36.7 64.0 33.1 55.6 194 202 A L H X S+ 0 0 25 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.3 0.879 107.5 49.7 -72.1 -37.0 66.7 30.6 55.2 195 203 A E H X S+ 0 0 103 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.919 111.5 50.8 -66.1 -35.2 67.2 31.3 51.5 196 204 A L H X S+ 0 0 15 -4,-2.7 4,-2.5 2,-0.2 5,-0.3 0.911 108.4 52.3 -60.8 -41.0 67.4 35.0 52.5 197 205 A G H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.936 108.3 50.4 -64.9 -42.2 70.0 34.2 55.2 198 206 A N H < S+ 0 0 70 -4,-2.4 4,-0.3 2,-0.2 -1,-0.2 0.869 112.2 49.6 -58.9 -33.9 72.1 32.3 52.6 199 207 A R H >< S+ 0 0 128 -4,-1.6 3,-2.0 2,-0.2 4,-0.3 0.962 110.7 45.2 -72.4 -51.1 71.9 35.4 50.3 200 208 A V H >< S+ 0 0 19 -4,-2.5 3,-2.2 1,-0.3 -1,-0.2 0.829 101.7 72.9 -60.2 -27.2 72.9 38.0 52.9 201 209 A A T 3< S+ 0 0 6 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.722 89.2 58.9 -59.4 -22.0 75.7 35.6 53.8 202 210 A Q T < S+ 0 0 118 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.609 85.2 106.7 -83.4 -15.0 77.4 36.5 50.6 203 211 A N S < S- 0 0 39 -3,-2.2 -3,-0.0 -4,-0.3 0, 0.0 -0.284 78.4-107.1 -67.4 148.9 77.7 40.2 51.5 204 212 A A >> - 0 0 11 1,-0.1 4,-1.7 38,-0.0 3,-1.4 -0.473 32.5-116.3 -66.4 147.0 81.0 41.9 52.5 205 213 A P H 3> S+ 0 0 97 0, 0.0 4,-2.8 0, 0.0 -1,-0.1 0.841 115.1 56.1 -59.3 -35.9 81.1 42.6 56.3 206 214 A L H 3> S+ 0 0 47 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.677 102.0 57.3 -72.6 -19.0 81.3 46.4 55.7 207 215 A T H <> S+ 0 0 63 -3,-1.4 4,-2.7 2,-0.2 5,-0.3 0.958 108.7 45.6 -73.2 -49.4 78.1 46.1 53.7 208 216 A N H X S+ 0 0 14 -4,-1.7 4,-2.7 1,-0.2 5,-0.5 0.918 113.5 51.3 -54.0 -44.9 76.4 44.6 56.7 209 217 A F H X>S+ 0 0 106 -4,-2.8 4,-2.3 1,-0.2 5,-1.5 0.956 113.1 42.7 -56.4 -52.0 77.9 47.3 58.8 210 218 A A H <>S+ 0 0 21 -4,-2.1 5,-3.6 3,-0.2 -2,-0.2 0.908 121.5 40.7 -63.8 -42.1 76.8 50.2 56.6 211 219 A V H <5S+ 0 0 74 -4,-2.7 -1,-0.2 3,-0.2 -2,-0.2 0.943 120.7 39.0 -75.9 -47.1 73.3 48.9 56.1 212 220 A L H <5S+ 0 0 16 -4,-2.7 -2,-0.2 -5,-0.3 -3,-0.2 0.881 134.5 14.0 -74.5 -37.4 72.5 47.5 59.6 213 221 A Q T X5S+ 0 0 28 -4,-2.3 4,-1.0 -5,-0.5 -3,-0.2 0.868 129.1 38.6-106.9 -48.6 74.0 50.3 61.6 214 222 A A H > S+ 0 0 49 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.921 115.8 47.0 -51.4 -43.4 69.2 53.8 60.1 217 225 A M H X S+ 0 0 100 -4,-1.0 4,-1.0 1,-0.2 -2,-0.2 0.893 112.6 47.1 -66.3 -45.5 71.2 56.6 61.7 218 226 A I H >< S+ 0 0 27 -4,-2.9 3,-0.7 1,-0.2 -1,-0.2 0.935 110.1 54.1 -59.1 -44.3 71.8 58.4 58.4 219 227 A A H 3< S+ 0 0 73 -4,-2.8 -2,-0.2 -5,-0.3 -1,-0.2 0.841 112.9 41.6 -66.8 -28.5 68.1 58.2 57.5 220 228 A E H 3< S+ 0 0 118 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.539 96.3 99.4 -97.0 -7.7 66.9 59.8 60.8 221 229 A A S << S- 0 0 31 -4,-1.0 -3,-0.0 -3,-0.7 6,-0.0 -0.303 94.1 -86.9 -66.9 160.6 69.6 62.4 60.8 222 230 A N > - 0 0 49 1,-0.1 4,-2.6 4,-0.0 5,-0.3 -0.408 52.4-107.4 -59.2 146.5 68.9 65.9 59.7 223 231 A P H > S+ 0 0 92 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.883 114.8 49.4 -55.4 -48.6 69.5 65.8 55.9 224 232 A Q H > S+ 0 0 109 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.902 116.8 45.4 -58.3 -39.9 72.8 67.8 55.6 225 233 A T H > S+ 0 0 67 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 111.4 48.9 -70.1 -42.7 74.2 65.6 58.3 226 234 A G H X S+ 0 0 4 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.905 110.9 55.5 -65.6 -32.3 72.9 62.2 57.0 227 235 A L H X S+ 0 0 106 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.909 108.1 43.0 -71.2 -46.9 74.4 63.2 53.7 228 236 A L H X S+ 0 0 116 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.919 113.9 53.5 -61.0 -39.1 77.9 63.9 54.8 229 237 A M H X S+ 0 0 67 -4,-2.2 4,-3.1 1,-0.2 5,-0.2 0.879 106.5 53.5 -62.9 -39.0 77.7 60.7 56.9 230 238 A E H X S+ 0 0 110 -4,-2.5 4,-3.2 2,-0.2 -1,-0.2 0.950 107.1 50.0 -61.1 -48.0 76.7 58.8 53.7 231 239 A S H X S+ 0 0 70 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.915 113.2 48.0 -58.9 -39.9 79.7 60.2 51.8 232 240 A L H X S+ 0 0 103 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.942 113.1 44.7 -67.4 -48.9 81.9 59.1 54.7 233 241 A M H X S+ 0 0 30 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.887 114.0 54.3 -57.1 -35.0 80.4 55.5 55.0 234 242 A A H X S+ 0 0 50 -4,-3.2 4,-2.6 -5,-0.2 -2,-0.2 0.882 107.2 46.6 -70.0 -41.7 80.6 55.3 51.2 235 243 A T H X S+ 0 0 69 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.845 112.8 49.2 -72.3 -33.6 84.2 56.0 50.9 236 244 A V H X S+ 0 0 74 -4,-1.7 4,-0.7 2,-0.2 3,-0.2 0.949 113.4 46.9 -69.6 -48.6 85.3 53.7 53.6 237 245 A A H >< S+ 0 0 26 -4,-2.4 3,-1.1 1,-0.2 6,-0.3 0.933 115.2 45.9 -57.3 -48.2 83.2 50.9 52.2 238 246 A Q H 3< S+ 0 0 113 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.717 109.3 53.6 -73.4 -21.0 84.5 51.5 48.7 239 247 A S H 3< S+ 0 0 59 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.615 86.4 110.2 -95.6 2.1 88.1 51.8 49.7 240 248 A D S XX S- 0 0 64 -3,-1.1 4,-1.9 -4,-0.7 3,-0.7 -0.418 75.8-122.0 -76.7 144.2 88.1 48.4 51.5 241 249 A Q H 3> S+ 0 0 126 