==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-APR-13 4KAC . COMPND 2 MOLECULE: HALOALKANE DEHALOGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOCOCCUS SP.; . AUTHOR A.KUZIN,S.LEW,T.K.NEKLESA,D.NOBLIN,J.SEETHARAMAN,M.MAGLAQUI, . 584 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22888.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 404 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 11.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 0.7 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 . 37 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 87 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.7 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 7 1 2 1 3 0 3 2 2 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 0 4 0 0 4 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 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 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 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 14 A E 0 0 212 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -8.5 32.2 7.4 18.3 2 15 A I - 0 0 27 272,-0.1 46,-0.0 275,-0.0 272,-0.0 -0.924 360.0-109.0 -91.1 114.7 29.5 6.3 15.9 3 16 A G - 0 0 32 -2,-0.7 45,-0.1 1,-0.1 44,-0.0 -0.116 33.9-175.4 -51.2 134.3 26.4 7.9 17.4 4 17 A T + 0 0 51 43,-0.1 -1,-0.1 44,-0.0 182,-0.1 0.593 56.3 97.3-105.7 -19.3 23.9 5.6 19.0 5 18 A G - 0 0 40 1,-0.1 178,-0.0 2,-0.0 177,-0.0 -0.229 61.0-151.0 -68.9 158.4 21.3 8.3 19.7 6 19 A F + 0 0 50 2,-0.0 2,-1.6 42,-0.0 -1,-0.1 -0.724 18.5 177.5-129.6 79.0 18.3 9.1 17.5 7 20 A P + 0 0 107 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 -0.388 36.1 118.0 -85.5 59.9 17.7 12.9 18.1 8 21 A F - 0 0 27 -2,-1.6 17,-0.1 17,-0.0 -2,-0.0 -0.987 65.6-118.9-126.6 137.4 14.8 13.4 15.7 9 22 A D - 0 0 82 -2,-0.4 15,-0.4 15,-0.1 2,-0.2 -0.509 38.8-110.3 -70.3 138.2 11.3 14.5 16.6 10 23 A P - 0 0 22 0, 0.0 2,-0.4 0, 0.0 13,-0.1 -0.487 34.2-170.9 -70.0 133.2 8.7 11.9 15.6 11 24 A H E -A 22 0A 44 11,-1.1 11,-2.4 -2,-0.2 2,-0.4 -0.966 0.8-168.2-120.2 146.2 6.3 12.7 12.7 12 25 A Y E -A 21 0A 70 -2,-0.4 2,-0.4 9,-0.2 9,-0.2 -0.995 4.5-173.8-133.8 135.8 3.3 10.6 11.8 13 26 A V E -A 20 0A 27 7,-2.0 7,-2.5 -2,-0.4 2,-0.6 -0.993 30.0-117.0-129.8 141.0 1.1 10.8 8.7 14 27 A E E +A 19 0A 113 -2,-0.4 2,-0.5 5,-0.2 5,-0.2 -0.667 38.6 175.0 -76.7 114.9 -2.0 8.8 8.0 15 28 A V E > -A 18 0A 3 3,-3.5 3,-1.9 -2,-0.6 74,-0.1 -0.983 66.2 -24.9-128.3 118.8 -1.5 6.6 5.0 16 29 A L T 3 S- 0 0 92 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.875 126.7 -48.6 46.0 46.6 -4.1 4.1 3.8 17 30 A G T 3 S+ 0 0 55 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.560 123.5 94.1 76.2 8.3 -5.7 3.9 7.3 18 31 A E E < S-A 15 0A 46 -3,-1.9 -3,-3.5 53,-0.1 2,-0.5 -0.943 74.4-119.5-128.5 151.7 -2.4 3.4 9.1 19 32 A R E -A 14 0A 78 -2,-0.3 52,-2.7 -5,-0.2 2,-0.5 -0.796 25.7-161.8 -89.3 131.8 0.0 5.8 10.8 20 33 A X E -A 13 0A 2 -7,-2.5 -7,-2.0 -2,-0.5 2,-0.3 -0.962 9.7-140.7-114.3 131.0 3.5 5.9 9.3 21 34 A H E +A 12 0A 3 -2,-0.5 42,-3.0 42,-0.2 2,-0.3 -0.650 28.0 168.5 -88.9 143.8 6.4 7.4 11.3 22 35 A Y E -AB 11 62A 27 -11,-2.4 -11,-1.1 -2,-0.3 2,-0.3 -0.999 35.4-117.5-154.7 150.7 9.1 9.4 9.6 23 36 A V E + B 0 61A 0 38,-2.5 38,-1.8 -2,-0.3 2,-0.3 -0.701 29.3 178.9 -83.3 140.0 12.0 11.8 10.2 24 37 A D E + B 0 60A 13 -15,-0.4 2,-0.2 -2,-0.3 36,-0.2 -0.758 18.6 141.5-146.3 98.1 11.6 15.3 8.8 25 38 A V E + B 0 59A 34 34,-1.9 34,-2.9 -2,-0.3 -17,-0.0 -0.726 33.6 45.6-130.2 177.5 14.5 17.8 9.3 26 39 A G S S- 0 0 28 32,-0.3 32,-0.2 -2,-0.2 28,-0.1 -0.319 101.9 -2.4 82.3-171.9 16.3 20.6 7.4 27 40 A P - 0 0 50 0, 0.0 32,-0.1 0, 0.0 29,-0.0 -0.123 67.8-127.6 -46.6 148.6 14.6 23.4 5.4 28 41 A R S S+ 0 0 134 30,-0.1 2,-0.2 29,-0.0 -2,-0.0 0.573 85.9 24.3 -84.7 -9.3 10.8 23.1 5.3 29 42 A D S S+ 0 0 124 2,-0.1 29,-0.3 3,-0.0 2,-0.1 -0.827 82.2 67.5-142.0-179.2 10.6 23.3 1.5 30 43 A G S S- 0 0 54 -2,-0.2 27,-0.0 27,-0.1 0, 0.0 -0.248 96.0 -21.3 91.2 173.8 12.7 22.7 -1.6 31 44 A T S S- 0 0 47 -2,-0.1 27,-0.5 67,-0.1 2,-0.2 -0.337 71.8-145.9 -55.8 122.1 13.9 19.4 -3.1 32 45 A P - 0 0 6 0, 0.0 67,-2.0 0, 0.0 2,-0.6 -0.592 8.8-129.6 -88.7 154.4 13.9 16.8 -0.3 33 46 A V E -cd 59 99A 0 25,-2.9 27,-2.8 -2,-0.2 2,-0.7 -0.931 25.1-151.5 -98.0 