==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE/DNA/ANTIBIOTIC 28-MAR-11 3RAE . COMPND 2 MOLECULE: DNA TOPOISOMERASE 4 SUBUNIT A; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR I.LAPONOGOV,X.-S.PAN,D.A.VESELKOV,K.E.MCAULEY,L.M.FISHER, . 1381 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 56830.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1021 73.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 138 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 1 0.1 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 . 92 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 124 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 539 39.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.3 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 1 6 0 5 3 2 8 7 5 3 1 0 1 0 1 3 0 0 0 3 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 2 0 4 1 3 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 . 10 3 6 8 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 6 2 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 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 3 A N 0 0 116 0, 0.0 1138,-1.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -56.4 -22.2 35.8 -21.8 2 4 A I E -a 1139 0A 66 1136,-0.2 2,-0.4 1138,-0.0 1138,-0.2 -0.995 360.0-171.7-136.1 138.7 -21.1 37.6 -24.9 3 5 A Q E -a 1140 0A 67 1136,-1.3 1138,-2.2 -2,-0.4 2,-0.2 -0.996 20.8-131.1-130.1 131.5 -22.0 37.3 -28.6 4 6 A N E +a 1141 0A 120 -2,-0.4 2,-0.3 1136,-0.2 1138,-0.2 -0.491 23.8 174.4 -85.1 146.3 -20.3 39.1 -31.5 5 7 A M E -a 1142 0A 40 1136,-1.8 1138,-1.6 -2,-0.2 2,-0.1 -0.971 34.0-104.1-141.7 155.2 -21.8 41.1 -34.3 6 8 A S E > -a 1143 0A 15 -2,-0.3 4,-3.1 1136,-0.2 5,-0.2 -0.415 17.6-127.6 -78.4 152.3 -20.1 43.1 -37.1 7 9 A L H > S+ 0 0 7 1136,-1.5 4,-2.1 1,-0.2 5,-0.2 0.928 117.2 52.9 -58.0 -42.0 -19.9 46.9 -37.1 8 10 A E H 4 S+ 0 0 19 1135,-0.3 -1,-0.2 1,-0.2 1136,-0.1 0.818 113.7 41.8 -62.4 -33.4 -21.4 46.5 -40.6 9 11 A D H >> S+ 0 0 108 2,-0.2 4,-2.1 3,-0.1 3,-1.1 0.879 111.2 53.3 -81.8 -43.7 -24.2 44.3 -39.3 10 12 A I H 3X S+ 0 0 10 -4,-3.1 4,-1.6 1,-0.3 5,-0.2 0.975 109.1 49.0 -55.9 -55.7 -25.0 46.3 -36.1 11 13 A M H 3X S+ 0 0 1 -4,-2.1 4,-0.7 1,-0.2 -1,-0.3 0.546 112.1 54.0 -63.5 -4.7 -25.4 49.6 -38.1 12 14 A G H <> S+ 0 0 14 -3,-1.1 4,-1.4 2,-0.2 5,-0.2 0.867 107.7 42.1 -96.9 -47.0 -27.7 47.7 -40.5 13 15 A E H X S+ 0 0 59 -4,-2.1 4,-0.7 -3,-0.2 -2,-0.2 0.693 121.1 47.3 -72.3 -19.4 -30.3 46.2 -38.2 14 16 A R H X S+ 0 0 73 -4,-1.6 4,-2.6 -5,-0.3 5,-0.2 0.943 113.0 41.0 -86.6 -55.0 -30.4 49.5 -36.3 15 17 A F H X S+ 0 0 10 -4,-0.7 4,-2.7 -5,-0.2 5,-0.2 0.809 116.9 50.8 -68.5 -28.3 -30.6 52.1 -39.0 16 18 A G H X S+ 0 0 13 -4,-1.4 4,-2.5 2,-0.2 5,-0.3 0.942 110.1 50.2 -67.6 -47.7 -33.1 50.0 -41.0 17 19 A R H X S+ 0 0 46 -4,-0.7 4,-1.3 -5,-0.2 -2,-0.2 0.931 118.4 38.4 -54.5 -50.7 -35.2 49.6 -37.8 18 20 A Y H X S+ 0 0 26 -4,-2.6 4,-2.3 2,-0.2 3,-0.3 0.948 114.5 52.8 -66.7 -53.3 -35.2 53.3 -37.2 19 21 A S H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 151,-0.3 0.937 108.8 49.7 -48.1 -58.2 -35.5 54.4 -40.8 20 22 A K H X S+ 0 0 79 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.861 113.8 46.2 -48.4 -42.9 -38.6 52.3 -41.5 21 23 A Y H X S+ 0 0 48 -4,-1.3 4,-3.1 -3,-0.3 -1,-0.2 0.881 110.3 50.1 -75.1 -39.3 -40.3 53.6 -38.4 22 24 A I H X>S+ 0 0 6 -4,-2.3 5,-1.7 1,-0.2 4,-0.5 0.830 116.3 44.4 -71.0 -31.9 -39.7 57.3 -38.9 23 25 A I H <5S+ 0 0 0 -4,-2.1 5,-0.3 -5,-0.3 -2,-0.2 0.908 125.4 29.7 -76.3 -46.3 -40.9 57.0 -42.4 24 26 A Q H <5S+ 0 0 38 -4,-2.3 -2,-0.2 -5,-0.3 -3,-0.2 0.863 133.3 25.5 -80.2 -36.8 -44.0 54.9 -41.8 25 27 A D H <5S+ 0 0 60 -4,-3.1 -1,-0.2 -5,-0.2 -3,-0.1 -0.131 123.0 21.4-131.2 29.8 -44.9 56.0 -38.2 26 28 A R T <5S+ 0 0 72 -4,-0.5 12,-0.3 -3,-0.2 -3,-0.1 0.074 113.5 26.9-153.1 -82.5 -43.7 59.5 -37.4 27 29 A A S -g 330 0B 20 5,-1.8 4,-2.0 299,-0.2 301,-0.2 -0.613 27.0-132.1 -68.7 133.2 -50.8 59.2 -44.7 31 33 A I T 4 S+ 0 0 3 299,-2.3 