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.836 111.5 54.3 -57.1 -41.1 90.0 45.4 50.2 242 250 A E H 3> S+ 0 0 70 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.877 109.3 49.5 -57.6 -42.2 86.9 43.1 50.0 243 251 A A H <> S+ 0 0 25 -3,-0.7 4,-2.2 -6,-0.3 -2,-0.2 0.889 112.0 47.5 -61.8 -40.2 85.2 45.8 47.9 244 252 A K H X S+ 0 0 95 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.823 108.7 54.5 -71.4 -32.4 88.2 46.1 45.5 245 253 A T H X S+ 0 0 68 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.934 109.8 46.9 -67.3 -46.9 88.5 42.4 45.2 246 254 A R H X S+ 0 0 109 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.881 111.9 49.7 -63.0 -43.4 84.8 42.2 44.1 247 255 A I H X S+ 0 0 107 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.827 109.9 52.8 -64.6 -34.1 85.2 45.1 41.6 248 256 A R H X S+ 0 0 160 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.967 112.8 43.5 -60.0 -55.7 88.3 43.3 40.2 249 257 A A H X S+ 0 0 61 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.808 111.8 53.8 -60.4 -35.6 86.3 40.1 39.7 250 258 A F H X S+ 0 0 137 -4,-2.1 4,-1.0 1,-0.2 3,-0.2 0.913 114.4 40.3 -66.4 -42.7 83.3 41.9 38.2 251 259 A L H X S+ 0 0 92 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.608 112.0 56.9 -81.0 -15.1 85.4 43.7 35.6 252 260 A D H < S+ 0 0 86 -4,-1.3 -1,-0.2 2,-0.2 4,-0.2 0.638 105.5 51.7 -86.4 -21.6 87.6 40.5 34.8 253 261 A H H X S+ 0 0 114 -4,-0.9 4,-1.4 -3,-0.2 -2,-0.2 0.772 108.0 48.8 -87.1 -32.5 84.5 38.5 34.0 254 262 A K H X S+ 0 0 121 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.828 113.4 48.6 -72.5 -32.3 83.1 41.0 31.5 255 263 A T H < S+ 0 0 107 -4,-0.8 -2,-0.2 2,-0.2 -1,-0.2 0.559 108.7 54.3 -82.2 -13.8 86.6 41.1 29.8 256 264 A A H 4 S+ 0 0 76 -4,-0.2 -2,-0.2 0, 0.0 -1,-0.2 0.811 115.2 40.7 -76.1 -39.4 86.6 37.3 29.9 257 265 A K H < 0 0 152 -4,-1.4 -2,-0.2 0, 0.0 -3,-0.1 0.982 360.0 360.0 -73.2 -62.0 83.2 37.5 28.0 258 266 A V < 0 0 165 -4,-2.6 -3,-0.1 -5,-0.1 -4,-0.0 0.777 360.0 360.0 21.5 360.0 83.8 40.4 25.4 259 !* 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 0.0 260 11 B T 0 0 135 0, 0.0 2,-0.5 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 123.0 43.0 72.3 94.4 261 12 B I - 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q 0 389F 24 -46,-2.2 3,-2.8 -2,-0.3 23,-0.2 -0.909 50.2 -33.0-137.1 136.6 66.2 76.2 95.4 368 119 B G T 3> S+ 0 0 4 21,-2.5 4,-2.5 -2,-0.3 3,-0.4 -0.162 134.5 5.8 55.6-125.0 64.4 73.2 93.9 369 120 B G H 3> S+ 0 0 4 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.771 