119.9 16.3 13.9 0.2 34 47 A L E -cd 60 100A 0 65,-3.4 67,-2.5 -2,-0.6 2,-0.6 -0.864 4.7-157.0-100.9 115.2 14.3 10.8 0.7 35 48 A F E - d 0 101A 0 25,-3.0 2,-0.6 -2,-0.7 67,-0.2 -0.818 8.7-171.2 -96.0 120.1 16.0 8.1 2.8 36 49 A L E - d 0 102A 2 65,-2.3 67,-1.6 -2,-0.6 70,-0.2 -0.935 3.7-165.1-116.7 111.4 14.7 4.5 2.3 37 50 A H - 0 0 0 -2,-0.6 2,-0.1 25,-0.5 6,-0.1 -0.378 4.3-157.2 -84.9 169.5 15.9 1.8 4.6 38 51 A G > + 0 0 0 1,-0.2 3,-1.6 67,-0.2 66,-0.1 -0.149 40.8 4.1-120.4-142.6 15.6 -1.9 4.0 39 52 A N T 3 S- 0 0 2 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.637 118.4 -5.3 -92.8 150.2 15.5 -5.1 6.1 40 53 A P T 3 S+ 0 0 2 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 -0.436 115.6 77.0-104.0 58.3 15.6 -5.4 9.1 41 54 A T < - 0 0 2 -3,-1.6 27,-0.3 26,-0.0 2,-0.3 -0.066 52.3-153.7-114.7-155.8 16.1 -1.8 9.9 42 55 A S > - 0 0 11 25,-0.1 3,-2.1 -3,-0.1 4,-0.2 -0.855 57.9 -58.3-164.9-170.3 14.2 1.5 10.1 43 56 A S G > S+ 0 0 2 1,-0.3 3,-2.2 -2,-0.3 4,-0.3 0.752 120.0 81.9 -60.0 -22.1 15.0 5.2 9.8 44 57 A Y G > S+ 0 0 6 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.784 77.8 69.7 -47.8 -30.4 17.4 4.6 12.7 45 58 A L G < S+ 0 0 2 -3,-2.1 3,-0.3 1,-0.3 -1,-0.3 0.774 100.7 44.9 -64.4 -27.0 19.8 3.3 10.0 46 59 A W G X> S+ 0 0 0 -3,-2.2 4,-2.6 -4,-0.2 3,-1.8 0.377 78.2 109.4 -98.0 3.0 20.2 6.9 8.7 47 60 A R T <4 S+ 0 0 3 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.1 0.778 85.9 39.0 -52.4 -31.0 20.6 8.6 12.1 48 61 A N T 34 S+ 0 0 29 -3,-0.3 -1,-0.3 -4,-0.2 233,-0.1 0.479 117.2 50.0 -99.7 -2.8 24.3 9.3 11.5 49 62 A I T X> S+ 0 0 0 -3,-1.8 3,-2.1 2,-0.1 4,-0.6 0.832 98.0 64.5 -99.1 -46.3 23.9 10.2 7.8 50 63 A I H >X S+ 0 0 1 -4,-2.6 4,-2.9 1,-0.3 3,-1.8 0.849 90.8 64.3 -47.6 -45.8 21.1 12.7 8.0 51 64 A P H 34 S+ 0 0 73 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.650 100.5 54.1 -60.1 -12.0 23.0 15.3 10.0 52 65 A H H <4 S+ 0 0 64 -3,-2.1 -2,-0.2 2,-0.1 4,-0.1 0.669 118.2 33.5 -88.4 -20.8 25.4 15.8 7.0 53 66 A V H XX S+ 0 0 0 -3,-1.8 3,-1.7 -4,-0.6 4,-1.7 0.776 101.9 73.9-104.8 -38.2 22.6 16.5 4.6 54 67 A A T 3< S+ 0 0 17 -4,-2.9 -2,-0.1 1,-0.3 5,-0.1 0.611 82.9 69.1 -60.1 -20.9 20.1 18.3 6.7 55 68 A P T 34 S+ 0 0 104 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.848 118.9 19.8 -62.8 -30.5 22.0 21.6 6.9 56 69 A S T <4 S+ 0 0 69 -3,-1.7 2,-0.3 1,-0.2 -2,-0.2 0.600 126.4 39.3-111.8 -18.3 21.3 22.2 3.2 57 70 A H S < S- 0 0 46 -4,-1.7 -1,-0.2 -27,-0.0 2,-0.1 -0.985 80.1-103.9-143.2 141.2 18.3 20.0 2.4 58 71 A R - 0 0 38 -27,-0.5 -25,-2.9 -2,-0.3 2,-0.5 -0.456 41.3-153.0 -56.9 130.3 15.0 18.8 3.7 59 72 A C E -Bc 25 33A 0 -34,-2.9 -34,-1.9 -27,-0.2 2,-0.4 -0.962 14.3-176.1-113.8 132.2 15.6 15.2 4.9 60 73 A I E +Bc 24 34A 0 -27,-2.8 -25,-3.0 -2,-0.5 -36,-0.2 -0.984 6.2 172.4-128.6 124.8 12.7 12.7 5.0 61 74 A A E -B 23 0A 0 -38,-1.8 -38,-2.5 -2,-0.4 -25,-0.1 -0.835 11.9-166.2-138.8 98.0 13.1 9.2 6.3 62 75 A P E -B 22 0A 1 0, 0.0 2,-0.6 0, 0.0 -25,-0.5 -0.422 23.4-125.7 -77.2 152.4 10.0 7.0 6.8 63 76 A D - 0 0 3 -42,-3.0 -42,-0.2 -21,-0.1 3,-0.1 -0.919 40.0-116.5 -88.8 121.4 9.8 3.8 8.6 64 77 A L > - 0 0 2 -2,-0.6 3,-2.2 1,-0.2 6,-0.3 -0.173 47.1 -74.8 -54.3 151.8 8.4 1.3 6.1 65 78 A I T 3 S+ 0 0 2 1,-0.3 -1,-0.2 17,-0.2 7,-0.1 -0.238 122.1 15.8 -56.7 132.8 5.0 -0.1 7.0 66 79 A G T 3 S+ 0 0 2 5,-1.9 2,-0.3 1,-0.3 -1,-0.3 0.517 115.0 89.9 82.0 6.3 5.2 -2.7 9.8 67 80 A X S X S- 0 0 0 -3,-2.2 3,-2.3 4,-0.2 -1,-0.3 -0.859 83.3 -6.3-132.8 166.0 8.7 -1.6 10.7 68 81 A G T 3 S- 0 0 9 -27,-0.3 -26,-0.1 -2,-0.3 -5,-0.0 -0.225 127.7 -26.1 51.4-130.4 10.3 1.0 13.0 69 82 A K T 3 S+ 0 0 83 -48,-0.1 -1,-0.3 -4,-0.0 -47,-0.1 0.335 108.3 116.1 -96.9 8.7 7.7 3.1 14.6 70 83 A S S < S- 0 0 5 -3,-2.3 -50,-0.2 -6,-0.3 -6,-0.1 -0.315 76.7 -86.1 -74.1 160.7 5.1 2.7 11.8 71 84 A D - 0 0 45 -52,-2.7 -5,-1.9 1,-0.1 -4,-0.2 -0.177 33.8-130.9 -59.6 159.9 1.8 0.9 12.4 72 85 A K - 0 0 79 -7,-0.1 -1,-0.1 -6,-0.1 -7,-0.0 -0.652 27.6-176.0-119.4 74.7 1.6 -2.9 12.2 73 86 A P - 0 0 13 0, 0.0 2,-1.9 0, 0.0 -55,-0.0 -0.285 40.8-102.6 -65.0 154.6 -1.3 -3.9 9.9 74 87 A D S S+ 0 0 169 2,-0.0 2,-0.3 3,-0.0 -2,-0.0 -0.582 71.9 140.9 -80.0 79.6 -2.2 -7.6 9.5 75 88 A L - 0 0 36 -2,-1.9 123,-0.0 1,-0.1 0, 0.0 -0.755 66.3-121.3-116.6 166.4 -0.7 -7.8 6.0 76 89 A D - 0 0 99 -2,-0.3 126,-0.1 126,-0.0 -1,-0.1 0.638 43.1-139.8 -78.3 -15.2 1.3 -10.5 4.2 77 90 A Y + 0 0 10 1,-0.1 -3,-0.0 125,-0.1 5,-0.0 0.808 37.1 167.9 56.4 37.2 4.0 -7.8 3.8 78 91 A F >> - 0 0 68 1,-0.1 4,-1.5 127,-0.0 3,-0.6 -0.257 55.8-100.8 -61.7 164.4 5.0 -8.8 0.3 79 92 A F H 3> S+ 0 0 2 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.894 127.3 60.5 -55.7 -37.8 7.2 -6.4 -1.5 80 93 A D H 3> S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.857 99.0 54.7 -60.0 -34.3 4.0 -5.2 -3.2 81 94 A D H <> S+ 0 0 18 -3,-0.6 4,-2.0 1,-0.2 -1,-0.2 0.926 108.3 50.1 -61.6 -41.2 2.6 -4.3 0.2 82 95 A H H X S+ 0 0 1 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.870 108.7 52.4 -65.3 -35.7 5.6 -2.1 0.7 83 96 A V H X S+ 0 0 10 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.926 108.7 49.2 -62.4 -49.5 5.2 -0.5 -2.7 84 97 A R H X S+ 0 0 90 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.934 114.8 44.3 -58.7 -49.3 1.5 0.5 -2.1 85 98 A Y H X S+ 0 0 17 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.856 115.0 46.6 -67.5 -37.9 2.3 2.0 1.3 86 99 A L H X S+ 0 0 4 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.948 111.2 51.7 -71.3 -47.1 5.4 3.9 0.2 87 100 A D H X S+ 0 0 40 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.899 113.5 46.0 -47.6 -44.8 3.7 5.3 -3.0 88 101 A A H X S+ 0 0 28 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.839 110.3 53.2 -74.2 -32.0 0.9 6.5 -0.7 89 102 A F H X S+ 0 0 0 -4,-1.8 4,-1.1 2,-0.2 -2,-0.2 0.927 107.5 50.9 -65.3 -46.2 3.3 8.0 1.8 90 103 A I H ><>S+ 0 0 2 -4,-2.8 5,-2.2 1,-0.2 3,-0.5 0.926 114.2 44.0 -58.5 -44.5 5.1 10.0 -0.8 91 104 A E H ><5S+ 0 0 106 -4,-1.8 3,-0.6 1,-0.2 -1,-0.2 0.786 105.8 61.5 -70.3 -29.7 1.8 11.4 -2.1 92 105 A A H 3<5S+ 0 0 50 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.733 108.4 43.9 -70.9 -21.8 0.5 12.1 1.4 93 106 A L T <<5S- 0 0 30 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.460 111.2-128.6 -95.9 -6.9 3.4 14.4 1.9 94 107 A G T < 5 + 0 0 56 -3,-0.6 2,-0.2 -4,-0.2 -3,-0.2 0.911 41.2 178.8 57.0 44.8 2.7 15.8 -1.5 95 108 A L < + 0 0 9 -5,-2.2 -1,-0.2 1,-0.1 3,-0.1 -0.576 11.1 176.8 -76.9 139.6 6.4 15.3 -2.6 96 109 A E + 0 0 158 1,-0.5 2,-0.3 -2,-0.2 -1,-0.1 0.666 61.8 12.7-105.9 -93.2 7.2 16.3 -6.1 97 110 A E S S+ 0 0 94 24,-0.1 -1,-0.5 25,-0.0 2,-0.3 -0.701 76.4 174.9 -85.5 140.4 10.9 16.1 -7.2 98 111 A V E - e 0 121A 0 22,-2.5 24,-2.7 -2,-0.3 25,-0.5 -0.917 32.8-133.9-137.0 164.7 13.2 14.1 -4.8 99 112 A V E -de 33 123A 4 -67,-2.0 -65,-3.4 -2,-0.3 2,-0.4 -0.972 31.5-142.8-110.0 137.6 16.7 12.8 -4.4 100 113 A L E -de 34 124A 1 23,-2.3 25,-3.1 -2,-0.4 2,-0.5 -0.848 20.5-175.7-106.6 138.2 16.8 9.2 -3.2 101 114 A V E +de 35 125A 0 -67,-2.5 -65,-2.3 -2,-0.4 2,-0.3 -0.968 31.3 173.4-124.8 110.3 19.3 7.7 -0.7 102 115 A I E -de 36 126A 0 23,-2.6 25,-0.9 -2,-0.5 2,-0.3 -0.860 22.9-172.6-133.5 156.5 18.4 4.0 -0.6 103 116 A H E > - e 0 127A 0 -67,-1.6 3,-2.1 -2,-0.3 4,-0.4 -0.998 53.7 -36.2-150.0 139.0 19.5 0.7 0.7 104 117 A D E >> S+ e 0 129A 8 24,-1.2 4,-1.6 23,-0.9 3,-1.2 -0.178 132.0 1.5 53.0-126.8 18.5 -3.1 0.4 105 118 A W H 3> S+ 0 0 4 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.790 133.3 62.1 -64.4 -24.2 14.7 -3.5 0.0 106 119 A G H <> S+ 0 0 0 -3,-2.1 4,-3.1 2,-0.2 -1,-0.3 0.819 101.9 51.4 -65.2 -30.3 14.6 0.3 0.2 107 120 A S H <> S+ 0 0 0 -3,-1.2 4,-3.1 -4,-0.4 5,-0.4 0.897 107.0 51.1 -74.3 -37.9 16.7 0.3 -3.0 108 121 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.933 115.4 44.2 -60.0 -43.7 14.2 -2.1 -4.6 109 122 A L H X S+ 0 0 4 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.928 115.3 47.9 -64.2 -45.8 11.6 0.4 -3.6 110 123 A G H X S+ 0 0 0 -4,-3.1 4,-3.0 2,-0.2 -2,-0.2 0.936 115.2 42.7 -62.4 -51.4 13.6 3.4 -4.7 111 124 A F H X S+ 0 0 1 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.877 114.7 51.2 -64.2 -39.5 14.5 2.1 -8.1 112 125 A H H X S+ 0 0 21 -4,-2.0 4,-1.5 -5,-0.4 -2,-0.2 0.908 114.3 43.9 -65.1 -40.6 11.0 0.7 -8.7 113 126 A W H X S+ 0 0 5 -4,-2.5 4,-1.4 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A I B -h 209 0B 22 75,-3.3 77,-3.5 1,-0.2 78,-0.4 -0.901 5.7-158.5-102.4 107.1 21.1 -13.5 -7.9 134 147 A P - 0 0 75 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.825 67.9 -3.0 -57.4 -40.1 21.3 -16.1 -10.7 135 148 A T > - 0 0 56 75,-0.1 3,-1.3 74,-0.1 4,-0.4 -0.967 66.4-110.3-147.5 162.7 22.2 -19.0 -8.4 136 149 A W G > S+ 0 0 55 -2,-0.3 3,-1.2 1,-0.2 -1,-0.1 0.740 110.9 78.1 -62.7 -21.5 23.0 -19.9 -4.8 137 150 A D G 3 S+ 0 0 135 1,-0.3 -1,-0.2 3,-0.0 4,-0.1 0.843 93.9 47.2 -53.7 -35.9 26.5 -20.4 -6.1 138 151 A E G < S+ 0 0 122 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.2 0.561 89.2 98.8 -86.4 -11.4 27.0 -16.6 -6.1 139 152 A W S < S- 0 0 13 -3,-1.2 5,-0.1 -4,-0.4 105,-0.1 -0.666 91.5-100.2 -79.9 127.6 25.5 -16.1 -2.6 140 153 A P > - 0 0 40 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.264 26.4-133.1 -56.9 128.5 28.4 -15.8 -0.1 141 154 A E G >> S+ 0 0 122 1,-0.3 3,-1.6 2,-0.2 4,-0.7 0.811 97.4 70.6 -50.6 -43.4 29.0 -19.1 1.7 142 155 A F G 34 S+ 0 0 92 1,-0.3 -1,-0.3 2,-0.1 4,-0.1 0.730 118.5 21.2 -52.3 -23.2 29.2 -17.7 5.3 143 156 A A G <> S+ 0 0 4 -3,-1.9 4,-2.3 2,-0.1 -1,-0.3 0.279 96.8 99.5-128.0 10.3 25.5 -17.0 5.1 144 157 A R H <> S+ 0 0 72 -3,-1.6 4,-2.4 -4,-0.4 5,-0.2 0.963 86.5 42.8 -66.7 -52.9 24.3 -19.4 2.4 145 158 A E H X S+ 0 0 147 -4,-0.7 4,-1.9 1,-0.2 -1,-0.2 0.874 114.8 53.9 -60.7 -36.4 22.9 -22.2 4.6 146 159 A T H > S+ 0 0 53 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.940 111.4 41.9 -63.5 -49.7 21.3 -19.5 6.8 147 160 A F H X S+ 0 0 27 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.847 111.4 55.2 -72.5 -30.5 19.4 -17.7 4.1 148 161 A Q H < S+ 0 0 73 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.899 110.2 47.7 -64.5 -39.6 18.4 -21.0 2.4 149 162 A A H >< S+ 0 0 26 -4,-1.9 3,-0.8 -5,-0.2 7,-0.3 0.899 107.7 55.9 -63.5 -42.4 16.9 -22.0 5.8 150 163 A F H 3< S+ 0 0 2 -4,-2.2 2,-1.0 1,-0.3 -2,-0.2 0.887 97.9 66.0 -53.5 -39.9 15.2 -18.6 6.0 151 164 A R T 3< S+ 0 0 43 -4,-1.8 2,-0.3 -5,-0.1 -1,-0.3 -0.172 85.4 89.2 -86.3 42.9 13.6 -19.3 2.7 152 165 A T S < S- 0 0 44 -2,-1.0 5,-0.4 -3,-0.8 53,-0.0 -0.957 72.4-135.6-130.5 154.7 11.4 -22.1 3.9 153 166 A A S S+ 0 0 69 -2,-0.3 4,-0.2 3,-0.2 -1,-0.1 0.790 101.6 33.9 -78.7 -26.8 7.9 -22.0 5.4 154 167 A D S > S+ 0 0 114 3,-0.1 4,-1.7 2,-0.1 5,-0.1 0.939 129.7 24.7 -92.3 -71.5 8.7 -24.5 8.2 155 168 A V H > S+ 0 0 58 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.896 122.4 56.3 -62.2 -41.8 12.3 -24.0 9.4 156 169 A G H > S+ 0 0 0 -7,-0.3 4,-2.7 1,-0.2 5,-0.3 0.874 108.3 44.6 -61.4 -43.0 12.5 -20.4 8.1 157 170 A R H >>S+ 0 0 83 -5,-0.4 4,-2.0 2,-0.2 5,-1.6 0.857 112.3 53.4 -70.7 -35.9 9.5 -19.2 10.2 158 171 A E H <>S+ 0 0 83 -4,-1.7 5,-1.1 3,-0.2 -2,-0.2 0.929 114.7 42.1 -64.3 -43.7 10.7 -21.1 13.2 159 172 A L H X5S+ 0 0 38 -4,-2.7 6,-2.3 3,-0.2 4,-0.5 0.977 125.8 30.2 -62.7 -58.0 14.1 -19.3 12.9 160 173 A I H <5S+ 0 0 0 -4,-2.7 4,-0.3 4,-0.2 6,-0.2 0.879 131.0 28.5 -78.6 -43.3 12.9 -15.8 12.1 161 174 A I T <5S+ 0 0 17 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.1 0.949 129.9 33.4 -84.4 -53.5 9.6 -15.5 13.8 162 175 A D T 4> + 0 0 11 -4,-0.3 4,-2.8 -6,-0.2 3,-0.8 0.805 48.0 158.3 51.3 34.4 14.0 -13.7 16.1 165 178 A A H 3>> + 0 0 20 -6,-2.3 5,-1.8 1,-0.3 4,-1.6 0.735 62.8 60.7 -62.9 -28.7 17.1 -15.0 14.2 166 179 A F H 34>S+ 0 0 15 -6,-0.2 5,-1.6 3,-0.2 -1,-0.3 0.879 116.2 33.5 -66.7 -34.6 17.0 -12.2 11.6 167 180 A I H <45S+ 0 0 0 -3,-0.8 -2,-0.2 -7,-0.2 -1,-0.1 0.919 126.9 36.9 -83.8 -50.2 17.5 -9.6 14.4 168 181 A E H <5S+ 0 0 85 -4,-2.8 -3,-0.2 -5,-0.1 -2,-0.2 0.738 134.7 20.2 -77.7 -22.6 19.7 -11.5 16.9 169 182 A G T X5S+ 0 0 37 -4,-1.6 4,-1.3 -5,-0.4 -3,-0.2 0.837 124.9 35.7-110.8 -64.1 21.7 -13.3 14.2 170 183 A A H >44 S+ 0 0 46 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.823 113.8 58.8 -68.8 -23.7 25.0 -8.0 13.7 173 186 A X H 3< S+ 0 0 76 -4,-1.3 -2,-0.2 1,-0.2 -3,-0.1 0.741 96.8 63.2 -69.5 -22.6 26.6 -10.4 11.2 174 187 A G T << S+ 0 0 7 -4,-1.2 97,-2.3 -3,-1.2 96,-2.2 0.390 96.7 69.5 -83.5 5.1 25.8 -7.8 8.5 175 188 A V < - 0 0 7 -3,-1.1 4,-0.1 95,-0.2 97,-0.1 -0.979 69.4-148.1-126.7 136.4 28.1 -5.2 10.1 176 189 A V S S+ 0 0 70 -2,-0.4 -1,-0.1 95,-0.2 92,-0.1 0.961 85.4 52.2 -68.2 -53.7 31.9 -5.3 10.4 177 190 A R S S- 0 0 47 97,-0.1 2,-0.5 1,-0.1 -2,-0.1 -0.379 105.9 -91.5 -75.6 162.8 32.4 -3.6 13.7 178 191 A P - 0 0 115 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.666 37.3-128.4 -82.5 124.9 30.4 -4.9 16.7 