129,-0.2 -2,-0.3 316,-0.1 0.773 99.0 50.8 -63.2 -27.8 -51.8 60.2 -48.3 32 34 A R T 4 S+ 0 0 79 298,-0.4 128,-0.3 1,-0.1 -1,-0.2 0.942 126.9 15.5 -76.6 -53.4 -55.5 59.4 -47.6 33 35 A D T 4 S- 0 0 0 2,-0.2 -2,-0.2 126,-0.1 126,-0.1 0.541 94.4-129.8-102.0 -8.0 -56.4 61.3 -44.4 34 36 A G < + 0 0 2 -4,-2.0 2,-0.4 1,-0.2 -3,-0.1 0.622 61.6 129.5 72.0 16.9 -53.3 63.5 -44.4 35 37 A L - 0 0 2 -5,-0.2 -5,-1.8 -7,-0.1 -1,-0.2 -0.832 54.5-136.7-108.3 139.3 -52.3 62.8 -40.8 36 38 A K >> - 0 0 39 -2,-0.4 4,-2.2 -7,-0.2 3,-0.8 -0.557 42.3-102.2 -74.2 154.6 -49.1 61.8 -39.1 37 39 A P H 3> S+ 0 0 12 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.889 120.7 55.1 -47.9 -46.2 -49.6 59.0 -36.5 38 40 A V H 3> S+ 0 0 25 -12,-0.3 4,-2.3 1,-0.2 5,-0.1 0.862 110.3 46.1 -58.2 -37.5 -49.4 61.4 -33.5 39 41 A Q H <> S+ 0 0 30 -3,-0.8 4,-2.8 2,-0.2 5,-0.2 0.926 110.6 51.1 -73.0 -45.0 -52.1 63.6 -34.9 40 42 A R H X S+ 0 0 17 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.917 112.3 48.2 -54.1 -45.5 -54.5 60.7 -35.8 41 43 A R H X S+ 0 0 34 -4,-2.6 4,-3.1 -5,-0.2 5,-0.3 0.949 109.6 52.9 -63.8 -47.5 -54.0 59.5 -32.2 42 44 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.943 115.5 39.8 -45.4 -56.4 -54.7 62.9 -30.8 43 45 A L H X S+ 0 0 0 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.891 116.7 49.6 -65.1 -41.4 -58.0 63.2 -32.8 44 46 A Y H X S+ 0 0 32 -4,-3.1 4,-2.8 -5,-0.2 -2,-0.2 0.938 112.9 46.3 -64.8 -46.2 -59.0 59.6 -32.2 45 47 A S H X S+ 0 0 1 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.903 112.5 48.3 -66.3 -43.1 -58.4 59.8 -28.4 46 48 A M H <>S+ 0 0 1 -4,-2.3 5,-2.4 -5,-0.3 -1,-0.2 0.875 114.5 47.8 -67.6 -29.9 -60.2 63.1 -27.9 47 49 A N H ><5S+ 0 0 47 -4,-1.7 3,-1.8 -5,-0.2 -2,-0.2 0.899 106.6 55.1 -77.7 -39.6 -63.1 61.8 -29.9 48 50 A K H 3<5S+ 0 0 68 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.892 109.1 51.5 -55.1 -37.5 -63.3 58.5 -28.0 49 51 A D T 3<5S- 0 0 43 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.323 113.9-117.2 -87.1 6.8 -63.5 60.7 -24.9 50 52 A S T < 5 + 0 0 61 -3,-1.8 2,-1.8 1,-0.2 -3,-0.2 0.699 65.6 146.1 70.1 17.8 -66.5 62.8 -26.2 51 53 A N < + 0 0 0 -5,-2.4 70,-2.4 -6,-0.2 -1,-0.2 -0.460 31.7 149.4 -87.1 64.1 -64.3 65.9 -26.1 52 54 A T > - 0 0 22 -2,-1.8 3,-2.1 68,-0.2 71,-0.1 -0.404 64.1 -94.6-102.5 174.5 -66.0 67.3 -29.2 53 55 A F T 3 S+ 0 0 78 69,-0.3 70,-0.1 1,-0.3 4,-0.1 0.743 120.2 54.8 -62.1 -27.2 -66.8 70.8 -30.5 54 56 A D T 3 S+ 0 0 95 68,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.360 103.1 65.4 -91.9 2.6 -70.3 70.7 -29.0 55 57 A K S < S- 0 0 102 -3,-2.1 3,-0.1 1,-0.1 -4,-0.0 -0.764 95.7 -69.2-124.3 171.8 -69.2 70.0 -25.5 56 58 A S - 0 0 98 -2,-0.2 -1,-0.1 1,-0.1 63,-0.1 -0.169 56.6 -97.1 -61.5 147.9 -67.2 71.8 -22.8 57 59 A Y - 0 0 51 61,-0.1 2,-0.4 63,-0.1 63,-0.2 -0.281 40.5-145.3 -58.0 149.6 -63.5 72.4 -23.2 58 60 A R E -I 119 0C 52 61,-2.3 61,-3.1 -7,-0.1 5,-0.1 -0.939 29.5 -87.9-123.3 142.8 -61.5 69.7 -21.3 59 61 A K E >> -I 118 0C 37 -2,-0.4 4,-1.8 59,-0.3 3,-0.5 -0.240 32.3-133.2 -52.3 126.8 -58.2 70.3 -19.6 60 62 A S H 3> S+ 0 0 0 57,-2.0 4,-2.7 1,-0.2 5,-0.2 0.906 104.1 55.2 -45.1 -49.0 -55.3 69.8 -22.1 61 63 A A H 3> S+ 0 0 2 53,-1.4 4,-2.2 56,-0.4 -1,-0.2 0.860 104.1 53.4 -61.8 -36.4 -53.3 67.7 -19.6 62 64 A K H <> S+ 0 0 37 -3,-0.5 4,-1.8 486,-0.2 -1,-0.2 0.968 112.4 45.3 -59.2 -48.7 -56.2 65.3 -19.2 63 65 A S H X S+ 0 0 1 -4,-1.8 4,-2.0 1,-0.2 3,-0.2 0.958 113.4 48.6 -60.2 -51.0 -56.4 64.8 -22.9 64 66 A V H X S+ 0 0 1 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.881 109.0 53.3 -56.0 -44.5 -52.6 64.4 -23.4 65 67 A G H X S+ 0 0 3 -4,-2.2 4,-2.3 -5,-0.2 480,-0.3 0.887 108.6 49.2 -61.1 -40.9 -52.3 61.9 -20.6 66 68 A N H X S+ 0 0 12 -4,-1.8 4,-1.7 -3,-0.2 5,-0.3 0.872 110.1 51.3 -66.3 -38.3 -55.0 59.7 -22.1 67 69 A I H X>S+ 0 0 0 -4,-2.0 5,-2.9 1,-0.2 4,-2.6 0.942 113.5 45.7 -61.8 -49.8 -53.3 59.8 -25.5 68 70 A M H <5S+ 0 0 3 -4,-2.6 -2,-0.2 3,-0.2 -1,-0.2 0.887 116.2 43.9 -56.8 -44.8 -50.0 