==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 10-MAR-06 2GBB . COMPND 2 MOLECULE: PUTATIVE CHORISMATE MUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PESTIS BIOVAR MICROTUS STR. . AUTHOR J.E.LADNER,P.T.REDDY,B.C.NELSON,H.ROBINSON,S.-K.KIM . 622 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28319.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 458 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 1.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 14 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 363 58.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 0 0 0 4 2 2 4 4 0 0 0 0 0 3 1 0 0 0 0 0 4 2 0 0 2 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 31 A Q 0 0 201 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 107.3 32.7 95.5 64.7 2 32 A Q + 0 0 98 1,-0.3 3,-0.4 120,-0.1 2,-0.4 0.662 360.0 43.4-126.1 -49.7 36.4 95.4 64.0 3 33 A a S S+ 0 0 15 1,-0.2 -1,-0.3 114,-0.1 120,-0.1 -0.870 109.1 26.1-114.4 141.0 37.5 92.1 62.3 4 34 A G S S+ 0 0 9 -2,-0.4 -1,-0.2 -3,-0.1 119,-0.1 0.696 83.6 118.2 80.1 25.3 35.6 90.3 59.4 5 35 A Q + 0 0 55 -3,-0.4 4,-0.5 105,-0.1 106,-0.1 0.278 46.4 82.8-106.5 14.5 34.0 93.6 58.2 6 36 A T S >> S+ 0 0 2 1,-0.1 4,-1.8 2,-0.1 3,-1.1 0.924 78.8 63.0 -83.3 -46.6 35.5 93.8 54.6 7 37 A A H 3> S+ 0 0 1 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.808 96.3 58.4 -49.7 -42.6 33.1 91.5 52.7 8 38 A P H 3> S+ 0 0 55 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.874 108.9 47.5 -56.3 -36.4 30.0 93.7 53.3 9 39 A L H <> S+ 0 0 36 -3,-1.1 4,-2.3 -4,-0.5 -2,-0.2 0.899 110.8 49.4 -70.2 -42.7 31.9 96.6 51.6 10 40 A I H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 5,-0.2 0.936 111.0 51.7 -64.2 -44.2 32.9 94.5 48.7 11 41 A N H X S+ 0 0 37 -4,-3.0 4,-1.1 1,-0.2 -2,-0.2 0.908 109.5 48.3 -53.6 -49.1 29.3 93.4 48.3 12 42 A E H < S+ 0 0 18 -4,-2.0 4,-0.4 2,-0.2 -1,-0.2 0.863 107.6 55.9 -62.9 -39.1 28.0 97.0 48.3 13 43 A R H >< S+ 0 0 8 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.960 108.6 48.1 -53.8 -48.7 30.6 98.0 45.7 14 44 A L H >< S+ 0 0 2 -4,-2.2 3,-1.5 1,-0.3 4,-0.3 0.734 94.9 74.2 -71.0 -19.2 29.3 95.2 43.4 15 45 A S T 3< S+ 0 0 48 -4,-1.1 3,-0.3 1,-0.2 4,-0.3 0.681 91.7 58.7 -66.2 -17.5 25.6 96.3 44.0 16 46 A Y T <> S+ 0 0 46 -3,-1.4 4,-1.3 -4,-0.4 -1,-0.2 0.470 81.4 85.8 -83.9 -5.9 26.3 99.3 41.7 17 47 A X H <> S+ 0 0 8 -3,-1.5 4,-2.8 1,-0.2 5,-0.2 0.767 77.7 63.1 -80.5 -21.6 27.3 97.3 38.7 18 48 A K H > S+ 0 0 47 -4,-0.3 4,-2.4 -3,-0.3 -1,-0.2 0.934 105.3 49.1 -60.9 -43.7 23.8 96.8 37.4 19 49 A D H > S+ 0 0 15 -4,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.866 110.8 49.0 -62.4 -38.4 23.7 100.6 36.9 20 50 A V H X S+ 0 0 6 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.936 111.9 49.3 -66.4 -43.6 27.0 100.6 35.1 21 51 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.878 111.8 49.3 -58.4 -43.8 25.8 97.7 32.8 22 52 A G H X S+ 0 0 5 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.890 109.5 50.9 -65.6 -43.4 22.6 99.7 32.2 23 53 A Y H X S+ 0 0 59 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.924 114.1 45.8 -54.5 -46.6 24.6 102.9 31.3 24 54 A K H <>S+ 0 0 16 -4,-2.4 5,-2.9 2,-0.2 4,-0.4 0.930 112.2 48.6 -67.1 -45.2 26.7 100.9 28.9 25 55 A A H ><5S+ 0 0 25 -4,-2.6 3,-1.4 1,-0.2 -2,-0.2 0.937 109.3 54.2 -61.0 -46.3 23.8 99.0 27.2 26 56 A E H 3<5S+ 0 0 125 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.806 117.1 37.5 -51.9 -38.0 21.9 102.4 26.8 27 57 A N T 3<5S- 0 0 86 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.361 109.1-120.0-103.5 5.2 24.9 103.8 25.0 28 58 A H T < 5 + 0 0 94 -3,-1.4 -3,-0.2 -4,-0.4 -4,-0.1 0.870 59.3 158.3 56.1 39.2 25.9 100.6 23.1 29 59 A L < - 0 0 64 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.735 46.3-105.7 -95.2 146.1 29.3 100.7 24.9 30 60 A P - 0 0 57 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.323 21.0-132.0 -61.5 148.6 31.6 97.7 25.4 31 61 A I S S+ 0 0 4 1,-0.0 2,-0.5 39,-0.0 42,-0.1 0.902 92.1 68.7 -65.8 -41.8 31.7 96.2 28.9 32 62 A E + 0 0 34 153,-0.1 2,-0.4 38,-0.0 -1,-0.0 -0.680 55.4 165.5 -88.6 124.4 35.5 96.2 28.9 33 63 A D > - 0 0 67 -2,-0.5 4,-1.8 1,-0.1 3,-0.1 -0.857 14.9-170.5-142.5 97.0 37.2 99.5 29.0 34 64 A R H > S+ 0 0 134 -2,-0.4 4,-2.8 1,-0.2 5,-0.2 0.748 84.9 59.8 -66.7 -29.5 40.9 99.3 29.8 35 65 A I H > S+ 0 0 141 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.953 109.0 44.0 -60.1 -51.4 41.4 103.0 30.2 36 66 A Q H > S+ 0 0 42 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.877 112.9 53.4 -60.5 -39.3 38.8 103.0 33.0 37 67 A E H X S+ 0 0 30 -4,-1.8 4,-2.6 1,-0.2 5,-0.2 0.948 108.4 47.7 -65.6 -44.9 40.3 99.8 34.5 38 68 A E H X S+ 0 0 109 -4,-2.8 4,-3.5 1,-0.2 -1,-0.2 0.882 111.2 52.9 -61.5 -36.3 43.9 101.3 34.7 39 69 A K H X S+ 0 0 136 -4,-1.8 4,-2.5 -5,-0.2 5,-0.2 0.938 110.4 45.9 -62.8 -44.7 42.4 104.4 36.2 40 70 A V H X S+ 0 0 28 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.925 116.4 46.4 -66.3 -43.0 40.6 102.4 38.9 41 71 A I H X S+ 0 0 10 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.932 111.8 49.9 -63.4 -50.6 43.8 100.3 39.6 42 72 A N H X S+ 0 0 41 -4,-3.5 4,-1.9 1,-0.2 -2,-0.2 0.911 113.3 46.0 -59.5 -43.9 46.1 103.4 39.7 43 73 A S H X S+ 0 0 67 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.904 112.2 50.7 -62.8 -45.3 43.8 105.3 42.2 44 74 A A H X S+ 0 0 1 -4,-2.2 4,-3.0 -5,-0.2 -2,-0.2 0.951 110.5 50.1 -58.3 -47.8 43.4 102.2 44.4 45 75 A X H X S+ 0 0 68 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.861 110.7 49.0 -60.4 -36.6 47.2 101.8 44.4 46 76 A A H X S+ 0 0 48 -4,-1.9 4,-1.2 -5,-0.2 -1,-0.2 0.892 112.5 48.0 -70.3 -39.1 47.7 105.4 45.4 47 77 A Q H >X S+ 0 0 52 -4,-2.6 4,-1.5 2,-0.2 3,-0.8 0.963 106.3 56.5 -62.7 -52.6 45.1 105.1 48.2 48 78 A A H 3<>S+ 0 0 0 -4,-3.0 5,-2.9 1,-0.3 3,-0.4 0.887 104.1 56.8 -40.0 -48.4 46.8 101.9 49.4 49 79 A E H ><5S+ 0 0 153 -4,-1.6 3,-0.8 1,-0.2 -1,-0.3 0.864 106.6 46.9 -46.4 -50.0 50.0 104.1 49.7 50 80 A S H <<5S+ 0 0 97 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.733 111.1 53.8 -72.8 -18.6 48.3 106.6 52.1 51 81 A L T 3<5S- 0 0 36 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.375 118.1-104.0-100.3 7.7 46.9 103.8 54.2 52 82 A G T < 5S+ 0 0 28 -3,-0.8 104,-2.7 -4,-0.3 2,-0.3 0.700 76.8 137.3 78.5 18.5 50.1 101.9 54.9 53 83 A L B < -A 155 0A 3 -5,-2.9 2,-0.8 103,-0.3 -1,-0.3 -0.690 66.6-105.0 -94.1 149.4 49.3 99.2 52.4 54 84 A N > - 0 0 63 100,-2.7 4,-0.6 -2,-0.3 3,-0.4 -0.712 32.7-147.4 -67.9 111.1 51.8 97.7 50.0 55 85 A G H >> S+ 0 0 17 -2,-0.8 3,-1.1 1,-0.2 4,-0.6 0.872 94.2 45.5 -51.7 -52.9 50.7 99.2 46.7 56 86 A E H >4 S+ 0 0 46 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.836 105.0 63.5 -62.6 -32.7 51.5 96.4 44.3 57 87 A S H 34 S+ 0 0 19 -3,-0.4 4,-0.4 1,-0.2 -1,-0.2 0.672 99.8 56.8 -65.4 -17.8 49.9 93.8 46.8 58 88 A I H S+ 0 0 55 