179 192 A L - 0 0 22 -2,-0.5 2,-0.2 -7,-0.2 -4,-0.0 -0.370 28.1-120.4 -60.5 141.6 26.9 -3.2 17.1 180 193 A T > - 0 0 60 1,-0.1 4,-3.0 -2,-0.0 5,-0.2 -0.533 18.6-111.9 -84.1 158.1 26.5 -2.0 20.7 181 194 A E H > S+ 0 0 149 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.875 120.0 55.8 -52.4 -41.6 23.6 -3.2 23.0 182 195 A V H > S+ 0 0 76 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.926 110.2 43.9 -58.7 -44.3 22.1 0.3 22.7 183 196 A E H > S+ 0 0 1 -3,-0.2 4,-1.7 1,-0.2 3,-0.3 0.940 112.9 52.0 -67.3 -46.5 22.1 0.1 18.9 184 197 A X H X S+ 0 0 14 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.879 105.6 55.6 -54.5 -42.3 20.7 -3.5 19.0 185 198 A D H X S+ 0 0 83 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.872 104.7 52.0 -64.7 -37.8 17.9 -2.4 21.3 186 199 A H H < S+ 0 0 60 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.892 115.2 43.4 -59.6 -40.0 16.8 0.3 18.9 187 200 A Y H < S+ 0 0 3 -4,-1.7 -2,-0.2 1,-0.2 4,-0.2 0.753 114.3 48.9 -77.3 -29.1 16.7 -2.4 16.2 188 201 A R H >< S+ 0 0 50 -4,-2.4 3,-1.5 -5,-0.2 -1,-0.2 0.727 91.5 86.7 -76.9 -23.9 15.0 -5.0 18.4 189 202 A E G >< S+ 0 0 96 -4,-1.4 3,-1.1 1,-0.3 -1,-0.2 0.842 85.9 45.6 -54.5 -49.6 12.4 -2.6 19.5 190 203 A P G 3 S+ 0 0 18 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.705 116.8 48.9 -66.1 -15.8 9.8 -3.0 16.7 191 204 A F G < + 0 0 1 -3,-1.5 -2,-0.2 -4,-0.2 6,-0.1 0.038 66.0 119.0-116.6 29.6 10.1 -6.8 16.9 192 205 A L S < S+ 0 0 124 -3,-1.1 -1,-0.2 4,-0.1 -3,-0.1 0.868 71.3 61.8 -64.0 -35.3 9.8 -7.6 20.6 193 206 A K S > S- 0 0 132 -3,-0.2 3,-2.4 1,-0.1 4,-0.2 -0.819 80.9-139.0 -96.7 127.3 6.6 -9.7 20.0 194 207 A P G > S+ 0 0 58 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.840 103.2 66.5 -49.3 -34.7 7.0 -12.8 17.8 195 208 A V G > S+ 0 0 111 1,-0.3 3,-0.7 2,-0.1 -33,-0.0 0.806 95.1 56.7 -58.4 -29.6 3.7 -11.8 16.2 196 209 A D G < S+ 0 0 38 -3,-2.4 -1,-0.3 1,-0.2 4,-0.2 0.355 84.7 84.5 -88.0 7.5 5.2 -8.6 14.8 197 210 A R G X> + 0 0 20 -3,-1.9 4,-0.9 1,-0.2 3,-0.7 0.364 51.5 107.0 -96.7 5.9 8.0 -10.4 12.8 198 211 A E H X> S+ 0 0 37 -3,-0.7 4,-2.2 1,-0.2 3,-1.3 0.906 79.4 51.0 -48.0 -49.8 6.0 -11.3 9.7 199 212 A P H 3> S+ 0 0 2 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.830 104.5 59.3 -63.4 -27.5 7.8 -8.7 7.5 200 213 A L H <4 S+ 0 0 0 -3,-0.7 -2,-0.2 1,-0.2 -3,-0.1 0.706 111.4 40.3 -68.5 -25.5 11.2 -10.0 8.7 201 214 A W H < S+ 0 0 0 -4,-1.8 3,-1.3 -5,-0.3 4,-0.5 0.912 103.3 42.5 -55.5 -52.1 11.4 -10.1 3.0 204 217 A P H >4 S+ 0 0 2 0, 0.0 3,-0.7 0, 0.0 -1,-0.2 0.816 111.1 59.7 -64.8 -24.8 14.2 -12.7 2.6 205 218 A N H 3< S+ 0 0 28 -4,-1.0 -2,-0.2 1,-0.2 -3,-0.1 0.593 101.9 54.3 -76.8 -8.2 11.6 -14.9 0.9 206 219 A E T << S+ 0 0 3 -3,-1.3 -1,-0.2 -4,-0.6 -3,-0.1 0.501 77.6 121.2 -98.7 -9.1 11.2 -12.2 -1.7 207 220 A L S < S- 0 0 13 -3,-0.7 2,-1.5 -4,-0.5 5,-0.2 -0.326 72.5-119.7 -56.4 133.3 14.9 -12.0 -2.6 208 221 A P + 0 0 3 0, 0.0 -75,-3.3 0, 0.0 2,-0.4 -0.606 55.2 153.4 -77.8 91.1 15.3 -12.7 -6.4 209 222 A I B > -hI 133 212B 2 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-3,-0.4 5,-1.8 2,-0.2 4,-1.4 0.845 110.9 54.0 -79.2 -36.5 10.1 42.1 44.3 451 171 B E H <>S+ 0 0 96 -4,-2.1 5,-1.7 3,-0.2 -2,-0.2 0.936 116.6 40.2 -58.7 -44.9 8.7 44.2 47.1 452 172 B L H <5S+ 0 0 43 -4,-2.8 6,-2.8 3,-0.2 -2,-0.2 0.958 127.3 28.6 -68.9 -54.1 5.5 42.1 46.9 453 173 B I H <5S+ 0 0 0 -4,-2.6 4,-0.4 4,-0.3 6,-0.3 0.925 130.4 30.2 -82.4 -45.8 6.9 38.6 46.4 454 174 B I T <5S+ 0 0 13 -4,-1.4 -3,-0.2 -5,-0.3 -2,-0.1 0.983 129.8 31.1 -75.1 -63.9 10.3 38.7 48.2 455 175 B D T + 0 0 12 -4,-0.4 4,-2.9 -6,-0.2 3,-0.5 0.881 46.7 160.7 53.4 43.1 5.8 37.0 50.6 458 178 B A H >> + 0 0 17 -6,-2.8 5,-2.1 1,-0.2 4,-1.3 0.670 62.7 61.8 -74.5 -17.9 2.8 37.9 48.5 459 179 B F H 4>S+ 0 0 14 -6,-0.3 5,-1.3 3,-0.2 -1,-0.2 0.866 117.1 32.9 -71.8 -33.0 2.9 34.9 46.2 460 180 B I H 45S+ 0 0 0 -3,-0.5 -2,-0.2 -7,-0.2 -1,-0.1 0.920 128.5 35.9 -85.8 -48.4 2.4 32.7 49.4 461 181 B E H <5S+ 0 0 84 -4,-2.9 -3,-0.2 -5,-0.1 -2,-0.1 0.806 135.1 18.6 -77.0 -27.8 0.2 35.1 51.5 462 182 B G T X5S+ 0 0 29 -4,-1.3 4,-1.3 -5,-0.3 -3,-0.2 0.873 123.8 38.4-106.9 -64.4 -1.8 36.5 48.6 463 183 B A H >44 S+ 0 0 49 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.855 112.7 60.5 -60.8 -33.3 -5.4 31.5 