58.8 -23.9 69 71 A G H <5S+ 0 0 11 -4,-2.3 -1,-0.2 -5,-0.2 473,-0.2 0.739 125.8 29.8 -81.4 -21.3 -51.4 56.0 -21.8 70 72 A N H <5S- 0 0 22 -4,-1.7 74,-0.3 -5,-0.2 77,-0.2 0.784 136.1 -3.1-107.4 -33.4 -53.6 54.5 -24.5 71 73 A F T <5S+ 0 0 0 -4,-2.6 72,-0.5 -5,-0.3 -3,-0.2 0.699 112.6 57.8-132.7 -38.3 -52.1 55.1 -27.9 72 74 A H < - 0 0 12 -5,-2.9 2,-2.4 -6,-0.1 -1,-0.2 -0.828 53.8-163.0-122.0 96.0 -48.9 57.1 -28.1 73 75 A P + 0 0 51 0, 0.0 2,-0.2 0, 0.0 -5,-0.1 -0.267 58.6 89.5 -76.5 54.8 -45.8 55.9 -26.1 74 76 A H S S- 0 0 47 -2,-2.4 -2,-0.1 1,-0.2 5,-0.0 -0.773 82.7 -53.4-138.6-176.7 -43.8 59.1 -26.2 75 77 A G > - 0 0 16 -2,-0.2 4,-1.4 1,-0.1 -1,-0.2 -0.152 37.3-132.7 -60.0 154.1 -43.2 62.3 -24.4 76 78 A D H > S+ 0 0 24 2,-0.2 4,-3.7 1,-0.2 5,-0.3 0.870 104.2 64.4 -76.4 -38.3 -46.1 64.6 -23.5 77 79 A S H > S+ 0 0 63 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.948 105.5 45.5 -44.0 -54.4 -44.2 67.7 -24.8 78 80 A S H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.909 115.3 45.6 -62.8 -44.4 -44.4 66.2 -28.3 79 81 A I H X S+ 0 0 0 -4,-1.4 4,-2.6 2,-0.2 -1,-0.2 0.956 116.0 46.8 -61.3 -49.0 -48.0 65.2 -28.0 80 82 A Y H X S+ 0 0 11 -4,-3.7 4,-3.3 1,-0.2 5,-0.2 0.952 111.8 49.2 -60.8 -51.0 -49.0 68.6 -26.6 81 83 A D H X S+ 0 0 96 -4,-3.4 4,-2.4 -5,-0.3 -1,-0.2 0.869 112.3 49.9 -55.6 -39.0 -47.0 70.6 -29.1 82 84 A A H X S+ 0 0 20 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.926 112.6 46.6 -64.1 -44.1 -48.6 68.5 -31.9 83 85 A M H < S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.899 112.8 50.1 -63.4 -43.3 -52.1 69.2 -30.3 84 86 A V H >X S+ 0 0 4 -4,-3.3 3,-2.1 -5,-0.2 4,-0.8 0.933 107.8 53.2 -61.5 -46.3 -51.3 72.9 -30.0 85 87 A R H >< S+ 0 0 70 -4,-2.4 3,-2.0 1,-0.3 6,-0.2 0.951 102.1 57.9 -57.6 -48.7 -50.1 73.2 -33.6 86 88 A M T 3< S+ 0 0 3 -4,-2.1 11,-1.7 1,-0.3 10,-1.4 0.488 108.6 49.9 -59.3 -1.5 -53.4 71.6 -34.8 87 89 A S T <4 S+ 0 0 8 -3,-2.1 2,-0.6 9,-0.2 -1,-0.3 0.510 83.9 99.2-112.8 -12.5 -55.1 74.5 -33.0 88 90 A Q XX - 0 0 23 -3,-2.0 4,-2.3 -4,-0.8 3,-1.1 -0.683 58.1-158.7 -82.1 121.1 -53.1 77.4 -34.4 89 91 A N T 34 S+ 0 0 107 -2,-0.6 -1,-0.1 1,-0.3 6,-0.1 0.437 88.7 59.7 -85.9 1.4 -55.0 79.0 -37.2 90 92 A W T 34 S+ 0 0 44 123,-0.1 170,-0.5 122,-0.1 123,-0.3 0.377 114.1 37.4-101.1 -2.8 -52.0 80.6 -38.8 91 93 A K T <4 S+ 0 0 30 -3,-1.1 2,-0.5 1,-0.2 -2,-0.2 0.642 117.2 54.2-111.9 -34.0 -50.4 77.2 -39.3 92 94 A N >< - 0 0 13 -4,-2.3 3,-0.5 -7,-0.2 -1,-0.2 -0.904 61.9-157.8-109.3 126.4 -53.6 75.3 -40.2 93 95 A R T 3 S+ 0 0 21 -2,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.862 99.7 20.5 -64.5 -35.8 -55.9 76.4 -43.0 94 96 A E T 3 S- 0 0 29 65,-0.1 -1,-0.3 -3,-0.1 69,-0.1 -0.763 93.0-140.7-133.8 88.2 -58.7 74.5 -41.3 95 97 A I < - 0 0 44 -3,-0.5 30,-0.3 -2,-0.3 29,-0.2 -0.152 13.6-167.2 -58.7 141.8 -57.9 73.9 -37.6 96 98 A L S S+ 0 0 4 -10,-1.4 26,-1.9 1,-0.1 2,-0.4 0.465 72.1 51.4-105.3 -9.7 -58.9 70.6 -36.0 97 99 A V E -J 121 0C 0 -11,-1.7 2,-0.5 24,-0.3 24,-0.2 -0.999 66.1-153.2-132.6 131.2 -58.4 71.5 -32.4 98 100 A E E -J 120 0C 60 22,-2.8 22,-1.6 -2,-0.4 2,-0.4 -0.933 18.7-170.4-101.4 128.1 -59.9 74.4 -30.5 99 101 A M E -J 119 0C 13 -2,-0.5 2,-0.6 -12,-0.2 20,-0.2 -0.969 15.9-144.1-127.0 131.3 -57.9 75.5 -27.5 100 102 A H E +J 118 0C 19 18,-3.1 18,-1.5 -2,-0.4 2,-0.2 -0.855 67.0 19.2 -94.4 121.7 -58.8 78.0 -24.8 101 103 A G S S- 0 0 2 -2,-0.6 2,-0.9 16,-0.2 1235,-0.2 -0.681 111.6 -14.2 120.2-173.8 -55.8 80.1 -23.6 102 104 A N + 0 0 2 1230,-0.3 10,-2.8 -2,-0.2 15,-0.1 -0.527 58.1 160.3 -65.6 104.2 -52.4 81.1 -24.8 103 105 A N - 0 0 23 -2,-0.9 -1,-0.2 1,-0.5 2,-0.1 -0.090 60.0 -91.1-113.9 32.6 -51.7 78.7 -27.6 104 106 A G - 0 0 4 6,-0.3 -1,-0.5 -16,-0.0 2,-0.3 -0.358 41.4-118.7 91.4-171.6 -49.0 80.9 -29.1 105 107 A S > - 0 0 18 4,-0.3 3,-2.2 -2,-0.1 -17,-0.0 -0.955 34.0 -91.0-158.8 168.8 -49.0 83.6 -31.7 106 108 A M T 3 S+ 0 0 44 1,-0.3 157,-1.7 -2,-0.3 158,-0.2 0.731 124.4 65.2 -60.1 -20.7 -47.7 84.6 -35.1 107 109 A D T 3 S- 0 0 