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.919 109.9 49.0 -56.6 -41.7 45.3 91.5 42.3 61 91 A L H > S+ 0 0 0 88,-0.4 4,-2.6 -4,-0.4 -2,-0.2 0.907 111.5 48.1 -62.9 -44.6 42.3 92.4 44.5 62 92 A X H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.957 112.4 49.6 -61.2 -47.7 41.5 95.3 42.2 63 93 A V H X S+ 0 0 56 -4,-3.3 4,-2.6 1,-0.2 -2,-0.2 0.925 112.7 47.9 -51.4 -49.1 41.8 93.0 39.2 64 94 A A H X S+ 0 0 5 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.896 112.3 48.4 -61.9 -40.3 39.5 90.4 41.0 65 95 A Q H X S+ 0 0 1 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.899 111.3 49.5 -68.8 -40.5 37.0 93.0 41.8 66 96 A I H X S+ 0 0 17 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.906 110.0 51.9 -65.4 -44.7 36.9 94.4 38.3 67 97 A N H X S+ 0 0 43 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.906 110.3 48.0 -52.3 -48.4 36.5 90.9 36.8 68 98 A A H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.910 112.3 49.6 -60.3 -44.2 33.5 90.2 39.1 69 99 A A H X S+ 0 0 4 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.934 113.0 45.7 -60.1 -50.1 32.0 93.6 38.1 70 100 A K H X S+ 0 0 11 -4,-2.9 4,-3.4 2,-0.2 5,-0.3 0.919 109.6 56.0 -58.5 -42.3 32.5 92.8 34.4 71 101 A A H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.947 110.1 45.7 -55.4 -46.5 31.1 89.3 34.9 72 102 A I H X S+ 0 0 2 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.926 114.1 47.9 -60.2 -48.0 27.9 90.9 36.4 73 103 A Q H X S+ 0 0 8 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.895 109.7 51.8 -63.0 -45.0 27.6 93.5 33.7 74 104 A Y H X S+ 0 0 6 -4,-3.4 4,-2.4 2,-0.2 -1,-0.2 0.914 109.5 50.7 -57.1 -44.0 28.1 91.0 30.9 75 105 A R H X S+ 0 0 18 -4,-2.0 4,-2.3 -5,-0.3 -2,-0.2 0.883 110.4 49.2 -63.1 -41.3 25.3 88.8 32.4 76 106 A Y H X S+ 0 0 22 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.899 108.5 52.8 -63.7 -43.5 23.0 91.8 32.5 77 107 A R H X S+ 0 0 14 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.942 111.0 48.2 -58.7 -44.2 23.7 92.7 28.9 78 108 A A H >X S+ 0 0 0 -4,-2.4 3,-0.9 1,-0.2 4,-0.7 0.962 112.5 47.9 -58.4 -50.6 22.8 89.1 27.9 79 109 A D H >X S+ 0 0 34 -4,-2.3 4,-2.4 1,-0.3 3,-0.9 0.856 105.6 56.2 -61.9 -40.8 19.6 89.1 29.9 80 110 A W H 3< S+ 0 0 29 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.733 92.3 72.4 -70.7 -22.1 18.2 92.4 28.7 81 111 A L H << S+ 0 0 44 -4,-1.0 -1,-0.2 -3,-0.9 -2,-0.2 0.866 118.7 17.2 -57.9 -38.8 18.5 91.3 25.1 82 112 A S H << S+ 0 0 25 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.647 141.0 33.7-105.4 -20.1 15.5 89.0 25.5 83 113 A Q S < S- 0 0 112 -4,-2.4 2,-0.5 -5,-0.2 -1,-0.2 -0.627 72.0-176.4-138.2 78.6 14.1 90.5 28.8 84 114 A P - 0 0 86 0, 0.0 -4,-0.1 0, 0.0 -3,-0.0 -0.010 23.8-138.4 -83.4 25.9 14.7 94.2 28.8 85 115 A E > - 0 0 74 -2,-0.5 3,-1.7 1,-0.1 -5,-0.0 0.732 24.7-159.6 34.6 56.1 13.5 95.7 32.2 86 116 A P T 3 S+ 0 0 119 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.311 73.9 24.6 -70.3 150.7 11.7 98.9 30.9 87 117 A G T 3 S+ 0 0 93 1,-0.3 2,-0.5 0, 0.0 -2,-0.1 0.695 92.4 107.2 55.9 13.7 11.3 101.6 33.5 88 118 A W < - 0 0 73 -3,-1.7 -1,-0.3 2,-0.0 0, 0.0 -0.986 59.4-172.8 -93.4 129.2 14.1 100.3 35.5 89 119 A Q - 0 0 50 -2,-0.5 2,-0.1 -3,-0.1 -66,-0.1 -0.968 23.0-116.0-126.0 136.5 16.5 103.1 34.7 90 120 A P - 0 0 29 0, 0.0 3,-0.1 0, 0.0 -71,-0.1 -0.444 33.2-112.1 -66.6 144.6 20.2 103.3 35.5 91 121 A K - 0 0 123 1,-0.1 -68,-0.1 -2,-0.1 5,-0.1 -0.321 52.0 -73.8 -64.8 157.1 21.4 106.1 37.8 92 122 A P >> - 0 0 82 0, 0.0 4,-1.9 0, 0.0 3,-0.6 -0.362 46.1-126.6 -58.3 134.2 23.6 108.9 36.3 93 123 A L H 3> S+ 0 0 34 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.843 104.8 54.4 -51.2 -47.3 27.1 107.5 35.7 94 124 A D H 3> S+ 0 0 131 1,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.894 109.9 47.6 -63.2 -38.8 29.0 110.1 37.5 95 125 A D H <> S+ 0 0 91 -3,-0.6 4,-1.8 2,-0.2 -1,-0.3 0.877 113.0 48.9 -63.3 -42.0 27.0 109.5 40.7 96 126 A V H X S+ 0 0 2 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.940 111.6 48.6 -63.6 -47.4 27.4 105.7 40.4 97 127 A R H X S+ 0 0 68 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.791 108.1 53.4 -67.5 -30.6 31.2 105.9 39.9 98 128 A A H X S+ 0 0 60 -4,-1.6 4,-2.7 -5,-0.2 -1,-0.2 0.914 110.4 48.6 -68.9 -43.3 31.7 108.3 42.9 99 129 A N H X S+ 0 0 55 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.891 112.2 48.6 -57.7 -41.6 29.8 105.8 45.1 100 130 A I H X S+ 0 0 13 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.926 112.3 47.8 -64.4 -45.8 31.9 103.0 43.7 101 131 A G H X S+ 0 0 34 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.898 110.5 53.1 -65.9 -40.3 35.2 105.0 44.3 102 132 A E H X S+ 0 0 107 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.929 111.7 45.0 -57.3 -47.1 33.9 105.8 47.8 103 133 A L H X S+ 0 0 27 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.889 107.6 58.0 -69.0 -38.1 33.4 102.1 48.6 104 134 A S H X S+ 0 0 9 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.927 107.3 48.3 -55.2 -44.4 36.7 101.2 47.0 105 135 A T H X S+ 0 0 36 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.919 110.5 51.3 -58.4 -47.5 38.3 103.6 49.6 106 136 A K H X S+ 0 0 100 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.852 106.9 53.8 -63.0 -35.8 36.3 102.0 52.5 107 137 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.939 111.5 44.4 -64.9 -47.0 37.4 98.5 51.5 108 138 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.870 113.3 50.8 -66.7 -39.5 41.1 99.5 51.5 109 139 A E H X S+ 0 0 95 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.914 112.1 48.2 -60.8 -44.4 40.7 101.4 54.9 110 140 A Q H X S+ 0 0 37 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.889 111.4 48.6 -66.4 -43.5 39.0 98.3 56.4 111 141 A I H X S+ 0 0 1 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.913 112.1 49.4 -59.5 -44.6 41.6 95.9 55.1 112 142 A A H X S+ 0 0 3 -4,-2.2 4,-2.0 2,-0.2 5,-0.2 0.970 112.3 47.9 -60.8 -55.0 44.5 98.1 56.5 113 143 A E H X S+ 0 0 71 -4,-2.5 4,-2.9 1,-0.2 3,-0.4 0.950 114.5 46.4 -46.2 -55.6 42.8 98.4 59.9 114 144 A E H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.3 -1,-0.2 0.873 109.6 53.0 -59.7 -42.4 42.1 94.6 60.0 115 145 A L H < S+ 0 0 49 -4,-2.6 -1,-0.3 2,-0.2 -2,-0.2 0.823 115.2 42.4 -61.3 -37.3 45.7 93.7 58.9 116 146 A K H < S+ 0 0 131 -4,-2.0 -2,-0.2 -3,-0.4 -1,-0.2 0.924 128.4 26.4 -71.0 -47.6 47.0 95.9 61.7 117 147 A T H < S+ 0 0 94 -4,-2.9 2,-0.3 -5,-0.2 -2,-0.2 0.633 109.5 65.8 -97.7 -21.3 44.6 94.9 64.5 118 148 A a < - 0 0 17 -4,-3.0 -114,-0.0 -5,-0.3 0, 0.0 -0.713 69.2-120.1-115.4 156.2 43.4 91.3 63.7 119 149 A K >> - 0 0 146 -2,-0.3 4,-0.9 1,-0.1 3,-0.6 -0.524 37.1-116.6 -70.4 152.7 44.5 87.7 63.5 120 150 A P T 34 S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 0.557 120.2 62.0 -70.3 -3.0 43.9 86.2 60.0 121 151 A A T 34 S+ 0 0 93 1,-0.1 4,-0.1 4,-0.0 -3,-0.0 0.743 99.5 50.1 -84.1 -31.9 41.6 84.0 62.1 122 152 A E T <4 S+ 0 0 93 -3,-0.6 -1,-0.1 -8,-0.1 3,-0.1 0.704 101.3 85.0 -77.7 -18.7 39.4 86.9 63.1 123 153 A X S < S- 0 0 18 -4,-0.9 -120,-0.1 1,-0.2 -4,-0.0 -0.355 97.8 -68.1 -85.4 165.1 39.2 88.0 59.5 124 154 A G - 0 0 10 -2,-0.1 2,-0.2 1,-0.1 -1,-0.2 -0.163 49.8-152.5 -54.2 135.2 36.7 86.8 56.9 125 155 A D >> - 0 0 94 -3,-0.1 4,-2.3 -121,-0.1 3,-0.6 -0.597 35.2 -89.1-103.7 173.4 37.1 83.2 55.7 126 156 A K H 3> S+ 0 0 117 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.823 126.6 45.9 -51.9 -39.8 36.1 81.6 52.4 127 157 A A H 3> S+ 0 0 49 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.796 108.6 55.1 -77.3 -34.4 32.6 80.7 53.5 128 158 A H H <> S+ 0 0 66 -3,-0.6 4,-1.4 2,-0.2 5,-0.2 0.917 108.0 50.1 -61.9 -44.6 32.0 84.1 55.0 129 159 A F H >X S+ 0 0 2 -4,-2.3 4,-3.4 2,-0.2 3,-0.5 0.956 111.9 47.3 -60.0 -51.6 32.8 85.7 51.7 130 160 A I H 3< S+ 0 0 47 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.945 114.8 45.1 -52.8 -50.9 30.5 83.5 49.8 131 161 A N H 3< S+ 0 0 121 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.711 121.8 39.1 -68.2 -20.0 27.6 84.0 52.2 132 162 A T H << S+ 0 0 34 -4,-1.4 2,-1.2 -3,-0.5 -2,-0.2 0.778 105.4 62.6-102.3 -38.3 28.1 87.7 52.4 133 163 A I < + 0 0 4 -4,-3.4 2,-0.4 -5,-0.2 -1,-0.2 -0.767 68.6 143.7 -96.0 90.2 29.0 88.6 48.8 134 164 A R + 0 0 190 -2,-1.2 2,-0.3 -3,-0.1 5,-0.1 -0.994 12.0 152.8-128.6 123.1 25.8 87.7 47.0 135 165 A Q > - 0 0 56 -2,-0.4 3,-1.6 3,-0.3 -120,-0.0 -0.982 52.6 -89.8-141.4 151.3 24.4 89.7 44.0 136 166 A H T 3 S+ 0 0 115 -2,-0.3 3,-0.1 1,-0.2 -118,-0.0 -0.350 115.3 18.4 -52.2 137.2 22.2 88.7 41.1 137 167 A N T 3 S+ 0 0 27 1,-0.2 2,-0.5 -62,-0.1 -1,-0.2 0.616 98.8 113.5 72.1 15.3 24.5 87.7 38.2 138 168 A L < - 0 0 23 -3,-1.6 -3,-0.3 -66,-0.1 -1,-0.2 -0.966 52.1-152.9-119.0 127.2 27.6 87.0 40.4 139 169 A T > - 0 0 48 -2,-0.5 4,-1.8 1,-0.1 5,-0.1 -0.460 27.5-113.4 -98.9 169.1 28.9 83.5 40.8 140 170 A S H > S+ 0 0 61 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.884 119.0 56.4 -63.4 -41.6 30.8 81.7 43.5 141 171 A A H > S+ 0 0 20 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.882 106.5 51.6 -53.7 -37.3 33.8 81.4 41.2 142 172 A D H > S+ 0 0 4 1,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.919 113.6 43.7 -65.6 -43.1 33.7 85.2 40.9 143 173 A V H X S+ 0 0 3 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.867 107.7 58.0 -72.4 -38.0 33.7 85.6 44.7 144 174 A E H X S+ 0 0 75 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.856 104.1 52.9 -62.4 -35.0 36.4 83.0 45.3 145 175 A A H X S+ 0 0 38 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.852 109.5 49.6 -64.5 -33.2 38.8 85.0 43.1 146 176 A I H X S+ 0 0 0 -4,-1.0 4,-2.0 -82,-0.2 -2,-0.2 0.924 111.4 49.1 -72.7 -41.5 38.0 88.0 45.2 147 177 A F H X S+ 0 0 28 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.896 109.6 50.3 -63.3 -44.5 38.7 86.1 48.4 148 178 A S H < S+ 0 0 66 -4,-2.3 4,-0.2 1,-0.2 -1,-0.2 0.911 114.1 43.5 -69.4 -33.4 41.9 84.7 47.3 149 179 A T H >X S+ 0 0 22 -4,-1.7 3,-1.4 1,-0.2 4,-0.6 0.827 105.4 63.4 -75.5 -33.5 43.4 88.1 46.2 150 180 A F H >< S+ 0 0 5 -4,-2.0 3,-1.1 1,-0.3 -1,-0.2 0.905 101.1 52.6 -53.1 -41.2 42.0 89.7 49.3 151 181 A N T 3< S+ 0 0 66 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.582 100.2 63.1 -73.3 -10.2 44.4 87.5 51.3 152 182 A Q T <4 S+ 0 0 114 -3,-1.4 2,-0.3 -4,-0.2 -1,-0.2 0.605 78.1 105.7 -87.4 -14.4 47.3 88.6 49.1 153 183 A V << - 0 0 3 -3,-1.1 2,-0.3 -4,-0.6 -95,-0.1 -0.515 52.1-178.5 -72.1 130.0 46.9 92.2 50.4 154 184 A K - 0 0 112 -100,-0.3 -100,-2.7 -2,-0.3 -97,-0.1 -0.882 27.1-107.9-127.1 155.6 49.8 93.1 52.8 155 185 A L B A 53 0A 66 -2,-0.3 -102,-0.3 -102,-0.3 -103,-0.1 -0.346 360.0 360.0 -66.8 156.5 50.9 96.0 55.0 156 186 A K 0 0 191 -104,-2.7 -103,-0.3 -2,-0.1 -102,-0.2 -0.015 360.0 360.0 169.4 360.0 54.0 98.1 54.1 157 !* 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 0.0 158 32 B Q 0 0 125 0, 0.0 3,-0.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-119.3 11.9 69.4 4.4 159 33 B b + 0 0 13 1,-0.2 120,-0.0 2,-0.1 409,-0.0 -0.881 360.0 21.0-108.7 152.6 9.2 70.6 6.8 160 34 B G S S+ 0 0 15 -2,-0.3 -1,-0.2 120,-0.0 119,-0.0 0.711 93.1 116.4 57.5 25.3 10.0 71.5 10.4 161 35 B Q > + 0 0 16 -3,-0.3 4,-1.0 105,-0.1 -2,-0.1 0.565 49.8 77.9 -97.5 -6.7 13.6 71.8 9.2 162 36 B T H > S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 3,-0.5 0.927 87.4 55.6 -69.5 -46.6 14.1 75.6 9.9 163 37 B A H > S+ 0 0 12 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.882 103.6 54.9 -56.8 -43.1 14.6 75.3 13.7 164 38 B P H > S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.868 109.6 47.7 -57.6 -33.6 17.6 72.9 13.3 165 39 B L H X S+ 0 0 5 -4,-1.0 4,-1.9 -3,-0.5 -2,-0.2 0.904 108.7 53.6 -73.4 -38.9 19.3 75.4 11.0 166 40 B I H X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.932 110.8 48.4 -56.2 -44.3 18.6 78.2 13.5 167 41 B N H X S+ 0 0 0 -4,-2.5 4,-1.1 1,-0.2 3,-0.2 0.928 106.2 55.0 -65.3 -47.2 20.3 76.0 16.1 168 42 B E H < S+ 0 0 2 -4,-2.2 3,-0.5 1,-0.2 4,-0.3 0.864 104.7 56.2 -49.6 -39.7 23.3 75.2 13.9 169 43 B R H >< S+ 0 0 8 -4,-1.9 3,-1.2 1,-0.2 -1,-0.2 0.921 106.7 48.9 -64.4 -39.3 23.9 79.0 13.5 170 44 B L H >< S+ 0 0 4 -4,-1.4 3,-1.8 1,-0.3 4,-0.3 0.722 93.7 74.4 -71.2 -22.7 24.1 79.5 17.2 171 45 B S T 3< S+ 0 0 2 -4,-1.1 -1,-0.3 -3,-0.5 3,-0.2 0.590 92.0 60.2 -67.0 -11.2 26.6 76.6 17.7 172 46 B Y T <> S+ 0 0 4 -3,-1.2 4,-1.4 -4,-0.3 3,-0.3 0.478 79.7 86.7 -91.8 -1.8 29.2 78.9 16.2 173 47 B X H <> S+ 0 0 7 -3,-1.8 4,-2.8 1,-0.2 5,-0.2 0.749 78.5 60.7 -81.2 -22.6 28.9 81.6 18.9 174 48 B K H > S+ 0 0 18 -4,-0.3 4,-2.4 -3,-0.2 -1,-0.2 0.888 107.6 48.6 -67.1 -35.1 31.4 80.1 21.4 175 49 B D H > S+ 0 0 3 -3,-0.3 4,-2.2 -4,-0.2 -2,-0.2 0.884 111.5 48.0 -67.4 -42.3 34.0 80.5 18.6 176 50 B V H X S+ 0 0 6 -4,-1.4 4,-2.7 2,-0.2 5,-0.2 0.967 114.7 46.8 -61.6 -52.6 33.0 84.1 17.9 177 51 B A H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.889 112.8 49.1 -51.2 -50.9 33.1 84.8 21.7 178 52 B G H X S+ 0 0 4 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.937 112.7 46.7 -57.9 -46.9 36.5 83.1 22.2 179 53 B Y H X S+ 0 0 70 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.939 114.4 47.4 -64.7 -47.4 38.0 85.0 19.2 180 54 B K H <>S+ 0 0 11 -4,-2.7 5,-3.3 2,-0.2 4,-0.4 0.856 111.6 52.3 -56.1 -41.0 36.6 88.3 20.5 181 55 B A H ><5S+ 0 0 23 -4,-2.5 3,-1.1 -5,-0.2 -2,-0.2 0.948 108.2 49.3 -63.1 -49.6 37.8 87.5 24.0 182 56 B E H 3<5S+ 0 0 109 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.842 120.2 37.9 -56.0 -37.3 41.4 86.8 22.8 183 57 B N T 3<5S- 0 0 84 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.329 109.6-119.6-101.9 8.0 41.5 90.0 20.8 184 58 B H T < 5 + 0 0 87 -3,-1.1 -3,-0.2 -4,-0.4 -4,-0.1 0.890 55.6 162.1 50.9 49.5 39.6 92.1 23.3 185 59 B L < - 0 0 67 -5,-3.3 -1,-0.2 -8,-0.1 -2,-0.1 -0.702 43.4-110.6 -94.9 