48.6 466 186 B X H 3< S+ 0 0 58 -4,-1.3 -2,-0.2 1,-0.3 -3,-0.1 0.751 98.8 56.2 -63.6 -28.8 -6.6 33.4 45.6 467 187 B G T << S+ 0 0 7 -4,-1.2 97,-2.7 -3,-0.8 96,-2.1 0.334 98.4 72.3 -90.4 8.9 -6.0 30.4 43.4 468 188 B V < - 0 0 6 -3,-1.4 4,-0.1 95,-0.2 97,-0.1 -0.991 68.0-149.6-126.0 126.1 -8.2 28.1 45.5 469 189 B V S S+ 0 0 71 -2,-0.4 -1,-0.2 95,-0.1 92,-0.1 0.946 86.7 53.2 -53.5 -55.5 -12.1 28.4 45.6 470 190 B R S S- 0 0 52 1,-0.1 2,-0.4 97,-0.0 -2,-0.1 -0.424 103.5 -96.2 -77.8 158.6 -12.3 27.1 49.2 471 191 B P - 0 0 114 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.631 35.7-127.0 -76.3 126.6 -10.3 28.8 52.0 472 192 B L - 0 0 21 -2,-0.4 2,-0.1 -4,-0.1 -4,-0.0 -0.509 28.3-123.3 -67.0 141.1 -7.0 27.0 52.8 473 193 B T > - 0 0 64 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.370 21.3-106.6 -81.8 167.6 -6.8 26.3 56.5 474 194 B E H > S+ 0 0 123 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.849 120.3 54.7 -64.4 -37.9 -3.9 27.4 58.7 475 195 B V H > S+ 0 0 76 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.919 111.7 46.1 -59.6 -42.4 -2.4 24.0 58.9 476 196 B E H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.938 111.1 50.8 -67.1 -49.7 -2.4 23.9 55.1 477 197 B X H X S+ 0 0 10 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.887 106.7 55.7 -51.4 -45.3 -0.9 27.4 54.8 478 198 B D H X S+ 0 0 82 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.882 104.7 52.3 -61.1 -40.0 1.9 26.5 57.2 479 199 B H H < S+ 0 0 60 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.901 113.8 43.9 -60.8 -42.5 2.9 23.6 55.0 480 200 B Y H < S+ 0 0 3 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.791 113.7 51.3 -71.4 -29.8 3.1 25.9 52.0 481 201 B R H >< S+ 0 0 44 -4,-2.5 3,-2.7 -5,-0.2 -2,-0.2 0.856 88.1 87.7 -71.4 -35.0 4.9 28.7 54.1 482 202 B E G >< S+ 0 0 79 -4,-2.1 3,-1.0 1,-0.3 -1,-0.2 0.749 86.7 44.5 -39.4 -51.1 7.6 26.3 55.3 483 203 B P G 3 S+ 0 0 11 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.640 115.5 49.5 -74.3 -8.6 10.2 26.5 52.5 484 204 B F G < + 0 0 1 -3,-2.7 -2,-0.2 -4,-0.2 6,-0.1 -0.027 65.1 117.4-124.5 28.6 9.9 30.3 52.3 485 205 B L S < S+ 0 0 130 -3,-1.0 -1,-0.1 4,-0.1 -3,-0.1 0.818 70.8 66.3 -65.1 -34.6 10.3 31.5 55.9 486 206 B K S > S- 0 0 134 -3,-0.2 3,-1.5 1,-0.1 4,-0.2 -0.823 82.9-139.2 -89.6 126.0 13.5 33.4 54.9 487 207 B P G > S+ 0 0 67 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.846 101.2 59.2 -46.0 -41.6 12.9 36.3 52.5 488 208 B V G > S+ 0 0 110 1,-0.3 3,-0.8 2,-0.1 -33,-0.0 0.753 96.5 61.0 -70.1 -20.2 16.0 35.4 50.6 489 209 B D G < S+ 0 0 35 -3,-1.5 -1,-0.3 1,-0.2 4,-0.2 0.421 84.4 81.5 -84.0 1.3 14.7 31.9 49.7 490 210 B R G X> + 0 0 25 -3,-1.7 4,-0.7 1,-0.2 3,-0.6 0.366 58.0 104.6 -90.4 4.6 11.7 33.4 47.9 491 211 B E H X> S+ 0 0 38 -3,-0.8 4,-2.2 1,-0.2 3,-1.2 0.872 75.0 54.4 -51.6 -45.4 13.7 34.0 44.7 492 212 B P H 3> S+ 0 0 2 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.860 103.9 58.5 -61.4 -31.9 12.2 31.1 42.8 493 213 B L H <4 S+ 0 0 0 -3,-0.6 -2,-0.2 -4,-0.2 -3,-0.1 0.684 110.1 41.5 -68.1 -22.4 8.7 32.5 43.6 494 214 B W H X S+ 0 0 0 -4,-1.7 3,-1.7 1,-0.2 4,-0.6 0.897 100.7 42.5 -59.6 -53.9 8.6 32.2 37.9 497 217 B P T 34 S+ 0 0 3 0, 0.0 3,-0.4 0, 0.0 -1,-0.2 0.778 111.8 59.3 -64.8 -21.7 5.7 34.6 37.0 498 218 B N T 3< S+ 0 0 31 -4,-1.0 -2,-0.2 -3,-0.2 -3,-0.1 0.578 102.2 54.6 -77.8 -8.8 8.4 36.6 35.2 499 219 B E T <4 S+ 0 0 5 -3,-1.7 -1,-0.2 -4,-0.4 -3,-0.1 0.596 79.5 119.5 -93.9 -15.3 8.9 33.5 33.1 500 220 B L S < S- 0 0 20 -4,-0.6 2,-1.7 -3,-0.4 10,-0.1 -0.193 75.2-113.5 -54.5 139.4 5.3 33.1 32.0 501 221 B P + 0 0 2 0, 0.0 -75,-3.0 0, 0.0 2,-0.6 -0.547 55.1 158.1 -78.9 85.5 4.8 33.3 28.2 502 222 B I B > -qR 426 505D 6 3,-2.0 3,-1.3 -2,-1.7 -73,-0.1 -0.929 66.5 -23.4-120.4 112.7 2.8 36.5 28.0 503 223 B A T 3 S- 0 0 54 -77,-2.3 -1,-0.2 -2,-0.6 -75,-0.1 0.864 124.7 -49.8 57.7 41.8 2.7 38.6 24.8 504 224 B G T 3 S+ 0 0 45 1,-0.2 -1,-0.3 -78,-0.2 6,-0.2 0.176 100.3 144.8 92.1 -18.9 5.9 37.2 23.4 505 225 B E B < +R 502 0D 129 -3,-1.3 -3,-2.0 1,-0.2 -1,-0.2 -0.891 58.7 30.0-114.5 140.9 8.1 37.7 26.5 506 226 B P S >> S- 0 0 29 0, 0.0 4,-2.4 0, 0.0 3,-1.0 0.507 81.8-157.5 -77.7 140.4 10.3 36.1 27.5 507 227 B A H 3> S+ 0 0 75 1,-0.3 4,-2.7 2,-0.2 5,-0.1 0.781 87.9 52.2 -58.2 -36.2 11.0 35.0 24.0 508 228 B N H 3> S+ 0 0 99 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.788 111.0 46.8 -72.7 -30.1 12.9 31.8 24.9 509 229 B I H <> S+ 0 0 2 -3,-1.0 4,-2.5 2,-0.2 5,-0.2 0.923 113.3 49.0 -75.4 -43.4 10.0 30.6 27.1 510 230 B V H X S+ 0 0 15 -4,-2.4 4,-2.6 -6,-0.2 5,-0.2 0.953 112.2 49.4 -55.8 -52.2 7.4 31.4 24.4 511 231 B A H X S+ 0 0 54 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.925 113.7 44.9 -50.1 -52.2 9.6 29.6 21.9 512 232 B L H X S+ 0 0 36 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.845 113.7 49.1 -66.3 -37.0 9.9 26.5 24.1 513 233 B V H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.891 108.3 53.2 -71.8 -39.9 6.3 26.4 25.1 514 234 B E H X S+ 0 0 94 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.918 107.1 54.7 -60.3 -39.9 5.1 26.7 21.5 515 235 B A H X S+ 0 0 33 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.918 110.6 43.2 -62.3 -44.6 7.3 23.8 20.6 516 236 B Y H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.851 111.6 53.6 -72.5 -32.2 5.8 21.5 23.2 517 237 B X H X S+ 0 0 12 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.854 109.5 49.9 -64.5 -36.6 2.2 22.6 22.4 518 238 B N H X S+ 0 0 94 -4,-2.1 4,-0.9 -5,-0.2 -2,-0.2 0.888 111.5 48.5 -68.7 -39.6 2.9 21.7 18.8 519 239 B W H >X S+ 0 0 19 -4,-1.9 4,-1.4 -5,-0.2 3,-0.6 0.925 111.0 50.8 -62.3 -41.9 4.2 18.3 19.9 520 240 B L H 3< S+ 0 0 1 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.865 106.3 54.3 -67.2 -35.6 1.1 17.8 22.1 521 241 B H H 3< S+ 0 0 66 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.740 117.4 36.6 -70.8 -22.9 -1.3 18.6 19.3 522 242 B Q H << S+ 0 0 115 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.567 94.8 106.9-100.1 -14.6 0.4 16.0 17.0 523 243 B S < - 0 0 11 -4,-1.4 -512,-0.0 1,-0.1 -4,-0.0 -0.483 56.2-154.8 -81.6 134.5 1.1 13.4 19.7 524 244 B P + 0 0 45 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.560 55.6 125.8 -75.9 -8.0 -0.9 10.1 19.9 525 245 B V S S- 0 0 14 1,-0.1 -109,-0.1 -109,-0.1 2,-0.1 -0.192 72.4-102.5 -57.9 136.3 -0.1 9.8 23.7 526 246 B P - 0 0 30 0, 0.0 -109,-2.1 0, 0.0 2,-0.4 -0.399 42.3-164.1 -62.2 136.6 -3.1 9.4 25.9 527 247 B K E -op 417 553C 2 25,-2.7 27,-2.8 -111,-0.2 2,-0.5 -0.973 15.1-165.6-129.1 138.5 -4.1 12.7 27.7 528 248 B L E -op 418 554C 0 -111,-2.6 -109,-2.8 -2,-0.4 2,-0.6 -0.972 11.5-164.8-123.8 114.8 -6.3 13.4 30.6 529 249 B L E -op 419 555C 1 25,-3.2 27,-2.8 -2,-0.5 2,-0.4 -0.881 4.1-162.2-109.5 113.3 -7.3 17.0 31.2 530 250 B F E +op 420 556C 0 -111,-2.6 -109,-0.6 -2,-0.6 2,-0.3 -0.744 17.9 175.0 -86.0 133.9 -8.9 18.1 34.5 531 251 B W E - p 0 557C 42 25,-2.4 27,-2.5 -2,-0.4 28,-0.5 -0.994 12.1-164.6-141.0 146.4 -10.7 21.5 34.4 532 252 B G E - 0 0 0 6,-0.4 4,-0.1 -2,-0.3 -111,-0.0 -0.745 33.7 -71.5-123.2 173.1 -12.7 23.5 36.8 533 253 B T E S- p 0 560C 68 26,-2.6 28,-2.0 1,-0.3 3,-0.0 -0.963 113.8 -1.6-117.5 127.8 -15.1 26.5 36.6 534 254 B P E S- p 0 561C 77 0, 0.0 -1,-0.3 0, 0.0 28,-0.2 -0.997 94.4-173.4 -88.0 0.2 -14.3 29.2 36.0 535 255 B G - 0 0 3 26,-2.6 28,-0.2 4,-0.2 -2,-0.1 -0.209 20.4-135.1 76.6-176.3 -10.7 28.0 35.9 536 256 B V S S+ 0 0 30 26,-0.4 27,-0.1 27,-0.1 -100,-0.0 0.319 93.6 16.9-137.9 -66.8 -7.7 30.4 35.5 537 257 B L S S+ 0 0 53 25,-0.3 26,-0.1 1,-0.3 -113,-0.1 0.817 139.7 33.0 -81.1 -34.0 -5.2 29.1 33.0 538 258 B I S S- 0 0 0 24,-0.3 -6,-0.4 4,-0.0 -1,-0.3 -0.737 78.7-174.4-126.9 80.9 -7.7 26.7 31.4 539 259 B P >> - 0 0 52 0, 0.0 4,-1.9 0, 0.0 3,-0.6 -0.277 44.5 -94.3 -66.1 162.0 -11.2 28.1 31.6 540 260 B P H 3> S+ 0 0 42 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.835 123.9 53.4 -51.7 -42.2 -14.1 25.8 30.4 541 261 B A H 3> S+ 0 0 60 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.895 109.9 48.6 -62.7 -39.4 -14.2 27.2 26.8 542 262 B E H <> S+ 0 0 16 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.889 110.5 50.3 -66.1 -40.3 -10.5 26.5 26.4 543 263 B A H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.891 108.6 53.0 -65.8 -39.2 -10.8 22.9 27.8 544 264 B A H X S+ 0 0 59 -4,-2.4 4,-0.8 -5,-0.2 -2,-0.2 0.914 110.7 48.6 -57.3 -43.8 -13.7 22.3 25.4 545 265 B R H >X S+ 0 0 145 -4,-1.9 4,-2.4 1,-0.2 3,-0.6 0.894 111.3 47.5 -64.6 -44.7 -11.4 23.5 22.6 546 266 B L H 3X S+ 0 0 4 