130.3 63.2 -65.8 -20.2 61.1 74.1 92.5 370 121 B G H <> S+ 0 0 0 -3,-2.8 4,-2.5 2,-0.2 -1,-0.3 0.912 106.4 43.2 -63.6 -46.3 62.0 77.7 93.3 371 122 B L H > S+ 0 0 3 -3,-0.4 4,-2.8 18,-0.3 -2,-0.2 0.900 111.7 54.5 -68.0 -37.8 64.9 77.4 90.8 372 123 B E H X S+ 0 0 8 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.915 109.1 49.2 -62.9 -34.1 62.5 75.6 88.4 373 124 B L H >X S+ 0 0 2 -4,-2.1 3,-1.1 1,-0.2 4,-1.0 0.953 109.4 49.5 -70.7 -46.5 60.2 78.6 88.7 374 125 B A H >< S+ 0 0 0 -4,-2.5 3,-0.6 1,-0.3 -1,-0.2 0.888 108.1 57.7 -57.1 -39.3 63.0 81.1 88.1 375 126 B C H 3< S+ 0 0 11 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.776 97.7 58.7 -58.4 -32.3 64.0 78.9 85.0 376 127 B A H << S+ 0 0 3 -3,-1.1 -1,-0.2 -4,-1.0 -2,-0.2 0.831 91.0 88.5 -74.6 -23.9 60.6 79.3 83.4 377 128 B A S << S- 0 0 5 -4,-1.0 -18,-0.2 -3,-0.6 3,-0.1 -0.192 78.6-130.3 -69.5 160.9 61.0 83.1 83.4 378 129 B H S S+ 0 0 40 -20,-2.0 2,-0.4 1,-0.2 -19,-0.2 0.906 89.7 22.6 -78.9 -45.5 62.6 84.9 80.3 379 130 B I E -m 359 0D 35 -21,-1.9 -19,-2.6 58,-0.0 2,-0.4 -0.975 68.6-159.7-125.3 136.3 65.1 87.1 82.2 380 131 B R E -m 360 0D 9 -2,-0.4 59,-1.7 -21,-0.2 58,-1.0 -0.966 1.2-164.8-114.8 134.8 66.5 86.6 85.8 381 132 B V E -mn 361 439D 0 -21,-2.8 -19,-3.4 -2,-0.4 2,-0.5 -0.981 13.1-159.2-116.5 119.5 68.0 89.4 87.8 382 133 B A E -mn 362 440D 0 57,-2.0 59,-3.2 -2,-0.5 2,-0.2 -0.921 8.2-152.8-110.6 132.0 70.0 88.2 90.7 383 134 B E E > - 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0 0 101 -5,-1.2 -1,-0.2 -6,-0.1 -2,-0.2 -0.870 44.7-152.0-112.5 123.8 63.6 62.7 94.3 398 149 B F - 0 0 136 -2,-0.4 2,-0.3 1,-0.1 -3,-0.0 -0.249 40.8 -82.4 -76.9 178.6 64.3 63.8 90.7 399 150 B V + 0 0 12 1,-0.1 -1,-0.1 -2,-0.1 3,-0.1 -0.646 41.7 177.7 -82.9 144.2 63.0 67.2 89.5 400 151 B G + 0 0 31 -2,-0.3 -55,-0.3 1,-0.1 -56,-0.1 0.284 63.4 76.7-124.9 9.7 59.3 67.4 88.4 401 152 B G S S- 0 0 0 -57,-0.1 -1,-0.1 -56,-0.0 -59,-0.0 -0.021 115.3 -84.6-114.3 29.2 59.0 71.1 87.6 402 153 B G S >> S+ 0 0 6 -3,-0.1 4,-2.8 4,-0.0 3,-1.9 0.279 91.4 124.5 88.8 -7.3 60.6 71.4 84.2 403 154 B G H 3> + 0 0 1 1,-0.3 4,-2.1 2,-0.2 -3,-0.0 0.882 67.4 58.6 -60.7 -32.9 64.1 71.8 85.5 404 155 B S H 34 S+ 0 0 54 1,-0.2 -1,-0.3 2,-0.2 12,-0.0 0.719 117.4 33.0 -71.4 -18.0 65.5 68.9 83.5 405 156 B V H <> S+ 0 0 80 -3,-1.9 4,-0.6 3,-0.1 -1,-0.2 0.779 126.1 38.3 -99.0 -43.7 64.5 70.6 80.3 406 157 B R H X S+ 0 0 28 -4,-2.8 4,-0.7 2,-0.1 -3,-0.2 0.890 111.4 51.4 -80.2 -44.9 64.9 74.3 81.2 407 158 B L H >X S+ 0 0 2 -4,-2.1 4,-2.9 -5,-0.3 3,-0.7 