143.2 36.8 92.8 20.8 186 60 B P - 0 0 58 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.433 20.5-129.8 -69.8 155.8 33.5 94.0 21.9 187 61 B I S S+ 0 0 5 -2,-0.1 2,-0.5 1,-0.1 42,-0.0 0.933 93.2 70.1 -69.6 -44.6 30.6 91.5 21.5 188 62 B E + 0 0 36 -159,-0.0 2,-0.5 38,-0.0 -1,-0.1 -0.640 59.0 174.6 -85.5 126.2 28.4 94.0 19.8 189 63 B D > - 0 0 55 -2,-0.5 4,-2.4 1,-0.1 5,-0.2 -0.930 11.0-168.4-129.6 96.9 29.6 94.9 16.3 190 64 B R H > S+ 0 0 133 -2,-0.5 4,-2.3 1,-0.2 5,-0.2 0.874 85.7 50.3 -62.1 -39.4 27.1 97.2 14.6 191 65 B I H > S+ 0 0 111 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.895 111.5 49.5 -69.3 -35.2 28.5 97.1 11.1 192 66 B Q H > S+ 0 0 45 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.948 111.7 48.6 -66.2 -42.2 28.6 93.3 11.3 193 67 B E H X S+ 0 0 29 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.869 110.1 51.8 -63.0 -38.4 25.0 93.2 12.5 194 68 B E H X S+ 0 0 75 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.883 108.4 51.3 -68.8 -37.9 23.9 95.6 9.7 195 69 B K H X S+ 0 0 112 -4,-2.1 4,-1.9 2,-0.2 5,-0.2 0.872 111.5 47.6 -58.4 -44.7 25.6 93.4 7.1 196 70 B V H X S+ 0 0 23 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.969 114.7 45.8 -59.0 -52.2 23.7 90.4 8.5 197 71 B I H X S+ 0 0 9 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.892 112.9 50.3 -64.0 -43.3 20.4 92.3 8.5 198 72 B N H X S+ 0 0 91 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.864 110.0 48.0 -58.8 -40.7 20.9 93.7 5.0 199 73 B S H X S+ 0 0 74 -4,-1.9 4,-3.0 2,-0.2 5,-0.2 0.917 111.4 52.1 -70.7 -40.2 21.8 90.3 3.3 200 74 B A H X S+ 0 0 3 -4,-2.3 4,-3.4 -5,-0.2 5,-0.2 0.926 110.7 47.6 -57.5 -43.3 18.8 88.7 5.0 201 75 B X H X S+ 0 0 83 -4,-1.9 4,-1.8 2,-0.2 10,-0.2 0.930 113.4 47.3 -67.2 -47.9 16.5 91.5 3.6 202 76 B A H X S+ 0 0 42 -4,-2.3 4,-2.1 2,-0.2 3,-0.4 0.977 116.3 44.5 -50.5 -58.4 17.9 91.2 0.1 203 77 B Q H X S+ 0 0 32 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.943 113.1 50.1 -54.9 -50.4 17.5 87.4 0.2 204 78 B A H X>S+ 0 0 0 -4,-3.4 5,-2.9 -5,-0.2 4,-0.7 0.837 107.7 55.7 -55.4 -33.3 14.0 87.5 1.8 205 79 B E H ><5S+ 0 0 132 -4,-1.8 3,-1.2 -3,-0.4 -2,-0.2 0.974 109.2 45.8 -66.1 -53.2 13.0 90.0 -1.0 206 80 B S H 3<5S+ 0 0 94 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.806 110.5 54.2 -53.1 -40.1 14.1 87.6 -3.8 207 81 B L H 3<5S- 0 0 42 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.597 120.0-104.2 -79.2 -10.4 12.4 84.6 -2.1 208 82 B G T <<5S+ 0 0 25 -3,-1.2 104,-2.9 -4,-0.7 2,-0.4 0.760 74.0 136.5 90.7 26.2 8.9 86.4 -1.9 209 83 B L E < -B 311 0B 4 -5,-2.9 2,-1.4 102,-0.3 -1,-0.3 -0.845 63.0 -95.7-100.7 141.5 9.0 87.2 1.8 210 84 B N E > -B 310 0B 72 100,-2.7 3,-0.7 -2,-0.4 100,-0.6 -0.777 28.5-152.3 -64.5 92.3 8.0 90.4 3.6 211 85 B G T 3> S+ 0 0 25 -2,-1.4 4,-0.8 2,-0.3 -1,-0.2 0.343 90.8 49.1 82.1 -91.7 10.8 91.9 3.9 212 86 B E T 34 S+ 0 0 168 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.768 105.8 58.1 -79.0 -33.5 9.6 93.8 7.0 213 87 B S T <4 S+ 0 0 19 -3,-0.7 4,-0.4 97,-0.2 -2,-0.3 0.691 103.2 57.0 -71.7 -16.9 8.3 90.6 8.7 214 88 B I T >> S+ 0 0 0 -4,-0.3 4,-2.1 1,-0.1 3,-0.8 0.822 88.9 71.2 -84.0 -38.2 11.9 89.1 8.4 215 89 B K H 3X S+ 0 0 90 -4,-0.8 4,-2.7 1,-0.2 5,-0.2 0.847 94.4 53.3 -49.5 -45.4 13.9 91.8 10.3 216 90 B P H 3> S+ 0 0 55 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.839 108.6 50.2 -63.4 -31.5 12.6 90.9 13.8 217 91 B L H <> S+ 0 0 0 -3,-0.8 4,-2.0 -4,-0.4 -2,-0.2 0.909 111.1 49.0 -68.8 -47.2 13.5 87.2 13.3 218 92 B X H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.914 113.1 46.9 -56.9 -49.1 17.0 88.3 12.2 219 93 B V H X S+ 0 0 47 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.901 109.4 54.6 -59.3 -44.0 17.3 90.6 15.3 220 94 B A H X S+ 0 0 8 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.890 111.7 45.1 -55.0 -40.9 16.0 87.8 17.5 221 95 B Q H X S+ 0 0 1 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.914 113.4 47.9 -70.6 -46.1 18.8 85.5 16.2 222 96 B I H X S+ 0 0 13 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.916 112.3 50.5 -56.8 -45.7 21.5 88.1 16.5 223 97 B N H X S+ 0 0 37 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.906 111.0 48.3 -61.8 -42.2 20.3 88.9 20.1 224 98 B A H X S+ 0 0 1 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.918 111.7 50.3 -61.3 -44.5 20.4 85.2 21.0 225 99 B A H X S+ 0 0 4 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.935 112.6 45.9 -62.1 -45.8 23.9 84.9 19.5 226 100 B K H X S+ 0 0 10 -4,-2.7 4,-3.3 2,-0.2 5,-0.2 0.897 109.5 54.8 -61.8 -42.9 25.1 88.0 21.5 227 101 B A H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.931 108.7 48.5 -57.9 -44.5 23.5 86.7 24.7 228 102 B I H X S+ 0 0 4 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.962 114.5 46.7 -55.5 -51.6 25.5 83.4 24.3 229 103 B Q H X S+ 0 0 7 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.856 109.3 52.7 -60.5 -46.4 28.7 85.4 23.6 230 104 B Y H X S+ 0 0 6 -4,-3.3 4,-1.9 2,-0.2 -1,-0.2 0.844 109.5 49.9 -56.5 -40.3 28.2 87.8 26.7 231 105 B R H X S+ 0 0 20 -4,-1.8 4,-2.5 -5,-0.2 -2,-0.2 0.840 108.8 51.0 -74.0 -33.7 27.7 84.8 29.0 232 106 B Y H X S+ 0 0 8 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.938 109.6 51.2 -61.9 -44.7 30.9 83.1 27.8 233 107 B R H X S+ 0 0 15 -4,-2.2 4,-0.8 1,-0.2 -2,-0.2 0.904 112.7 46.8 -61.0 -40.7 32.8 86.4 28.3 234 108 B A H >X S+ 0 0 0 -4,-1.9 3,-0.8 1,-0.2 4,-0.6 0.956 113.7 46.1 -61.5 -50.0 31.4 86.5 31.9 235 109 B D H >X S+ 0 0 38 -4,-2.5 4,-2.1 1,-0.2 3,-0.8 0.859 106.7 58.9 -64.9 -38.1 32.2 82.9 32.7 236 110 B W H 3< S+ 0 0 34 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.675 90.2 71.2 -66.4 -21.3 35.8 83.0 31.3 237 111 B L H << S+ 0 0 45 -3,-0.8 -1,-0.2 -4,-0.8 -2,-0.2 0.917 120.7 14.7 -60.1 -39.9 36.8 85.8 33.6 238 112 B S H << S+ 0 0 30 -3,-0.8 -2,-0.2 -4,-0.6 -1,-0.2 0.547 139.4 37.6-111.7 -16.0 36.8 83.4 36.6 239 113 B Q S < S- 0 0 96 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 -0.476 74.0-173.4-137.5 66.7 36.6 80.1 34.7 240 114 B P - 0 0 93 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.189 22.6-132.4 -55.2 151.3 38.8 80.2 31.5 241 115 B E > - 0 0 79 1,-0.2 3,-1.5 3,-0.1 -5,-0.0 -0.891 19.3-172.2-114.9 95.4 38.6 77.2 29.2 242 116 B P T 3 S+ 0 0 121 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.848 83.2 54.4 -54.6 -41.5 42.2 76.1 28.3 243 117 B G T 3 S+ 0 0 44 1,-0.1 2,-0.9 2,-0.0 353,-0.2 0.590 84.5 100.6 -73.3 -11.5 41.1 73.5 25.8 244 118 B W < + 0 0 17 -3,-1.5 -3,-0.1 352,-0.1 -1,-0.1 -0.646 45.8 177.0 -84.3 106.3 39.0 76.0 23.8 245 119 B Q - 0 0 111 -2,-0.9 352,-0.1 -66,-0.0 -66,-0.1 -0.890 26.6-134.4-110.0 108.5 40.9 77.2 20.7 246 120 B P - 0 0 22 0, 0.0 3,-0.1 0, 0.0 -71,-0.1 -0.234 16.2-121.5 -65.4 139.7 38.6 79.6 18.7 247 121 B K - 0 0 45 1,-0.1 -68,-0.1 2,-0.1 5,-0.0 -0.378 49.4 -75.6 -71.3 155.7 38.4 79.1 14.9 248 122 B P > - 0 0 68 0, 