41 155,-0.2 -1,-0.3 156,-0.2 155,-0.1 0.428 113.9-122.5 -79.1 1.3 -44.8 86.1 -33.1 108 110 A G < + 0 0 49 -3,-2.2 -2,-0.1 1,-0.2 154,-0.1 0.854 49.2 165.5 57.9 39.3 -43.9 82.6 -32.0 109 111 A D - 0 0 36 1,-0.1 -4,-0.3 1093,-0.1 -1,-0.2 -0.715 49.7 -89.0 -82.7 139.1 -44.2 83.1 -28.2 110 112 A P - 0 0 106 0, 0.0 -6,-0.3 0, 0.0 -1,-0.1 -0.124 42.3-121.3 -45.0 130.7 -44.4 79.8 -26.2 111 113 A P - 0 0 43 0, 0.0 -8,-0.2 0, 0.0 3,-0.1 -0.317 41.3 -87.1 -59.3 154.9 -47.9 78.5 -25.8 112 114 A A - 0 0 0 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-53.9 66.2 -47.0 161 163 A L H <45S+ 0 0 2 -3,-0.9 18,-0.8 2,-0.1 -1,-0.2 0.808 120.7 57.8 -88.2 -34.8 -54.2 69.1 -49.4 162 164 A V H <5S+ 0 0 0 -4,-1.9 17,-1.0 16,-0.3 -69,-0.2 0.969 125.9 14.9 -62.5 -54.7 -56.6 71.2 -47.3 163 165 A N H <5S- 0 0 5 -4,-2.4 -70,-0.3 15,-0.2 -3,-0.2 0.755 97.0-151.3 -93.4 -27.5 -54.2 71.4 -44.2 164 166 A G << - 0 0 10 -5,-1.0 2,-0.3 -4,-0.7 -1,-0.2 -0.432 4.2-123.4 89.2-164.9 -50.9 70.3 -45.6 165 167 A S E -L 176 0E 9 11,-1.8 11,-2.4 -2,-0.1 2,-0.3 -0.890 8.7-144.3 179.3 147.3 -48.0 68.6 -43.8 166 168 A T E -L 175 0E 42 -2,-0.3 9,-0.2 9,-0.2 2,-0.1 -0.825 23.0-168.3-167.1 129.5 -44.3 69.0 -43.1 167 169 A G E +L 174 0E 4 7,-0.6 7,-2.6 -2,-0.3 2,-0.3 -0.835 30.6 165.0 142.3 55.8 -42.2 66.8 -43.0 168 170 A I E +L 173 0E 138 5,-0.3 5,-0.3 -141,-0.2 -141,-0.1 -0.801 29.1 136.2-138.6 110.4 -38.7 65.5 -42.1 169 171 A S - 0 0 23 3,-2.6 2,-0.5 -2,-0.3 -146,-0.1 0.129 59.9 -56.1-113.5-133.9 -37.7 61.8 -41.8 170 172 A A S S- 0 0 10 -151,-0.3 -1,-0.0 1,-0.1 3,-0.0 -0.985 118.0 -7.4-115.1 127.1 -34.8 59.6 -42.9 171 173 A G S S+ 0 0 8 -2,-0.5 2,-0.3 998,-0.0 -1,-0.1 0.378 133.1 60.7 69.9 -8.4 -34.0 59.6 -46.7 172 174 A Y - 0 0 42 2,-0.0 -3,-2.6 156,-0.0 2,-0.3 -0.996 54.7-178.2-150.5 146.3 -37.2 61.6 -47.2 173 175 A A E -L 168 0E 34 -2,-0.3 2,-0.3 -5,-0.3 -5,-0.3 -0.808 16.8-146.0-126.2 170.3 -38.8 65.0 -46.2 174 176 A T E +L 167 0E 0 -7,-2.6 -7,-0.6 -2,-0.3 2,-0.3 -0.983 19.1 172.7-144.3 137.7 -42.2 66.4 -47.0 175 177 A D E +LM 166 326E 45 151,-1.1 151,-3.0 -2,-0.3 -9,-0.2 -0.888 11.7 161.3-141.1 110.5 -43.7 69.8 -47.7 176 178 A I E -L 165 0E 3 -11,-2.4 -11,-1.8 -2,-0.3 149,-0.1 -0.994 28.2-142.2-126.6 120.0 -47.3 70.1 -48.9 177 179 A P - 0 0 0 0, 0.0 -13,-0.3 0, 0.0 2,-0.1 -0.383 23.7 -95.6 -85.5 170.5 -48.9 73.4 -48.5 178 180 A P - 0 0 0 0, 0.0 32,-2.7 0, 0.0 2,-0.3 -0.399 37.2-163.3 -78.7 154.8 -52.6 74.1 -47.5 179 181 A H - 0 0 0 -17,-1.0 2,-0.2 -18,-0.8 -86,-0.0 -0.907 30.9 -84.7-135.5 163.2 -55.4 74.6 -50.0 180 182 A N > - 0 0 6 28,-0.4 4,-2.8 -2,-0.3 5,-0.2 -0.502 33.7-137.3 -68.6 130.4 -58.9 76.0 -50.0 181 183 A L H > S+ 0 0 1 -2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.917 101.9 47.9 -59.1 -50.8 -61.5 73.4 -49.0 182 184 A A H > S+ 0 0 14 292,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.930 113.7 49.4 -58.9 -43.8 -64.1 74.4 -51.7 183 185 A E H > S+ 0 0 27 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.948 110.7 47.3 -61.1 -51.3 -61.4 74.3 -54.3 184 186 A V H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.857 113.7 49.8 -59.5 -35.0 -59.9 71.0 -53.4 185 187 A I H X S+ 0 0 0 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.867 105.8 55.1 -73.9 -37.4 -63.5 69.5 -53.3 186 188 A D H X S+ 0 0 50 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.943 110.3 47.8 -57.6 -45.5 -64.4 70.9 -56.7 187 189 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.915 111.4 49.2 -60.2 -45.8 -61.3 69.1 -58.1 188 190 A A H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.910 110.9 50.5 -63.9 -41.1 -62.2 65.8 -56.4 189 191 A V H X S+ 0 0 17 -4,-2.8 4,-1.3 2,-0.2 -1,-0.2 0.895 110.2 49.0 -64.8 -38.7 -65.7 66.0 -57.6 190 192 A Y H >X S+ 0 0 49 -4,-2.2 4,-2.9 1,-0.2 3,-0.6 0.960 111.8 49.4 -64.6 -47.0 -64.6 66.6 -61.2 191 193 A M H 3< S+ 0 0 10 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.780 103.3 59.7 -63.1 -28.9 -62.1 63.7 -61.0 192 194 A I H 3< S+ 0 0 12 