0.866 103.6 55.8 -72.0 -35.0 68.0 74.5 83.4 408 159 B P H 3> S+ 0 0 27 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.885 102.7 59.5 -62.3 -31.5 70.4 72.6 81.0 409 160 B R H 3< S+ 0 0 150 -4,-0.6 -2,-0.2 1,-0.2 -3,-0.1 0.796 115.6 34.5 -62.7 -26.6 69.5 75.2 78.4 410 161 B L H << S+ 0 0 53 -4,-0.7 -1,-0.2 -3,-0.7 -3,-0.1 0.809 139.5 12.1 -92.1 -35.4 70.9 77.9 80.7 411 162 B I H < S- 0 0 6 -4,-2.9 4,-0.4 25,-0.1 -2,-0.2 0.478 102.2-108.7-127.9 -6.0 73.7 76.0 82.4 412 163 B G X - 0 0 32 -4,-2.4 4,-1.4 -5,-0.4 3,-0.1 0.215 31.2 -90.8 85.5 147.5 74.5 72.8 80.5 413 164 B V H > S+ 0 0 102 1,-0.2 4,-3.7 2,-0.2 5,-0.3 0.875 118.9 60.3 -55.6 -45.0 73.8 69.2 81.7 414 165 B A H > S+ 0 0 80 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.907 106.3 44.4 -64.5 -43.2 77.2 68.6 83.3 415 166 B R H > S+ 0 0 100 -4,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.894 117.3 47.7 -66.2 -36.0 76.8 71.5 85.9 416 167 B M H X S+ 0 0 10 -4,-1.4 4,-2.7 2,-0.2 5,-0.3 0.948 108.8 52.3 -66.6 -51.6 73.2 70.4 86.6 417 168 B A H X S+ 0 0 40 -4,-3.7 4,-2.6 1,-0.2 -1,-0.2 0.911 110.4 49.2 -49.7 -46.0 74.1 66.8 87.0 418 169 B D H X S+ 0 0 46 -4,-2.0 4,-2.6 -5,-0.3 6,-0.5 0.955 109.7 51.6 -59.1 -47.0 76.8 67.8 89.5 419 170 B M H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -29,-0.3 0.893 113.9 44.8 -53.7 -45.7 74.3 69.9 91.5 420 171 B M H < S+ 0 0 34 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.908 116.2 44.5 -73.7 -38.5 71.9 67.0 91.6 421 172 B L H < S+ 0 0 151 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.831 128.8 22.1 -73.7 -31.0 74.5 64.4 92.6 422 173 B T H < S- 0 0 92 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.452 96.9-116.3-119.8 -6.1 76.4 66.4 95.2 423 174 B G < - 0 0 37 -4,-1.8 -4,-0.2 -5,-0.4 -3,-0.1 0.615 49.2-178.6 78.4 12.2 74.0 69.1 96.5 424 175 B R - 0 0 109 -6,-0.5 2,-0.4 -5,-0.1 -34,-0.4 -0.169 12.7-150.5 -50.5 134.4 76.4 71.7 95.2 425 176 B V - 0 0 81 -36,-0.1 2,-0.4 -3,-0.1 -36,-0.2 -0.879 5.2-156.4-108.5 137.2 75.3 75.2 95.8 426 177 B Y E -R 388 0F 3 -38,-2.2 -38,-2.7 -2,-0.4 2,-0.1 -0.936 11.0-136.6-110.2 140.3 76.1 78.3 93.6 427 178 B S E > -R 387 0F 39 -2,-0.4 4,-3.2 -40,-0.2 -40,-0.2 -0.361 31.5-105.7 -79.1 165.3 76.1 82.0 94.7 428 179 B A H > S+ 0 0 0 -42,-1.6 4,-1.9 -44,-0.6 9,-0.1 0.921 122.3 53.1 -54.8 -44.5 74.6 84.7 92.6 429 180 B A H > S+ 0 0 60 -45,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.883 114.2 40.0 -65.1 -41.5 78.1 85.9 91.6 430 181 B E H >> S+ 0 0 91 1,-0.2 4,-1.8 2,-0.1 3,-0.7 0.938 112.9 60.8 -67.8 -40.9 79.1 82.3 90.4 431 182 B G H 3X>S+ 0 0 0 -4,-3.2 5,-2.1 1,-0.3 4,-1.5 0.784 94.9 57.0 -60.1 -35.5 75.7 82.0 88.9 432 183 B V H 3<5S+ 0 0 45 -4,-1.9 -1,-0.3 4,-0.2 3,-0.2 0.897 109.3 46.6 -67.4 -37.3 75.9 84.9 86.5 433 184 B V H <<5S+ 0 0 113 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.939 113.6 48.8 -68.5 -38.9 79.0 83.5 84.8 434 185 B H H <5S- 0 0 51 -4,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.641 122.3 -98.4 -78.6 -18.1 77.5 79.9 84.6 435 186 B G T <5S+ 0 0 23 -4,-1.5 -3,-0.2 2,-0.3 -4,-0.1 0.431 86.2 121.7 119.1 2.2 74.2 81.0 83.1 436 187 B F S - 0 0 40 -2,-0.2 4,-1.7 1,-0.1 5,-0.2 -0.784 23.3-156.6-110.4 121.3 67.9 95.5 94.7 446 197 B A H > S+ 0 0 1 -2,-0.5 4,-3.1 1,-0.2 5,-0.2 0.877 98.1 58.1 -49.4 -43.8 66.9 92.8 92.2 447 198 B Y H > S+ 0 0 67 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.941 105.4 48.0 -56.5 -49.4 63.3 94.0 92.3 448 199 B D H > S+ 0 0 95 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.901 114.1 46.4 -57.7 -47.9 64.1 97.6 91.3 449 200 B K H X S+ 0 0 61 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.919 111.2 51.6 -63.9 -44.6 66.3 96.4 88.4 450 201 B A H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 -2,-0.2 0.909 109.5 51.6 -57.7 -40.1 63.6 93.9 87.3 451 202 B L H X S+ 0 0 27 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.903 109.0 49.4 -64.7 -40.8 61.1 96.8 87.3 452 203 B E H X S+ 0 0 126 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.943 113.1 47.3 -60.3 -45.8 63.5 98.9 85.2 453 204 B L H X S+ 0 0 19 -4,-2.6 4,-3.4 2,-0.2 5,-0.3 0.878 109.1 54.6 -59.2 -39.1 63.8 96.0 82.8 454 205 B G H X S+ 0 0 0 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.925 109.6 47.4 -62.0 -45.0 60.0 95.6 82.9 455 206 B N H < S+ 0 0 67 -4,-2.5 4,-0.3 2,-0.2 -1,-0.2 0.829 113.2 49.2 -67.0 -32.1 59.6 99.2 81.9 456 207 B R H >< S+ 0 0 129 -4,-2.0 3,-1.9 1,-0.2 -2,-0.2 0.956 111.3 45.7 -72.4 -50.2 62.2 98.8 79.1 457 208 B V H >< S+ 0 0 19 -4,-3.4 3,-1.9 1,-0.3 -2,-0.2 0.780 100.9 72.4 -66.7 -17.8 60.7 95.7 77.5 458 209 B A T 3< S+ 0 0 9 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.688 88.0 61.7 -69.6 -14.7 57.3 97.4 77.8 459 210 B Q T < S+ 0 0 120 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.489 84.0 111.9 -85.1 -7.1 58.3 99.7 75.0 460 211 B N S < S- 0 0 41 -3,-1.9 -3,-0.0 -4,-0.2 -4,-0.0 -0.323 77.1-107.8 -74.4 153.9 58.7 96.8 72.5 461 212 B A >> - 0 0 10 1,-0.1 4,-1.4 -2,-0.0 3,-0.7 -0.540 32.8-120.5 -69.7 145.6 56.5 96.1 69.6 462 213 B P H 3> S+ 0 0 95 