0.0 4,-2.0 0, 0.0 3,-0.2 -0.329 43.8-128.2 -57.3 139.7 39.5 82.1 12.8 249 123 B L H > S+ 0 0 17 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.858 104.4 54.2 -65.6 -39.5 36.6 84.7 12.9 250 124 B D H > S+ 0 0 115 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.904 109.4 48.2 -61.4 -40.9 36.3 85.1 9.1 251 125 B D H > S+ 0 0 66 -3,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.922 113.9 47.1 -62.2 -44.4 35.9 81.3 8.6 252 126 B V H X S+ 0 0 1 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.923 110.0 53.9 -66.9 -44.9 33.3 81.2 11.3 253 127 B R H X S+ 0 0 57 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.849 107.0 50.2 -55.8 -39.7 31.5 84.2 9.9 254 128 B A H X S+ 0 0 49 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.873 110.6 49.8 -69.7 -34.4 31.3 82.6 6.5 255 129 B N H X S+ 0 0 8 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.944 111.9 49.2 -65.4 -44.2 29.8 79.4 8.1 256 130 B I H X S+ 0 0 11 -4,-2.9 4,-1.9 2,-0.2 -2,-0.2 0.919 111.4 48.8 -59.4 -44.1 27.3 81.6 9.9 257 131 B G H X S+ 0 0 36 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.916 107.7 54.6 -63.8 -42.1 26.4 83.5 6.6 258 132 B E H X S+ 0 0 67 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.893 110.1 47.9 -57.5 -41.0 25.9 80.2 4.8 259 133 B L H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.882 107.0 53.4 -69.5 -41.5 23.4 79.1 7.5 260 134 B S H X S+ 0 0 12 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.882 107.4 54.9 -56.1 -39.5 21.4 82.3 7.5 261 135 B T H X S+ 0 0 57 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.915 109.5 44.5 -61.8 -47.0 21.1 81.8 3.8 262 136 B K H X S+ 0 0 59 -4,-1.7 4,-3.0 1,-0.2 -2,-0.2 0.855 108.9 58.8 -67.2 -34.1 19.6 78.2 4.3 263 137 B I H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.928 109.0 43.2 -60.3 -47.3 17.3 79.5 7.1 264 138 B L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.910 113.7 49.6 -67.5 -46.6 15.7 82.0 4.7 265 139 B E H X S+ 0 0 75 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.949 114.0 48.3 -50.4 -48.9 15.4 79.5 1.8 266 140 B Q H X S+ 0 0 18 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.835 109.6 50.9 -64.9 -38.3 13.8 77.1 4.3 267 141 B I H X S+ 0 0 3 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.918 112.2 47.0 -64.6 -47.0 11.4 79.6 5.7 268 142 B A H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.977 114.1 46.8 -55.6 -59.0 10.2 80.6 2.2 269 143 B E H X S+ 0 0 103 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.888 114.6 47.7 -48.6 -47.9 9.8 76.9 1.1 270 144 B E H < S+ 0 0 4 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.862 114.8 46.1 -67.1 -36.1 7.9 76.1 4.4 271 145 B L H < S+ 0 0 30 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.822 112.7 49.4 -70.9 -35.7 5.7 79.1 4.0 272 146 B K H < S+ 0 0 128 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.741 127.3 16.8 -80.6 -25.3 4.9 78.5 0.4 273 147 B T S < S+ 0 0 100 -4,-1.5 -3,-0.1 -5,-0.2 -4,-0.0 0.467 106.1 53.5-111.0-107.2 4.0 74.8 0.9 274 148 B b S S- 0 0 18 -5,-0.2 -1,-0.2 1,-0.1 5,-0.0 0.159 81.2-107.1 -51.1 145.2 3.2 73.1 4.2 275 149 B K >> - 0 0 169 1,-0.1 3,-2.5 -3,-0.1 2,-1.6 -0.591 22.8-119.5 -85.0 122.0 0.4 74.5 6.4 276 150 B P T 34 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.234 111.0 70.0 -44.7 12.3 1.4 76.3 9.7 277 151 B A T 34 S+ 0 0 100 -2,-1.6 -3,-0.0 4,-0.0 -2,-0.0 0.796 105.3 39.3 -85.0 -50.4 -0.6 73.7 11.7 278 152 B E T <4 S+ 0 0 115 -3,-2.5 3,-0.1 2,-0.0 2,-0.1 0.676 99.0 106.9 -65.3 -19.9 2.1 71.2 10.7 279 153 B X S < S- 0 0 20 -4,-0.8 -4,-0.0 1,-0.1 -120,-0.0 -0.400 89.0 -74.4 -64.9 139.4 4.6 74.0 11.3 280 154 B G - 0 0 19 -2,-0.1 -1,-0.1 1,-0.1 2,-0.1 0.119 44.1-141.7 -43.7 136.0 6.7 73.6 14.5 281 155 B D > - 0 0 54 -3,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.390 31.7 -97.3 -90.8 176.1 5.2 74.2 18.0 282 156 B K H > S+ 0 0 113 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.857 121.5 55.2 -67.7 -40.1 7.0 75.8 20.9 283 157 B A H > S+ 0 0 31 2,-0.2 4,-2.4 273,-0.2 -1,-0.2 0.913 111.1 46.3 -60.1 -39.0 8.0 72.5 22.6 284 158 B H H > S+ 0 0 7 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.945 112.6 49.6 -68.3 -46.3 9.7 71.4 19.3 285 159 B F H X S+ 0 0 7 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.912 112.9 48.2 -50.8 -45.9 11.4 74.7 18.9 286 160 B I H < S+ 0 0 63 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.875 112.4 47.0 -70.3 -40.8 12.6 74.5 22.5 287 161 B N H < S+ 0 0 13 -4,-2.4 -1,-0.2 -5,-0.2 318,-0.2 0.859 117.8 43.3 -65.8 -35.7 13.9 71.0 22.2 288 162 B T H < S+ 0 0 9 -4,-2.5 2,-1.1 1,-0.2 -2,-0.2 0.944 104.3 62.0 -78.8 -47.2 15.7 71.8 18.9 289 163 B I S < S+ 0 0 3 -4,-3.0 2,-0.4 -5,-0.2 -1,-0.2 -0.690 71.7 146.1 -90.6 97.5 17.2 75.1 19.8 290 164 B R + 0 0 78 -2,-1.1 2,-0.3 313,-0.1 313,-0.2 -0.985 9.2 148.0-145.1 116.3 19.5 74.1 22.7 291 165 B Q > - 0 0 12 -2,-0.4 3,-1.4 3,-0.2 310,-0.1 -0.990 52.0 -99.0-151.0 143.4 22.9 75.7 23.4 292 166 B H T 3 S+ 0 0 74 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.442 112.1 23.7 -57.9 142.8 24.8 76.3 26.5 293 167 B N T 3 S+ 0 0 25 1,-0.2 2,-0.4 -62,-0.1 -1,-0.2 0.645 96.7 113.6 75.3 15.7 24.3 80.0 27.6 294 168 B L < - 0 0 24 -3,-1.4 -1,-0.2 -63,-0.1 -3,-0.2 -0.968 52.6-154.5-117.5 128.9 21.0 80.3 25.8 295 169 B T > - 0 0 50 -2,-0.4 4,-2.1 -3,-0.1 5,-0.2 -0.576 29.2-106.8-103.1 175.1 17.8 80.8 27.9 296 170 B S H > S+ 0 0 73 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.884 121.2 54.2 -63.4 -39.6 14.1 80.1 27.3 297 171 B A H > S+ 0 0 15 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.900 107.3 50.9 -61.5 -39.0 13.4 83.8 26.9 298 172 B D H > S+ 0 0 4 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.934 114.5 43.3 -61.5 -45.4 16.1 83.9 24.1 299 173 B V H X S+ 0 0 5 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.918 112.5 54.3 -68.3 -42.0 14.5 80.9 22.4 300 174 B E H X S+ 0 0 91 -4,-3.4 4,-2.9 2,-0.2 5,-0.2 0.843 104.2 53.3 -57.2 -41.5 11.0 82.3 22.9 301 175 B A H X S+ 0 0 35 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.888 112.1 46.3 -66.6 -35.4 11.9 85.7 21.2 302 176 B I H X S+ 0 0 0 -4,-1.5 4,-2.6 -82,-0.2 -2,-0.2 0.933 113.3 49.0 -64.8 -46.1 13.1 83.7 18.2 303 177 B F H X S+ 0 0 26 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.942 112.3 47.3 -60.8 -49.3 9.9 81.5 18.3 304 178 B S H < S+ 0 0 61 -4,-2.9 -1,-0.2 1,-0.2 4,-0.2 0.858 115.6 44.2 -64.4 -36.4 7.6 84.5 18.5 305 179 B T H >< S+ 0 0 17 -4,-1.8 3,-1.4 -5,-0.2 -88,-0.3 0.872 108.1 59.3 -73.3 -36.3 9.3 86.4 15.7 306 180 B F H >< S+ 0 0 14 -4,-2.6 3,-1.6 1,-0.3 -2,-0.2 0.929 102.2 54.0 -57.6 -45.0 9.5 83.2 13.5 307 181 B N T 3< S+ 0 0 63 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.514 102.8 57.3 -68.7 -5.8 5.7 82.9 13.6 308 182 B Q T < S+ 0 0 118 -3,-1.4 -1,-0.3 -4,-0.2 2,-0.3 0.329 76.2 116.7-108.6 2.2 5.2 86.5 12.3 309 183 B V < - 0 0 3 -3,-1.6 2,-0.3 -4,-0.3 -98,-0.1 -0.580 47.5-173.3 -69.1 136.1 7.3 85.9 9.2 310 184 B K E -B 210 0B 111 -100,-0.6 -100,-2.7 -2,-0.3 -97,-0.2 -0.983 24.4-112.9-136.2 143.9 5.0 86.4 6.1 311 185 B L E B 209 0B 66 -2,-0.3 -102,-0.3 -102,-0.3 -103,-0.1 -0.369 360.0 360.0 -63.8 147.8 5.2 85.9 2.4 312 186 B K 0 0 204 -104,-2.9 -101,-0.1 -107,-0.1 -104,-0.1 -0.866 360.0 360.0 166.6 360.0 5.0 89.0 0.1 313 !