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.902 116.0 35.2 -64.4 -36.7 -64.8 61.4 -59.6 193 195 A D H << S+ 0 0 79 -4,-1.3 -2,-0.2 -3,-0.6 -1,-0.2 0.818 131.3 32.5 -84.1 -35.0 -66.8 62.1 -62.9 194 196 A H >< + 0 0 86 -4,-2.9 3,-1.6 -5,-0.2 -1,-0.3 -0.707 69.4 175.6-126.6 78.2 -63.7 62.3 -65.1 195 197 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.780 78.7 55.0 -58.0 -34.8 -61.1 59.9 -63.6 196 198 A T T 3 S+ 0 0 136 2,-0.0 -5,-0.1 0, 0.0 -2,-0.0 0.133 81.0 151.8 -86.8 21.7 -58.6 60.4 -66.4 197 199 A A < - 0 0 17 -3,-1.6 2,-0.2 -6,-0.2 -6,-0.0 -0.180 39.5-131.3 -62.1 144.9 -58.5 64.2 -65.9 198 200 A K >> - 0 0 61 1,-0.1 4,-2.2 143,-0.0 3,-0.8 -0.640 19.9-113.4 -95.1 153.2 -55.4 66.1 -66.8 199 201 A I H 3> S+ 0 0 25 1,-0.2 4,-3.0 -2,-0.2 5,-0.2 0.895 113.1 60.5 -49.6 -50.6 -53.7 68.7 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27.1-138.1-131.1 136.5 -44.3 58.3 -52.5 337 339 A Q E +H 328 0B 91 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.858 42.4 179.6 -86.2 130.1 -43.6 61.5 -54.2 338 340 A V - 0 0 3 -11,-2.7 -109,-0.2 -2,-0.6 2,-0.1 -0.992 26.1-149.0-141.7 142.7 -46.9 62.5 -55.6 339 341 A G > - 0 0 4 -111,-0.4 4,-1.7 -2,-0.4 -111,-0.2 -0.314 52.8 -77.5 -91.3-176.8 -48.6 65.2 -57.6 340 342 A I H > S+ 0 0 2 -113,-1.5 4,-2.2 1,-0.2 5,-0.2 0.785 124.4 60.7 -52.1 -32.1 -52.2 66.4 -57.4 341 343 A V H > S+ 0 0 47 -114,-0.7 4,-1.7 1,-0.2 -1,-0.2 0.952 106.1 39.7 -72.1 -53.7 -53.4 63.4 -59.4 342 344 A P H > S+ 0 0 27 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.843 115.8 56.3 -59.5 -35.2 -52.3 60.4 -57.2 343 345 A I H X S+ 0 0 5 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.979 112.0 38.9 -58.5 -59.9 -53.4 62.5 -54.1 344 346 A L H X S+ 0 0 1 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.806 117.0 51.9 -59.8 -31.6 -57.0 63.0 -55.3 345 347 A S H X S+ 0 0 49 -4,-1.7 4,-2.4 -5,-0.2 -1,-0.2 0.918 108.6 48.4 -80.4 -39.0 -57.2 59.6 -56.7 346 348 A S H X S+ 0 0 18 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.922 112.4 51.0 -59.3 -44.3 -56.0 57.9 -53.5 347 349 A Y H X S+ 0 0 4 -4,-2.3 4,-2.8 -5,-0.2 -2,-0.2 0.931 110.1 48.9 -59.0 -46.0 -58.5 60.0 -51.6 348 350 A I H X S+ 0 0 14 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.877 112.4 47.4 -63.0 -38.9 -61.3 59.0 -54.0 349 351 A A H X S+ 0 0 53 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.876 111.6 52.7 -71.0 -37.0 -60.4 55.3 -53.6 350 352 A H H X S+ 0 0 10 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.957 107.9 48.5 -60.9 -52.2 -60.3 55.7 -49.9 351 353 A R H X S+ 0 0 5 -4,-2.8 4,-3.2 1,-0.2 5,-0.3 0.819 109.2 56.7 -57.7 -31.0 -63.8 57.3 -49.7 352 354 A R H X S+ 0 0 64 -4,-1.4 4,-3.1 2,-0.2 5,-0.2 0.973 108.5 43.7 -65.2 -55.2 -64.9 54.4 -51.8 353 355 A E H X S+ 0 0 98 -4,-2.3 4,-3.2 2,-0.2 5,-0.2 0.943 116.4 50.4 -51.6 -50.1 -63.7 51.8 -49.3 354 356 A V H X S+ 0 0 1 -4,-2.9 4,-3.4 2,-0.2 5,-0.2 0.953 113.0 42.3 -54.7 -57.8 -65.1 53.9 -46.5 355 357 A I H X S+ 0 0 0 -4,-3.2 4,-2.3 2,-0.2 -1,-0.2 0.912 115.1 50.8 -61.0 -40.9 -68.6 54.4 -48.0 356 358 A L H X S+ 0 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Q H > S+ 0 0 14 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.873 112.4 52.8 -76.7 -40.3 -84.9 35.0 -33.2 414 416 A A H X S+ 0 0 0 -4,-3.0 4,-2.4 2,-0.2 5,-0.2 0.927 108.7 50.7 -59.0 -47.4 -85.1 32.5 -30.4 415 417 A E H X S+ 0 0 62 -4,-3.1 4,-1.3 1,-0.2 -1,-0.2 0.927 112.6 46.4 -56.5 -48.2 -82.7 34.7 -28.3 416 418 A A H < S+ 0 0 18 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.906 113.9 47.4 -61.4 -42.3 -84.8 37.8 -29.0 417 419 A I H >< S+ 0 0 0 -4,-2.6 3,-0.9 1,-0.2 488,-0.2 0.891 113.5 46.8 -68.1 -39.7 -88.1 36.0 -28.2 418 420 A V H 3< S+ 0 0 0 -4,-2.4 488,-1.8 1,-0.3 -1,-0.2 0.666 108.9 54.1 -82.7 -19.6 -87.0 34.5 -25.0 419 421 A T T 3< S+ 0 0 43 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.247 81.1 120.4 -99.3 12.6 -85.4 37.6 -23.7 420 422 A L < - 0 0 43 -3,-0.9 485,-3.0 -4,-0.1 2,-0.2 -0.461 69.6-112.8 -69.2 145.5 -88.6 39.7 -24.1 421 423 A Q B > -U 904 0H 65 483,-0.3 3,-1.9 -2,-0.1 4,-0.4 -0.567 25.9-113.2 -78.5 147.4 -90.0 41.2 -20.9 422 424 A L G > S+ 0 0 3 481,-2.6 3,-1.5 478,-0.3 480,-0.2 0.760 111.9 66.6 -49.7 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S- 0 0 3 -2,-0.4 2,-1.0 537,-0.2 537,-0.2 -0.465 112.5 -9.2 106.5-175.6 -39.4 52.7 -12.6 585 104 B N + 0 0 4 535,-0.5 10,-2.4 1,-0.2 3,-0.1 -0.410 60.2 161.2 -60.1 98.1 -37.0 55.3 -11.2 586 105 B N - 0 0 28 -2,-1.0 -1,-0.2 1,-0.5 2,-0.1 0.111 57.0 -95.2-107.3 23.3 -39.1 56.6 -8.3 587 106 B G - 0 0 3 6,-0.3 -1,-0.5 -16,-0.0 2,-0.3 -0.422 40.3-119.4 95.4-172.7 -36.1 58.2 -6.6 588 107 B S > - 0 0 19 4,-0.5 3,-2.0 -2,-0.1 -17,-0.0 -0.953 33.6 -89.2-157.5 172.7 -33.8 57.0 -3.8 589 108 B M T 3 S+ 0 0 46 -2,-0.3 157,-2.0 1,-0.3 158,-0.4 0.669 121.6 68.6 -65.7 -10.7 -32.6 57.6 -0.3 590 109 B D T 3 S- 0 0 24 155,-0.2 -1,-0.3 156,-0.2 155,-0.1 0.386 110.0-122.8 -84.4 4.6 -29.9 59.7 -2.1 591 110 B G < + 0 0 52 -3,-2.0 -2,-0.1 1,-0.2 154,-0.1 0.701 55.1 156.7 59.4 20.8 -32.5 62.2 -3.1 592 111 B D - 0 0 30 1,-0.1 -4,-0.5 400,-0.0 -1,-0.2 -0.453 52.4 -83.5 -72.5 154.1 -31.8 61.9 -6.9 593 112 B P - 0 0 102 0, 0.0 -6,-0.3 0, 0.0 2,-0.1 -0.248 38.4-124.3 -62.3 138.5 -34.7 62.9 -9.2 594 113 B P - 0 0 42 0, 0.0 -8,-0.2 0, 0.0 3,-0.1 -0.490 42.2 -89.3 -65.5 150.0 -37.5 60.5 -10.0 595 114 B A - 0 0 1 -10,-2.4 5,-0.1 -2,-0.1 0, 0.0 -0.300 54.9 -93.8 -50.6 145.3 -38.1 59.8 -13.6 596 115 B A >> - 0 0 32 1,-0.1 3,-2.3 -3,-0.1 4,-1.0 -0.226 41.8 -98.2 -59.0 155.3 -40.6 62.3 -15.2 597 116 B M T 34 S+ 0 0 13 1,-0.3 -53,-1.5 2,-0.2 -52,-0.2 0.595 120.6 66.9 -57.0 -10.5 -44.2 61.2 -15.3 598 117 B R T 34 S+ 0 0 91 -55,-0.2 -1,-0.3 1,-0.1 -53,-0.0 0.746 104.7 44.6 -80.2 -20.2 -43.9 60.1 -19.0 599 118 B Y T <4 S+ 0 0 75 -3,-2.3 -2,-0.2 -14,-0.1 -1,-0.1 0.830 102.2 70.1 -86.6 -37.4 -41.5 57.3 -17.9 600 119 B T < - 0 0 0 -4,-1.0 -57,-2.3 -5,-0.1 -56,-0.4 -0.369 58.1-153.4 -93.2 160.2 -43.1 55.7 -14.8 601 120 B E E -DE 542 583K 44 -18,-1.4 -18,-2.6 -59,-0.3 2,-0.3 -0.941 19.2-176.9-124.5 155.2 -46.3 53.5 -14.3 602 121 B A E +DE 541 582K 0 -61,-3.0 -61,-1.0 -2,-0.3 2,-0.3 -0.947 17.5 175.2-148.6 165.2 -48.4 53.3 -11.1 603 122 B R E - E 0 581K 48 -22,-1.7 -22,-3.3 -2,-0.3 -68,-0.2 -0.953 44.7 -84.4-160.5 158.5 -51.3 51.8 -9.2 604 123 B L E - E 0 580K 2 -70,-2.6 -24,-0.3 -2,-0.3 -25,-0.1 -0.396 48.1-118.6 -61.8 141.4 -52.8 51.9 -5.7 605 124 B S > - 0 0 6 -26,-1.6 4,-1.2 1,-0.1 -69,-0.3 -0.356 27.4-105.5 -71.6 163.2 -51.1 49.6 -3.3 606 125 B E H > S+ 0 0 67 1,-0.2 4,-0.5 2,-0.2 3,-0.4 0.909 121.3 50.7 -58.7 -39.4 -53.2 46.8 -1.7 607 126 B I H >> S+ 0 0 7 -29,-0.3 3,-1.4 1,-0.2 4,-0.6 0.846 100.5 62.7 -70.2 -30.9 -53.3 48.7 1.7 608 127 B A H >> S+ 0 0 0 1,-0.3 3,-0.9 -30,-0.3 4,-0.8 0.835 93.1 66.7 -57.0 -35.4 -54.5 51.9 -0.1 609 128 B G H >X S+ 0 0 28 -4,-1.2 3,-0.7 -3,-0.4 4,-0.7 0.841 95.0 56.3 -49.2 -38.3 -57.5 49.8 -1.0 610 129 B Y H << S+ 0 0 54 -3,-1.4 29,-1.9 -4,-0.5 -1,-0.2 0.681 98.9 58.5 -76.2 -20.1 -58.4 49.7 2.7 611 130 B L H << S+ 0 0 0 -3,-0.9 27,-2.2 -4,-0.6 -1,-0.2 0.728 114.2 39.2 -73.4 -22.3 -58.5 53.5 3.0 612 131 B L H X< S+ 0 0 5 -4,-0.8 3,-2.1 -3,-0.7 4,-0.2 0.496 84.1 135.3-104.8 -9.2 -61.1 53.5 0.2 613 132 B Q T 3< S+ 0 0 61 -4,-0.7 -3,-0.1 1,-0.3 -4,-0.0 -0.119 77.0 7.5 -50.7 128.7 -63.1 50.5 1.4 614 133 B D T > S+ 0 0 19 1,-0.1 3,-1.4 23,-0.0 5,-0.5 0.585 84.8 131.7 76.5 12.0 -66.9 51.0 1.3 615 134 B I G X + 0 0 15 -3,-2.1 3,-0.7 1,-0.3 4,-0.2 0.793 68.9 58.8 -65.1 -26.6 -66.6 54.4 -0.4 616 135 B E G 3 S+ 0 0 130 1,-0.2 -1,-0.3 -4,-0.2 -3,-0.1 0.609 93.2 73.0 -74.0 -11.4 -69.2 53.3 -2.9 617 136 B K G < S- 0 0 41 -3,-1.4 227,-0.3 1,-0.0 -1,-0.2 -0.047 112.0-105.7 -99.4 30.2 -71.7 52.7 0.0 618 137 B K S < S+ 0 0 112 -3,-0.7 -3,-0.1 1,-0.1 -2,-0.1 0.870 75.3 137.9 56.0 45.7 -72.4 56.4 1.0 619 138 B T + 0 0 7 -5,-0.5 221,-0.2 -4,-0.2 222,-0.2 0.254 59.4 39.5-104.3 8.4 -70.2 56.2 4.1 620 139 B V S S- 0 0 14 -5,-0.2 2,-0.3 220,-0.1 -1,-0.1 -0.983 90.9 -92.9-168.6 138.0 -68.5 59.5 3.9 621 140 B P - 0 0 74 0, 0.0 13,-2.3 0, 0.0 14,-0.4 -0.468 38.5-157.8 -75.2 128.9 -69.6 63.1 2.9 622 141 B F E -F 633 0L 63 -2,-0.3 2,-0.3 11,-0.2 9,-0.0 -0.672 7.0-168.1-104.0 157.1 -69.1 64.2 -0.8 623 142 B A E -F 632 0L 38 9,-2.6 9,-3.4 -2,-0.2 2,-0.1 -0.941 31.1 -94.4-137.1 159.0 -68.8 67.6 -2.3 624 143 B W E -F 631 0L 151 -2,-0.3 7,-0.2 7,-0.2 2,-0.1 -0.460 40.6-125.0 -70.4 145.9 -68.8 69.1 -5.8 625 144 B N > - 0 0 3 5,-2.7 3,-1.3 -2,-0.1 -71,-0.1 -0.353 37.9 -87.1 -83.1 171.7 -65.5 69.5 -7.6 626 145 B F T 3 S+ 0 0 61 -72,-0.3 701,-0.1 1,-0.3 -72,-0.1 0.788 130.4 52.8 -50.0 -32.3 -64.3 72.9 -9.1 627 146 B D T 3 S- 0 0 73 -74,-0.3 -1,-0.3 3,-0.1 700,-0.2 0.883 97.9-136.2 -63.4 -40.4 -66.1 71.9 -12.3 628 147 B D S < S+ 0 0 114 -3,-1.3 -2,-0.1 2,-0.3 3,-0.1 0.658 83.4 106.7 68.5 24.6 -69.4 71.2 -10.6 629 148 B T S S+ 0 0 85 1,-0.2 2,-0.3 -76,-0.2 -3,-0.1 0.619 78.6 21.4 -99.8 -17.5 -69.1 68.3 -13.0 630 149 B E S S- 0 0 46 -77,-0.1 -5,-2.7 -5,-0.1 2,-0.3 -0.996 70.4-119.4-156.3 147.0 -68.3 65.6 -10.4 631 150 B K E -F 624 0L 90 -2,-0.3 -7,-0.2 -7,-0.2 -9,-0.0 -0.726 28.2-169.8 -90.4 139.9 -68.6 64.8 -6.7 632 151 B E E -F 623 0L 18 -9,-3.4 -9,-2.6 -2,-0.3 2,-0.2 -0.936 27.7-103.8-127.0 153.7 -65.4 64.1 -4.7 633 152 B P E -F 622 0L 6 0, 0.0 -11,-0.2 0, 0.0 3,-0.1 -0.510 15.1-155.8 -78.6 144.7 -65.0 62.7 -1.2 634 153 B T S S+ 0 0 57 -13,-2.3 2,-0.3 1,-0.3 -12,-0.1 0.594 84.2 4.2 -91.7 -13.0 -64.1 65.2 1.7 635 154 B V S S- 0 0 0 -14,-0.4 -1,-0.3 -120,-0.1 0, 0.0 -0.955 80.2-115.7-161.0 152.4 -62.6 62.4 3.7 636 155 B L - 0 0 0 -2,-0.3 -24,-0.2 -3,-0.1 -118,-0.1 -0.662 27.6-113.7 -93.4 153.7 -61.9 58.7 3.0 637 156 B P - 0 0 0 0, 0.0 -25,-0.2 0, 0.0 200,-0.1 0.786 44.5-159.5 -48.9 -34.2 -63.5 55.8 5.0 638 157 B A - 0 0 0 -27,-2.2 -27,-0.2 1,-0.1 -26,-0.1 0.954 17.4-169.7 49.7 82.3 -60.0 54.9 6.4 639 158 B A S S+ 0 0 4 -29,-1.9 -28,-0.2 2,-0.1 312,-0.2 0.455 79.1 38.9 -83.1 -1.3 -60.1 51.3 7.5 640 159 B F S S- 0 0 0 -30,-0.1 2,-1.8 -124,-0.1 3,-0.1 -0.967 101.3-100.2-136.4 157.5 -56.8 51.8 9.2 641 160 B P >> + 0 0 5 0, 0.0 4,-1.9 0, 0.0 3,-0.5 -0.510 43.9 174.8 -77.5 81.7 -55.5 54.9 11.1 642 161 B N H 3>> + 0 0 4 -2,-1.8 4,-2.4 -127,-0.2 5,-0.7 0.784 65.5 70.0 -64.2 -30.1 -53.5 56.5 8.4 643 162 B L H 3>5S+ 0 0 3 -128,-0.4 4,-1.0 1,-0.2 -1,-0.2 0.930 111.8 27.2 -54.0 -54.0 -52.7 59.6 10.3 644 163 B L H <45S+ 0 0 1 -3,-0.5 18,-0.3 2,-0.2 -1,-0.2 0.889 119.3 58.4 -76.8 -37.6 -50.4 58.0 12.8 645 164 B V H <5S+ 0 0 0 -4,-1.9 17,-1.2 16,-0.2 -69,-0.2 0.879 123.9 16.2 -65.8 -44.1 -49.3 55.1 10.6 646 165 B N H <5S- 0 0 3 -4,-2.4 -1,-0.2 15,-0.2 -3,-0.2 0.595 97.3-151.4-106.2 -14.8 -47.8 57.1 7.7 647 166 B G << - 0 0 9 -4,-1.0 2,-0.3 -5,-0.7 -1,-0.2 -0.264 5.7-127.0 76.9-163.2 -47.4 60.5 9.4 648 167 B S E -G 659 0M 6 11,-1.9 11,-2.4 -4,-0.1 2,-0.2 -0.949 9.2-145.0 178.3 163.6 -47.5 63.9 7.7 649 168 B T E -G 658 0M 32 -2,-0.3 9,-0.2 9,-0.2 2,-0.1 -0.610 21.6-174.0 165.5 118.5 -45.5 67.1 7.3 650 169 B G E +G 657 0M 8 7,-0.6 7,-1.7 -2,-0.2 2,-0.2 -0.627 30.9 174.2 136.6 73.4 -46.5 69.9 7.0 651 170 B I E +G 656 0M 138 -141,-0.3 5,-0.2 5,-0.3 -140,-0.1 -0.736 30.7 136.9-150.9 106.7 -46.1 73.7 6.4 652 171 B S - 0 0 24 3,-2.1 2,-0.5 -2,-0.2 -146,-0.1 0.069 60.4 -53.9-115.0-136.0 -49.0 76.2 6.0 653 172 B A S S- 0 0 10 -151,-0.3 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-19.8 1324 ! 