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.824 114.0 56.6 -60.7 -32.5 54.3 93.1 70.3 463 214 B L H 3> S+ 0 0 45 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.810 99.7 59.3 -72.2 -29.0 55.7 91.2 67.4 464 215 B T H <> S+ 0 0 59 -3,-0.7 4,-2.7 2,-0.2 5,-0.2 0.954 107.6 47.2 -51.8 -53.6 59.1 91.7 68.9 465 216 B N H X>S+ 0 0 17 -4,-1.4 4,-3.1 1,-0.2 5,-0.5 0.915 111.8 49.2 -57.4 -51.5 57.9 89.8 71.9 466 217 B F H X>S+ 0 0 104 -4,-2.4 4,-2.8 1,-0.2 5,-1.5 0.946 113.9 45.6 -52.4 -53.0 56.3 87.1 69.9 467 218 B A H <>S+ 0 0 19 -4,-2.7 5,-2.8 3,-0.2 -2,-0.2 0.891 119.9 38.7 -65.8 -37.6 59.5 86.6 67.8 468 219 B V H <5S+ 0 0 75 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.921 123.1 38.9 -83.6 -32.8 61.9 86.6 70.7 469 220 B L H <5S+ 0 0 18 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.882 133.3 17.0 -84.7 -40.4 59.7 84.7 73.2 470 221 B Q T X> S+ 0 0 52 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.900 116.5 45.1 -65.4 -27.7 64.0 79.3 71.2 474 225 B M H < S+ 0 0 29 -4,-3.0 3,-0.9 1,-0.2 -1,-0.2 0.946 111.0 50.9 -54.9 -45.8 64.7 78.6 65.6 476 227 B A H 3< S+ 0 0 75 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.806 112.3 46.9 -66.8 -28.3 67.8 78.1 67.8 477 228 B E H 3< S+ 0 0 114 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.599 96.5 94.5 -93.5 -7.4 66.9 74.5 68.5 478 229 B A S << S- 0 0 34 -4,-1.1 -3,-0.0 -3,-0.9 6,-0.0 -0.195 94.6 -78.5 -78.6 163.7 66.1 73.5 64.9 479 230 B N >> - 0 0 39 1,-0.1 4,-3.0 4,-0.1 3,-0.6 -0.367 55.1-114.9 -51.3 136.1 68.3 71.9 62.2 480 231 B P H 3> S+ 0 0 76 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.898 115.0 51.1 -56.4 -37.5 70.3 74.9 61.1 481 232 B Q H 3> S+ 0 0 79 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.882 113.8 46.8 -63.2 -37.9 68.8 74.9 57.6 482 233 B T H <> S+ 0 0 78 -3,-0.6 4,-2.8 2,-0.2 -1,-0.2 0.911 112.2 48.4 -63.6 -47.0 65.4 74.8 59.1 483 234 B G H X S+ 0 0 3 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.894 108.9 55.0 -63.9 -38.8 66.1 77.6 61.7 484 235 B L H X S+ 0 0 109 -4,-2.9 4,-2.2 -5,-0.3 -1,-0.2 0.935 111.3 42.5 -62.9 -43.3 67.6 79.8 59.0 485 236 B L H X S+ 0 0 113 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.925 113.6 52.8 -69.3 -43.1 64.4 79.6 56.8 486 237 B M H X S+ 0 0 65 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.898 108.2 53.5 -58.2 -35.4 62.2 80.0 59.8 487 238 B E H X S+ 0 0 106 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.949 105.5 50.3 -65.8 -43.6 64.3 83.1 60.6 488 239 B S H X S+ 0 0 67 