* 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 0.0 314 31 C Q 0 0 209 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 106.7 12.4 47.1 64.8 315 32 C Q + 0 0 127 1,-0.2 2,-0.3 112,-0.0 3,-0.2 0.606 360.0 51.1-122.5 -29.4 8.6 47.1 64.1 316 33 C c S S+ 0 0 13 1,-0.2 -1,-0.2 114,-0.1 120,-0.2 -0.788 102.0 18.8-117.4 157.4 7.9 50.4 62.4 317 34 C G S S+ 0 0 11 -2,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.730 83.1 122.0 61.7 29.0 9.3 52.4 59.4 318 35 C Q + 0 0 52 -3,-0.2 4,-0.4 1,-0.1 -1,-0.1 0.205 42.3 85.1-108.3 12.6 11.0 49.3 58.0 319 36 C T S >> S+ 0 0 2 2,-0.1 4,-1.9 1,-0.1 3,-1.1 0.919 78.7 63.3 -81.7 -44.8 9.4 49.1 54.5 320 37 C A H 3> S+ 0 0 1 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.838 97.3 56.0 -50.6 -44.4 11.8 51.4 52.6 321 38 C P H 3> S+ 0 0 49 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.845 109.8 47.7 -56.6 -34.8 14.9 49.3 53.1 322 39 C L H <> S+ 0 0 31 -3,-1.1 4,-2.3 -4,-0.4 -2,-0.2 0.871 110.7 50.0 -74.1 -38.9 13.0 46.4 51.5 323 40 C I H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.931 111.0 50.8 -63.7 -46.2 11.9 48.5 48.6 324 41 C N H X S+ 0 0 38 -4,-3.0 4,-1.0 1,-0.2 -2,-0.2 0.917 109.5 50.5 -54.5 -47.8 15.5 49.6 48.2 325 42 C E H < S+ 0 0 89 -4,-1.8 3,-0.5 2,-0.2 4,-0.3 0.886 107.2 51.9 -62.7 -43.0 16.7 46.1 48.2 326 43 C R H >< S+ 0 0 9 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.943 109.6 52.0 -55.4 -45.9 14.2 44.9 45.5 327 44 C L H >< S+ 0 0 3 -4,-2.2 3,-1.3 1,-0.3 4,-0.3 0.709 94.3 71.9 -66.4 -20.4 15.4 47.8 43.3 328 45 C S T 3< S+ 0 0 46 -4,-1.0 3,-0.3 -3,-0.5 4,-0.3 0.615 91.4 59.7 -70.8 -14.4 19.1 46.7 43.8 329 46 C Y T <> S+ 0 0 34 -3,-1.6 4,-1.4 -4,-0.3 3,-0.3 0.533 80.5 87.7 -86.3 -6.8 18.3 43.7 41.5 330 47 C X H <> S+ 0 0 8 -3,-1.3 4,-2.6 1,-0.2 -1,-0.2 0.774 78.5 59.7 -73.0 -24.1 17.3 45.9 38.5 331 48 C K H > S+ 0 0 44 -3,-0.3 4,-2.6 -4,-0.3 -1,-0.2 0.926 105.2 52.1 -64.5 -43.5 20.8 46.3 37.1 332 49 C D H > S+ 0 0 14 -4,-0.3 4,-2.3 -3,-0.3 -2,-0.2 0.899 110.9 46.2 -57.1 -43.3 20.9 42.5 36.7 333 50 C V H X S+ 0 0 5 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.923 110.9 53.5 -66.5 -43.3 17.6 42.5 34.9 334 51 C A H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.891 111.9 44.8 -55.1 -46.8 18.8 45.4 32.7 335 52 C G H X S+ 0 0 4 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.867 109.8 54.2 -73.6 -34.9 22.0 43.4 31.7 336 53 C Y H X S+ 0 0 64 -4,-2.3 4,-1.4 -5,-0.2 -2,-0.2 0.925 112.8 45.2 -55.3 -46.0 20.0 40.2 31.1 337 54 C K H <>S+ 0 0 16 -4,-2.3 5,-3.0 2,-0.2 4,-0.4 0.890 112.9 49.9 -68.3 -40.4 17.8 42.2 28.7 338 55 C A H ><5S+ 0 0 26 -4,-2.3 3,-1.2 3,-0.2 -2,-0.2 0.920 108.4 52.0 -64.2 -49.3 20.7 43.9 27.0 339 56 C E H 3<5S+ 0 0 106 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.847 117.9 39.2 -54.3 -39.6 22.6 40.7 26.4 340 57 C N T 3<5S- 0 0 86 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.399 107.6-122.4 -92.3 2.0 19.5 39.2 24.8 341 58 C H T < 5 + 0 0 92 -3,-1.2 -3,-0.2 -4,-0.4 162,-0.1 0.866 58.7 154.9 56.5 39.9 18.4 42.4 22.9 342 59 C L < - 0 0 65 -5,-3.0 -1,-0.2 -6,-0.1 -2,-0.1 -0.741 47.3-103.6 -97.7 148.3 15.1 42.3 24.7 343 60 C P - 0 0 58 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.299 19.8-132.7 -62.8 148.0 12.7 45.3 25.4 344 61 C I S S+ 0 0 6 1,-0.1 2,-0.5 -2,-0.0 42,-0.0 0.915 92.2 68.6 -69.8 -38.9 12.7 46.8 28.8 345 62 C E + 0 0 43 153,-0.0 2,-0.4 38,-0.0 3,-0.1 -0.689 55.3 166.5 -88.6 123.4 8.9 46.8 28.9 346 63 C D > - 0 0 64 -2,-0.5 4,-2.1 1,-0.1 5,-0.1 -0.875 14.3-170.9-135.0 98.0 7.3 43.4 28.9 347 64 C R H > S+ 0 0 169 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.807 85.0 58.4 -71.0 -25.0 3.6 43.8 29.8 348 65 C I H > S+ 0 0 139 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.944 109.1 44.3 -62.4 -49.6 3.1 40.1 30.2 349 66 C Q H > S+ 0 0 41 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.895 113.3 52.5 -61.9 -38.7 5.8 40.0 32.9 350 67 C E H X S+ 0 0 29 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.930 108.9 47.9 -66.3 -43.0 4.3 43.1 34.5 351 68 C E H X S+ 0 0 91 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.868 111.3 52.8 -65.5 -33.1 0.7 41.7 34.7 352 69 C K H X S+ 0 0 134 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.944 111.1 45.1 -64.5 -46.2 2.2 38.5 36.2 353 70 C V H X S+ 0 0 28 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.906 116.3 47.4 -62.2 -42.5 4.0 40.6 38.9 354 71 C I H X S+ 0 0 5 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.948 112.0 48.7 -67.2 -44.2 0.9 42.6 39.5 355 72 C N H X S+ 0 0 101 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.877 111.9 49.2 -64.4 -38.6 -1.4 39.6 39.7 356 73 C S H X S+ 0 0 70 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.920 110.8 50.2 -65.8 -43.7 1.0 37.8 42.2 357 74 C A H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.936 109.4 51.8 -60.6 -43.0 1.2 40.9 44.4 358 75 C X H X S+ 0 0 49 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.846 107.6 51.4 -67.0 -31.3 -2.6 41.1 44.5 359 76 C A H X S+ 0 0 50 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.840 112.6 46.5 -71.5 -34.7 -3.0 37.5 45.5 360 77 C Q H X S+ 0 0 47 -4,-1.8 4,-2.8 2,-0.2 6,-0.2 0.925 103.6 59.0 -69.7 -49.1 -0.6 37.9 48.4 361 78 C A H <>S+ 0 0 0 -4,-2.7 5,-3.0 1,-0.2 4,-0.5 0.919 105.7 55.5 -38.7 -48.6 -2.1 41.2 49.5 362 79 C E H ><5S+ 0 0 155 -4,-1.3 3,-1.0 1,-0.2 -2,-0.2 0.900 107.5 44.3 -49.6 -55.7 -5.2 38.8 49.9 363 80 C S H 3<5S+ 0 0 103 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.862 113.8 53.4 -62.8 -30.7 -3.4 36.3 52.2 364 81 C L T 3<5S- 0 0 35 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.443 116.0-109.0 -87.2 0.3 -1.9 39.2 54.2 365 82 C G T < 5S+ 0 0 28 -3,-1.0 104,-2.8 -4,-0.5 2,-0.3 0.715 73.1 137.2 76.1 20.8 -5.3 40.9 54.9 366 83 C L B < -C 468 0C 5 -5,-3.0 2,-0.5 102,-0.3 -1,-0.3 -0.698 66.6-101.3 -92.9 152.0 -4.5 43.9 52.6 367 84 C N > - 0 0 34 100,-3.0 4,-0.6 -2,-0.3 3,-0.4 -0.634 34.1-145.0 -66.9 120.6 -7.1 45.4 50.2 368 85 C G H >> S+ 0 0 19 -2,-0.5 3,-1.2 1,-0.3 4,-0.6 0.898 94.8 47.5 -62.8 -46.5 -6.1 43.9 46.8 369 86 C E H >4 S+ 0 0 133 1,-0.2 3,-0.7 2,-0.2 -1,-0.3 0.803 103.5 65.5 -63.8 -27.6 -6.8 46.9 44.6 370 87 C S H 34 S+ 0 0 13 -3,-0.4 4,-0.4 1,-0.2 -1,-0.2 0.662 97.8 54.4 -70.8 -16.1 -5.0 49.2 47.1 371 88 C I H S+ 0 0 56 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.914 111.0 50.5 -60.3 -36.0 -0.6 51.6 42.4 374 91 C L H > S+ 0 0 0 -4,-0.4 4,-2.7 88,-0.3 5,-0.2 0.924 110.3 48.0 -66.6 -43.4 2.4 50.6 44.5 375 92 C X H X S+ 0 0 0 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.950 113.2 48.8 -59.3 -46.5 3.3 47.7 42.2 376 93 C V H X S+ 0 0 54 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.910 112.5 48.8 -55.8 -46.2 2.9 50.0 39.2 377 94 C A H X S+ 0 0 7 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.936 114.0 45.1 -62.3 -45.2 5.2 52.6 41.1 378 95 C Q H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.886 113.4 50.2 -67.6 -41.0 7.8 50.0 41.9 379 96 C I H X S+ 0 0 15 -4,-3.1 4,-2.5 -5,-0.2 -2,-0.2 0.884 110.6 50.4 -62.4 -40.8 7.6 48.5 38.3 380 97 C N H X S+ 0 0 45 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.901 110.6 48.7 -61.1 -43.5 8.1 52.1 36.9 381 98 C A H X S+ 0 0 1 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.903 112.1 50.0 -62.6 -45.4 11.1 52.8 39.1 382 99 C A H X S+ 0 0 4 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.914 111.1 47.9 -59.9 -48.0 12.5 49.4 38.0 383 100 C K H X S+ 0 0 11 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.905 108.9 54.2 -59.8 -40.5 12.0 50.2 34.4 384 101 C A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.959 109.6 47.8 -62.4 -45.4 13.6 53.7 34.7 385 102 C I H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.896 113.4 47.6 -56.5 -44.0 16.7 52.1 36.2 386 103 C Q H X S+ 0 0 8 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.912 110.9 50.0 -68.5 -45.9 16.9 49.5 33.5 387 104 C Y H X S+ 0 0 6 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.861 109.9 52.5 -58.4 -41.6 16.4 52.0 30.7 388 105 C R H X S+ 0 0 18 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.950 110.4 46.8 -64.8 -46.7 19.2 54.2 32.2 389 106 C Y H X S+ 0 0 26 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.912 110.4 52.8 -54.7 -47.3 21.6 51.3 32.3 390 107 C R H X S+ 0 0 12 -4,-2.7 4,-0.7 2,-0.2 -2,-0.2 0.925 111.5 47.3 -56.4 -45.6 20.7 50.4 28.7 391 108 C A H >X S+ 0 0 0 -4,-2.2 3,-1.2 2,-0.2 4,-0.6 0.970 113.6 47.9 -54.5 -54.5 21.5 54.0 27.8 392 109 C D H >X S+ 0 0 37 -4,-2.7 4,-2.2 1,-0.3 3,-0.7 0.863 105.5 57.9 -59.3 -42.0 24.8 54.0 29.7 393 110 C W H 3< S+ 0 0 27 -4,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.690 89.9 73.2 -66.5 -19.1 26.0 50.7 28.3 394 111 C L H << S+ 0 0 40 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.893 118.9 14.7 -65.0 -38.4 25.8 51.9 24.6 395 112 C S H << S+ 0 0 27 -3,-0.7 -2,-0.2 -4,-0.6 -1,-0.2 0.611 139.9 37.8-109.0 -15.8 28.9 54.1 25.0 396 113 C Q S < S- 0 0 114 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 -0.567 71.4-179.4-132.3 75.0 30.3 52.7 28.3 397 114 C P - 0 0 88 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.222 25.3-139.6 -65.0 4.2 29.7 48.8 28.2 398 115 C E > - 0 0 73 -2,-0.1 3,-1.8 1,-0.1 -5,-0.0 0.839 23.9-159.2 44.3 49.2 31.1 47.4 31.6 399 116 C P T 3 S+ 0 0 118 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.206 73.5 27.3 -64.6 151.9 32.7 44.3 30.2 400 117 C G T 3 S+ 0 0 79 1,-0.3 2,-0.5 0, 0.0 -2,-0.1 0.753 91.0 105.4 53.1 20.0 33.2 41.6 32.9 401 118 C W < - 0 0 66 -3,-1.8 -1,-0.3 2,-0.0 0, 0.0 -0.981 58.4-175.1 -98.2 132.6 30.4 42.8 34.9 402 119 C Q - 0 0 126 -2,-0.5 -66,-0.1 -3,-0.1 -70,-0.1 -0.995 22.9-116.9-128.4 133.5 28.0 40.0 34.1 403 120 C P - 0 0 23 0, 0.0 3,-0.1 0, 0.0 -71,-0.1 -0.343 32.8-107.5 -64.4 150.6 24.4 39.8 35.2 404 121 C K - 0 0 115 1,-0.2 2,-0.1 2,-0.1 -68,-0.1 -0.275 52.8 -74.4 -68.9 159.5 23.2 37.0 37.5 405 122 C P >> - 0 0 82 0, 0.0 4,-2.0 0, 0.0 3,-0.6 -0.390 44.4-128.0 -61.9 135.8 21.0 34.2 36.0 406 123 C L H 3> S+ 0 0 31 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.857 104.8 55.7 -54.7 -47.6 17.5 35.6 35.5 407 124 C D H 3> S+ 0 0 132 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.887 110.5 47.6 -56.5 -38.7 15.6 32.9 37.3 408 125 C D H <> S+ 0 0 90 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.919 113.0 47.2 -65.2 -47.8 17.8 33.5 40.4 409 126 C V H X S+ 0 0 1 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.939 112.4 50.0 -61.3 -46.3 17.3 37.3 40.3 410 127 C R H X S+ 0 0 70 -4,-3.2 4,-2.5 2,-0.2 -1,-0.2 0.853 107.3 53.5 -64.2 -34.0 13.5 37.0 39.8 411 128 C A H X S+ 0 0 60 -4,-1.6 4,-2.7 -5,-0.2 -1,-0.2 0.925 111.9 46.4 -65.4 -46.9 13.2 34.6 42.7 412 129 C N H X S+ 0 0 49 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.923 112.8 48.9 -54.6 -44.9 15.0 37.2 44.9 413 130 C I H X S+ 0 0 14 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.912 112.6 47.0 -65.5 -43.1 12.8 40.0 43.5 414 131 C G H X S+ 0 0 34 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.905 109.8 54.7 -67.1 -42.5 9.6 38.0 44.2 415 132 C E H X S+ 0 0 105 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.934 111.8 44.4 -53.8 -45.0 10.9 37.1 47.7 416 133 C L H X S+ 0 0 6 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.907 105.8 59.2 -70.8 -37.5 11.3 40.9 48.4 417 134 C S H X S+ 0 0 10 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.948 108.6 47.0 -57.1 -41.1 8.1 41.8 46.9 418 135 C T H X S+ 0 0 37 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.915 111.1 51.1 -62.4 -50.1 6.5 39.4 49.5 419 136 C K H X S+ 0 0 94 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.859 107.9 53.5 -54.4 -38.1 8.5 40.9 52.4 420 137 C I H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.947 111.7 43.8 -65.7 -42.8 7.5 44.4 51.4 421 138 C L H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.888 113.6 50.7 -73.2 -39.5 3.8 43.5 51.5 422 139 C E H X S+ 0 0 85 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.921 112.0 49.1 -54.7 -51.2 4.2 41.5 54.9 423 140 C Q H X S+ 0 0 43 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.928 112.1 46.8 -57.8 -48.5 6.0 44.6 56.3 424 141 C I H X S+ 0 0 1 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.880 112.0 51.4 -60.5 -42.1 3.3 47.0 55.1 425 142 C A H X S+ 0 0 2 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.969 112.4 45.9 -59.8 -51.7 0.5 44.6 56.5 426 143 C E H X S+ 0 0 120 -4,-2.8 4,-0.6 1,-0.2 5,-0.2 0.914 112.7 49.3 -60.7 -44.1 2.2 44.4 59.9 427 144 C E H >< S+ 0 0 2 -4,-2.6 3,-0.5 1,-0.2 -1,-0.2 0.844 110.6 50.0 -66.7 -33.1 2.9 48.2 60.2 428 145 C L H 3< S+ 0 0 42 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.871 105.9 58.0 -68.4 -37.0 -0.7 49.1 59.2 429 146 C K H 3< S+ 0 0 114 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.572 129.8 3.9 -71.5 -13.7 -2.0 46.6 61.9 430 147 C T S << S+ 0 0 95 -4,-0.6 -3,-0.2 -3,-0.5 -2,-0.1 0.498 104.1 77.2-127.8 -75.6 -0.1 48.5 64.6 431 148 C c - 0 0 12 -5,-0.2 -1,-0.0 -4,-0.2 5,-0.0 0.264 67.7-113.3 -51.6 159.8 1.9 51.8 64.0 432 149 C K >> - 0 0 131 1,-0.1 3,-0.7 4,-0.0 4,-0.7 -0.531 31.8-116.1 -71.9 157.0 0.9 55.5 63.5 433 150 C P T 34 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.753 123.6 56.6 -65.0 -21.0 1.5 56.9 60.0 434 151 C A T 34 S+ 0 0 88 1,-0.2 4,-0.1 4,-0.0 -3,-0.0 0.617 102.0 54.2 -80.8 -16.2 3.9 59.2 62.0 435 