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 1325 577 D L 0 0 122 0, 0.0 2,-0.7 0, 0.0 -17,-0.2 0.000 360.0 360.0 360.0 129.0 -71.4 78.3 -17.5 1326 578 D Q E -S 1307 0Q 42 -19,-2.1 -19,-1.8 -1270,-0.0 2,-0.9 -0.888 360.0-153.8 -95.8 114.5 -67.6 78.3 -17.6 1327 579 D R E -S 1306 0Q 55 -2,-0.7 -21,-0.2 -21,-0.2 2,-0.1 -0.787 23.3-126.8 -90.1 103.4 -66.2 79.1 -14.1 1328 580 D Y - 0 0 30 -23,-2.0 -58,-0.1 -2,-0.9 3,-0.1 -0.288 23.5-171.9 -60.1 120.3 -62.7 80.6 -14.8 1329 581 D K - 0 0 65 1,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.408 66.7 -35.6 -89.8 -2.9 -60.0 78.8 -12.8 1330 582 D G S > S- 0 0 10 -61,-0.1 3,-1.3 -60,-0.1 -1,-0.2 -0.914 70.6 -74.6 162.7 174.2 -57.4 81.4 -13.8 1331 583 D L G > S+ 0 0 3 -2,-0.3 3,-0.9 1,-0.2 8,-0.1 0.654 115.3 73.3 -67.4 -16.0 -56.0 83.7 -16.5 1332 584 D G G 3 S+ 0 0 6 1,-0.2 -1230,-0.3 -1231,-0.1 -1,-0.2 0.560 90.1 55.7 -77.8 -9.7 -54.6 80.7 -18.4 1333 585 D E G < S+ 0 0 9 -3,-1.3 2,-0.4 -1232,-0.1 -1,-0.2 0.438 91.8 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-4,-2.8 -3,-0.2 -5,-0.2 -41,-0.2 0.712 122.9 45.4-131.2 -32.5 -59.9 93.3 -17.8 1344 596 D M T - 0 0 76 1,-0.1 4,-1.2 2,-0.0 -1,-0.3 -0.880 65.7-162.7-138.9 104.9 -54.7 105.2 7.8 1359 611 D L H > S+ 0 0 95 -2,-0.4 4,-0.9 1,-0.2 -1,-0.1 0.836 90.5 43.3 -57.9 -40.9 -50.8 105.0 8.1 1360 612 D A H > S+ 0 0 68 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.937 114.7 47.7 -71.5 -47.0 -50.7 103.5 11.6 1361 613 D R H 4 S+ 0 0 115 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.606 113.0 50.4 -72.6 -11.6 -53.6 100.9 11.0 1362 614 D A H X S+ 0 0 0 -4,-1.2 4,-1.8 2,-0.1 -1,-0.2 0.637 107.8 53.1 -95.2 -20.9 -51.9 99.8 7.7 1363 615 D E H X S+ 0 0 72 -4,-0.9 4,-2.1 -3,-0.4 5,-0.2 0.920 108.0 48.3 -75.8 -46.8 -48.5 99.4 9.4 1364 616 D R H X S+ 0 0 72 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.630 114.5 52.3 -65.6 -11.2 -49.9 97.1 12.1 1365 617 D R H > S+ 0 0 64 -5,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.871 109.2 41.6 -95.3 -43.8 -51.6 95.2 9.3 1366 618 D V H X S+ 0 0 4 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.830 118.8 51.1 -71.4 -28.5 -48.7 94.6 6.9 1367 619 D N H X S+ 0 0 59 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.921 108.5 46.0 -75.4 -45.4 -46.6 93.7 9.9 1368 620 D V H < S+ 0 0 22 -4,-1.0 9,-0.2 -5,-0.2 -1,-0.2 0.947 122.9 39.2 -59.0 -43.8 -48.9 91.2 11.6 1369 621 D L H < S+ 0 0 0 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.846 129.4 22.0 -77.7 -38.4 -49.5 89.5 8.3 1370 622 D M H < S+ 0 0 0 -4,-2.2 -144,-0.3 -5,-0.1 -3,-0.2 0.381 98.3 105.1-116.5 3.9 -46.1 89.5 6.5 1371 623 D G S < S- 0 0 10 -4,-1.4 -144,-0.2 2,-0.2 6,-0.1 -0.334 79.2-100.4 -92.6 165.1 -43.5 89.9 9.3 1372 624 D D S S+ 0 0 97 -146,-0.5 -145,-0.1 -2,-0.1 -1,-0.1 0.905 93.1 89.5 -38.5 -59.7 -41.0 87.7 11.1 1373 625 D K > - 0 0 58 1,-0.1 4,-0.7 -6,-0.1 -2,-0.2 -0.218 52.6-173.8 -61.9 128.7 -43.1 87.0 14.2 1374 626 D V H > S+ 0 0 84 2,-0.1 4,-2.4 3,-0.1 5,-0.2 0.825 74.6 61.6 -91.8 -37.0 -45.3 84.0 13.9 1375 627 D E H > S+ 0 0 76 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.971 101.9 52.3 -56.9 -53.3 -47.4 84.1 17.1 1376 628 D P H > S+ 0 0 66 0, 0.0 4,-2.6 0, 0.0 3,-0.2 0.923 111.9 47.6 -49.2 -49.8 -49.0 87.4 16.2 1377 629 D R H X S+ 0 0 10 -4,-0.7 4,-2.7 1,-0.2 -2,-0.2 0.900 108.2 53.7 -55.6 -48.3 -50.0 86.1 12.8 1378 630 D R H X S+ 0 0 42 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.887 112.6 45.8 -52.1 -41.1 -51.4 82.8 14.3 1379 631 D K H X S+ 0 0 38 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.892 109.0 53.0 -75.3 -39.8 -53.6 85.0 16.6 1380 632 D W H X S+ 0 0 35 -4,-2.6 4,-2.6 -5,-0.3 5,-0.3 0.917 112.6 46.7 -57.7 -41.2 -54.7 87.3 13.8 1381 633 D I H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.963 112.3 49.6 -65.4 -49.7 -55.8 84.2 11.9 1382 634 D E H < S+ 0 0 110 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.872 117.0 41.5 -55.2 -42.1 -57.5 82.8 15.0 1383 635 D D H < S+ 0 0 132 -4,-2.9 -1,-0.2 1,-0.1 -2,-0.2 0.896 126.9 26.8 -73.9 -43.1 -59.4 86.1 15.6 1384 636 D N H < S+ 0 0 95 -4,-2.6 2,-0.8 -5,-0.2 -3,-0.2 0.697 99.7 80.9-100.7 -22.7 -60.4 87.1 12.1 1385 637 D V < - 0 0 15 -4,-2.6 2,-0.7 -5,-0.3 -1,-0.1 -0.784 63.5-152.7 -96.7 109.8 -60.7 83.9 9.9 1386 638 D K - 0 0 76 -2,-0.8 -3,-0.1 1,-0.2 -4,-0.1 -0.696 14.4-177.4 -83.9 114.4 -63.9 82.1 10.3 1387 639 D F 0 0 25 -2,-0.7 -1,-0.2 1,-0.2 -2,-0.0 0.635 360.0 360.0 -80.9 -15.8 -63.5 78.4 9.6 1388 640 D T 0 0 116 -3,-0.1 -1,-0.2 0, 0.0 -3,-0.0 -0.046 360.0 360.0 77.2 360.0 -67.3 77.9 10.2