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.890 113.0 49.0 -64.6 -32.2 63.8 84.7 57.2 489 240 B L H X S+ 0 0 102 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.929 112.6 44.4 -70.4 -48.5 60.1 84.1 57.6 490 241 B M H X S+ 0 0 33 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.894 115.6 50.2 -58.9 -41.2 59.8 85.6 61.2 491 242 B A H X S+ 0 0 50 -4,-2.8 4,-2.9 -5,-0.2 5,-0.2 0.878 109.4 49.0 -67.5 -43.1 62.0 88.5 60.2 492 243 B T H X S+ 0 0 74 -4,-2.2 4,-1.4 -5,-0.2 -1,-0.2 0.903 113.3 47.2 -67.8 -38.8 60.0 89.4 57.1 493 244 B V H X S+ 0 0 74 -4,-2.0 4,-0.7 2,-0.2 3,-0.2 0.955 114.5 46.3 -62.5 -54.9 56.8 89.3 59.0 494 245 B A H >< S+ 0 0 31 -4,-2.8 3,-1.1 1,-0.2 6,-0.3 0.938 114.9 47.1 -46.6 -56.0 58.2 91.4 61.8 495 246 B Q H 3< S+ 0 0 106 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.788 111.0 51.6 -59.5 -31.3 59.7 94.0 59.4 496 247 B S H 3< S+ 0 0 66 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.596 85.7 111.5 -94.1 -5.3 56.6 94.2 57.3 497 248 B D S S+ 0 0 163 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.872 111.8 55.0 -54.1 -48.8 52.8 98.4 60.7 499 250 B E H > S+ 0 0 65 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.852 108.5 50.0 -52.5 -41.1 54.4 99.1 64.1 500 251 B A H > S+ 0 0 32 -3,-0.3 4,-2.1 -6,-0.3 -2,-0.2 0.901 110.8 48.1 -71.6 -35.7 57.8 98.3 62.5 501 252 B K H X S+ 0 0 88 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.867 111.8 50.1 -68.5 -34.0 57.2 100.7 59.7 502 253 B T H X S+ 0 0 85 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.919 113.4 45.5 -71.5 -42.1 56.0 103.4 62.2 503 254 B R H X S+ 0 0 108 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.799 113.2 50.6 -66.3 -36.0 59.2 102.9 64.3 504 255 B I H X S+ 0 0 102 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.884 114.3 44.2 -65.0 -43.7 61.4 102.9 61.1 505 256 B R H X S+ 0 0 143 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.947 110.5 51.7 -73.2 -50.7 59.8 106.1 59.8 506 257 B A H X S+ 0 0 63 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.922 115.5 42.3 -47.2 -59.2 59.8 108.1 63.2 507 258 B F H < S+ 0 0 179 -4,-1.4 3,-0.5 1,-0.2 -1,-0.2 0.932 118.1 46.6 -49.3 -54.7 63.5 107.4 63.7 508 259 B L H < S+ 0 0 120 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.812 107.1 57.3 -62.5 -34.4 64.3 108.1 59.9 509 260 B D H < 0 0 109 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 0.783 360.0 360.0 -67.2 -31.3 62.2 111.4 59.9 510 261 B H < 0 0 221 -4,-1.2 -2,-0.2 -3,-0.5 -3,-0.1 0.549 360.0 360.0 120.9 360.0 64.4 112.6 62.8