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.752 99.4 68.1 -70.5 -26.6 -8.5 21.3 23.7 547 267 B A H 3< S+ 0 0 25 -4,-1.8 6,-0.3 -5,-0.2 -1,-0.2 0.860 113.6 32.4 -58.4 -31.6 -10.8 18.3 24.0 548 268 B E H << S+ 0 0 165 -4,-0.8 -2,-0.2 -3,-0.6 -1,-0.2 0.887 120.3 46.7 -92.0 -45.6 -11.0 18.5 20.2 549 269 B S H < S+ 0 0 54 -4,-2.4 -3,-0.2 2,-0.1 -2,-0.2 0.726 101.4 71.9 -73.9 -23.4 -7.6 19.8 19.1 550 270 B L S >< S- 0 0 5 -4,-2.0 3,-0.8 -5,-0.2 -29,-0.1 -0.845 86.1-123.7 -98.3 124.2 -5.6 17.4 21.3 551 271 B P T 3 S+ 0 0 48 0, 0.0 -24,-0.1 0, 0.0 -2,-0.1 -0.345 86.8 4.0 -66.1 143.6 -5.6 13.7 20.1 552 272 B N T 3 S+ 0 0 110 1,-0.2 -25,-2.7 -26,-0.1 2,-0.6 0.845 91.7 154.8 54.6 41.3 -6.7 10.9 22.5 553 273 B C E < -p 527 0C 21 -3,-0.8 2,-0.4 -6,-0.3 -25,-0.2 -0.892 27.5-169.0-109.8 115.2 -7.7 13.5 25.1 554 274 B K E -p 528 0C 104 -27,-2.8 -25,-3.2 -2,-0.6 2,-0.3 -0.825 12.6-152.4 -95.4 135.9 -10.3 12.8 27.8 555 275 B T E -p 529 0C 46 -2,-0.4 2,-0.4 -27,-0.2 -25,-0.2 -0.820 4.8-159.1-107.2 152.2 -11.5 15.8 29.9 556 276 B V E -p 530 0C 13 -27,-2.8 -25,-2.4 -2,-0.3 2,-0.7 -0.982 11.5-142.9-133.7 124.0 -12.9 15.7 33.4 557 277 B D E -p 531 0C 82 -2,-0.4 -25,-0.2 -27,-0.2 -27,-0.1 -0.744 15.2-176.7 -82.4 112.3 -15.0 18.4 35.0 558 278 B I E - 0 0 5 -27,-2.5 -26,-0.2 -2,-0.7 -1,-0.1 0.476 36.4-128.0 -91.3 -0.7 -14.0 18.8 38.7 559 279 B G E S+ 0 0 24 -28,-0.5 -26,-2.6 2,-0.1 -1,-0.3 -0.730 74.5 21.4 94.3-142.1 -16.7 21.4 39.4 560 280 B P E S+p 533 0C 91 0, 0.0 2,-0.3 0, 0.0 -91,-0.1 -0.497 80.7 145.6 -65.3 128.1 -15.8 24.7 41.1 561 281 B G E +p 534 0C 0 -28,-2.0 -26,-2.6 -2,-0.3 -93,-0.1 -0.971 28.3 175.8-160.6 146.9 -12.1 25.4 40.5 562 282 B L S S- 0 0 27 -95,-0.4 -26,-0.4 -2,-0.3 -25,-0.3 0.514 73.3 -38.1-110.8 -91.7 -9.6 28.3 40.0 563 283 B F S S+ 0 0 30 -96,-2.1 2,-1.4 1,-0.2 3,-0.2 0.823 127.6 51.2-110.9 -51.2 -5.9 27.4 39.9 564 284 B L >> + 0 0 0 -97,-2.7 3,-1.6 1,-0.2 4,-0.6 -0.601 59.7 169.7 -91.9 77.5 -5.1 24.7 42.4 565 285 B L H >> S+ 0 0 0 -2,-1.4 4,-2.3 1,-0.3 3,-1.6 0.850 71.5 69.4 -51.2 -37.2 -7.8 22.2 41.4 566 286 B Q H 34 S+ 0 0 3 1,-0.3 -1,-0.3 -3,-0.2 8,-0.1 0.812 98.8 49.1 -52.6 -33.4 -6.0 19.7 43.7 567 287 B E H <4 S+ 0 0 0 -3,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.625 113.6 46.2 -83.9 -15.0 -7.1 21.7 46.7 568 288 B D H << S+ 0 0 31 -3,-1.6 -2,-0.2 -4,-0.6 -3,-0.1 0.876 132.3 3.3 -94.3 -44.0 -10.8 21.9 45.5 569 289 B N X + 0 0 44 -4,-2.3 4,-1.7 1,-0.1 -2,-0.1 -0.483 66.5 151.3-144.4 69.6 -11.6 18.3 44.4 570 290 B P H > S+ 0 0 2 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.849 71.9 63.0 -68.4 -35.3 -8.7 15.8 45.1 571 291 B D H > S+ 0 0 73 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.957 108.8 39.9 -56.3 -54.7 -11.1 12.8 45.5 572 292 B L H > S+ 0 0 52 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.917 115.8 51.9 -58.5 -45.6 -12.4 13.1 42.0 573 293 B I H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.944 115.3 40.5 -60.2 -47.4 -8.9 13.9 40.6 574 294 B G H X S+ 0 0 0 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.928 116.2 49.8 -65.5 -47.6 -7.3 10.9 42.2 575 295 B S H X S+ 0 0 54 -4,-2.8 4,-1.5 -5,-0.3 -1,-0.2 0.843 112.3 47.5 -62.0 -36.0 -10.2 8.5 41.5 576 296 B E H X S+ 0 0 14 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.865 110.5 51.3 -76.6 -36.1 -10.3 9.5 37.8 577 297 B I H X S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.934 110.4 50.2 -62.3 -43.5 -6.5 9.1 37.5 578 298 B A H < S+ 0 0 32 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.852 111.9 47.5 -61.4 -37.3 -6.8 5.7 39.0 579 299 B R H < S+ 0 0 165 -4,-1.5 4,-0.4 1,-0.2 -1,-0.2 0.865 114.1 47.7 -71.3 -35.6 -9.6 4.7 36.6 580 300 B W H >< S+ 0 0 34 -4,-2.0 3,-0.7 1,-0.2 -2,-0.2 0.777 96.9 71.3 -79.4 -28.4 -7.7 6.0 33.6 581 301 B L G >X S+ 0 0 3 -4,-2.0 3,-2.6 1,-0.2 4,-0.6 0.908 90.5 55.9 -58.9 -49.2 -4.3 4.4 34.4 582 302 B P G >4 S+ 0 0 83 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.799 96.2 69.2 -56.4 -23.6 -5.2 0.7 33.6 583 303 B G G <4 S+ 0 0 72 -3,-0.7 -2,-0.2 -4,-0.4 -3,-0.1 0.546 95.0 55.9 -69.4 -6.3 -6.3 2.0 30.1 584 304 B L G <4 0 0 37 -3,-2.6 -1,-0.2 -4,-0.1 -3,-0.1 0.622 360.0 360.0 -99.3 -19.9 -2.6 2.6 29.4 585 305 B A << 0 0 133 -3,-0.9 -2,-0.1 -4,-0.6 -4,-0.0 0.996 360.0 360.0 -67.1 360.0 -1.4 -1.0 30.1