152 C E T <4 S+ 0 0 94 -3,-0.7 2,-0.3 2,-0.1 -1,-0.2 0.587 104.9 70.1 -85.2 -15.2 5.7 56.0 63.3 436 153 C X S < S- 0 0 28 -4,-0.7 -120,-0.0 -120,-0.2 -4,-0.0 -0.698 105.1 -68.9-101.2 156.6 6.1 54.9 59.6 437 154 C G - 0 0 12 -2,-0.3 2,-0.1 1,-0.1 -1,-0.1 -0.077 44.9-152.2 -50.0 130.6 8.4 56.6 57.1 438 155 C D > - 0 0 99 -4,-0.1 4,-1.8 -3,-0.1 3,-0.3 -0.420 41.1 -82.8 -91.9 176.8 7.7 60.1 55.8 439 156 C K H > S+ 0 0 114 1,-0.2 4,-2.4 2,-0.2 3,-0.2 0.888 128.0 49.0 -49.0 -51.3 8.7 61.5 52.4 440 157 C A H > S+ 0 0 51 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.864 106.9 55.5 -59.6 -43.4 12.3 62.4 53.5 441 158 C H H > S+ 0 0 72 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.895 109.3 47.1 -57.4 -45.9 12.9 59.0 55.0 442 159 C F H X S+ 0 0 3 -4,-1.8 4,-3.0 -3,-0.2 3,-0.3 0.951 109.8 53.7 -56.0 -54.0 12.0 57.3 51.7 443 160 C I H < S+ 0 0 46 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.906 114.7 41.6 -47.4 -44.6 14.2 59.7 49.8 444 161 C N H < S+ 0 0 113 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.766 118.5 43.1 -79.3 -26.6 17.2 58.8 52.0 445 162 C T H < S+ 0 0 37 -4,-1.6 2,-1.3 -3,-0.3 -2,-0.2 0.870 104.1 63.2 -91.6 -38.9 16.7 55.1 52.3 446 163 C I < + 0 0 4 -4,-3.0 2,-0.4 -5,-0.2 -1,-0.2 -0.709 67.3 146.6 -93.4 90.0 15.9 54.3 48.7 447 164 C R + 0 0 189 -2,-1.3 2,-0.3 -3,-0.1 5,-0.1 -0.992 10.1 151.3-127.4 119.0 19.1 55.3 46.9 448 165 C Q > - 0 0 56 -2,-0.4 3,-1.4 3,-0.3 2,-0.1 -0.980 51.8 -95.8-145.6 146.2 20.3 53.3 43.8 449 166 C H T 3 S+ 0 0 115 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.465 112.2 21.6 -57.8 137.1 22.3 54.3 40.8 450 167 C N T 3 S+ 0 0 27 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.607 99.4 109.6 76.9 16.9 20.0 55.3 38.0 451 168 C L < - 0 0 22 -3,-1.4 -3,-0.3 -66,-0.1 -1,-0.2 -0.985 53.0-155.2-123.0 133.0 17.0 56.0 40.2 452 169 C T > - 0 0 50 -2,-0.4 4,-1.6 -3,-0.1 5,-0.1 -0.507 30.0-107.4-106.2 173.4 15.8 59.6 40.7 453 170 C S H > S+ 0 0 63 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.872 120.1 56.2 -61.5 -41.7 13.8 61.4 43.5 454 171 C A H > S+ 0 0 16 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.904 105.7 51.5 -63.3 -39.4 10.8 61.5 41.3 455 172 C D H > S+ 0 0 4 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.897 114.4 43.6 -55.9 -44.8 10.9 57.7 40.9 456 173 C V H X S+ 0 0 4 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.900 108.7 57.1 -74.0 -41.5 11.1 57.4 44.7 457 174 C E H X S+ 0 0 76 -4,-3.5 4,-2.7 1,-0.2 5,-0.2 0.881 104.7 52.0 -53.9 -42.7 8.4 60.0 45.4 458 175 C A H X S+ 0 0 38 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.850 108.4 52.5 -64.4 -30.6 5.8 58.0 43.2 459 176 C I H X S+ 0 0 0 -4,-1.0 4,-2.2 -5,-0.2 -2,-0.2 0.934 110.7 47.8 -68.4 -37.1 6.7 55.0 45.3 460 177 C F H X S+ 0 0 25 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.939 108.3 51.3 -74.6 -44.9 6.0 56.9 48.4 461 178 C S H < S+ 0 0 61 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.888 115.4 43.0 -60.7 -37.0 2.7 58.4 47.4 462 179 C T H >X S+ 0 0 21 -4,-1.6 3,-2.0 -5,-0.2 4,-0.7 0.865 105.3 62.8 -77.4 -34.4 1.3 55.0 46.4 463 180 C F H >< S+ 0 0 14 -4,-2.2 3,-1.1 1,-0.3 -2,-0.2 0.916 101.4 55.1 -47.0 -45.4 2.8 53.3 49.5 464 181 C N T 3< S+ 0 0 92 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.507 99.9 59.6 -66.4 -11.9 0.4 55.7 51.4 465 182 C Q T <4 S+ 0 0 125 -3,-2.0 2,-0.3 -4,-0.1 -1,-0.2 0.544 78.0 108.2 -95.0 -12.9 -2.6 54.4 49.4 466 183 C V << + 0 0 11 -3,-1.1 2,-0.3 -4,-0.7 -95,-0.1 -0.515 49.8 176.5 -70.2 131.3 -2.2 50.8 50.7 467 184 C K - 0 0 110 -100,-0.3 -100,-3.0 -2,-0.3 -97,-0.1 -0.915 29.6-100.8-136.3 159.9 -4.9 49.9 53.2 468 185 C L B C 366 0C 69 -2,-0.3 -102,-0.3 -102,-0.3 -103,-0.1 -0.349 360.0 360.0 -72.2 156.4 -6.1 46.9 55.2 469 186 C K 0 0 185 -104,-2.8 -101,-0.0 -2,-0.1 -2,-0.0 -0.699 360.0 360.0 160.4 360.0 -9.1 44.7 54.3 470 !* 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 0.0 471 32 D Q > 0 0 100 0, 0.0 3,-0.8 0, 0.0 112,-0.1 0.000 360.0 360.0 360.0 119.9 31.9 74.0 3.9 472 33 D d T 3 + 0 0 32 1,-0.2 -217,-0.1 2,-0.1 107,-0.0 0.128 360.0 22.5 -45.5 130.4 34.6 73.0 6.5 473 34 D G T 3 S+ 0 0 13 120,-0.0 -1,-0.2 -218,-0.0 3,-0.1 0.468 89.1 111.6 93.6 7.1 33.4 72.3 10.0 474 35 D Q <> + 0 0 7 -3,-0.8 4,-1.0 1,-0.2 -2,-0.1 0.494 53.0 80.1 -93.6 0.7 29.9 71.6 9.0 475 36 D T H >> S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 3,-0.6 0.966 90.6 49.2 -68.6 -55.4 29.8 67.9 9.8 476 37 D A H 3> S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.870 107.2 55.2 -52.0 -48.6 29.3 68.1 13.6 477 38 D P H 3> S+ 0 0 1 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.857 110.3 47.9 -50.8 -37.9 26.3 70.6 13.2 478 39 D L H < S+ 0 0 11 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.934 106.8 48.5 -61.2 -41.6 20.1 64.3 13.4 483 44 D L H >< S+ 0 0 4 -4,-1.5 3,-1.7 -3,-0.3 4,-0.3 0.694 92.5 76.8 -71.7 -22.4 19.9 63.8 17.1 484 45 D S T 3< S+ 0 0 2 -4,-1.2 3,-0.3 -3,-0.3 -1,-0.2 0.624 91.6 57.8 -62.5 -14.9 17.4 66.7 17.6 485 46 D Y T <> S+ 0 0 5 -3,-1.1 4,-1.7 -4,-0.4 3,-0.3 0.478 80.0 88.5 -92.0 -7.0 14.7 64.3 16.2 486 47 D X H <> S+ 0 0 7 -3,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.757 79.4 59.5 -74.4 -23.4 15.2 61.6 18.9 487 48 D K H > S+ 0 0 18 -3,-0.3 4,-2.3 -4,-0.3 -1,-0.2 0.886 107.8 48.0 -65.9 -37.8 12.7 63.1 21.4 488 49 D D H > S+ 0 0 2 -3,-0.3 4,-2.3 -4,-0.2 5,-0.2 0.924 112.5 48.5 -67.6 -42.1 10.0 62.7 18.7 489 50 D V H X S+ 0 0 6 -4,-1.7 4,-2.6 1,-0.2 5,-0.2 0.963 113.7 46.2 -61.1 -51.0 11.2 59.1 18.0 490 51 D A H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.852 112.5 50.6 -58.4 -42.1 11.2 58.2 21.7 491 52 D G H X S+ 0 0 4 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.909 111.6 46.8 -62.6 -46.8 7.8 59.8 22.3 492 53 D Y H X S+ 0 0 74 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.906 114.7 46.7 -62.2 -48.4 6.1 58.0 19.4 493 54 D K H <>S+ 0 0 14 -4,-2.6 5,-2.6 -5,-0.2 4,-0.4 0.906 112.6 51.9 -57.6 -41.5 7.7 54.7 20.5 494 55 D A H ><5S+ 0 0 34 -4,-2.4 3,-1.2 -5,-0.2 -2,-0.2 0.958 109.9 47.2 -63.1 -46.1 6.5 55.5 24.0 495 56 D E H 3<5S+ 0 0 125 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.762 120.2 38.8 -64.5 -30.9 2.9 56.1 22.9 496 57 D N T 3<5S- 0 0 88 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.232 109.6-119.5-103.6 10.2 2.8 53.0 20.8 497 58 D H T < 5 + 0 0 40 -3,-1.2 -3,-0.2 -4,-0.4 -4,-0.1 0.884 56.6 159.9 44.7 51.2 4.8 50.8 23.3 498 59 D L < - 0 0 68 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.1 -0.765 44.3-110.3 -96.2 141.0 7.4 50.1 20.7 499 60 D P - 0 0 57 0, 0.0 -1,-0.0 0, 0.0 -5,-0.0 -0.455 17.3-130.3 -68.5 146.3 10.9 49.0 21.8 500 61 D I S S+ 0 0 5 -2,-0.1 2,-0.4 39,-0.0 42,-0.0 0.944 95.0 65.4 -56.5 -49.6 13.7 51.5 21.5 501 62 D E + 0 0 30 -159,-0.1 2,-0.4 38,-0.0 3,-0.1 -0.603 58.1 171.2 -81.4 129.8 15.9 48.9 19.8 502 63 D D > - 0 0 59 -2,-0.4 4,-2.7 1,-0.1 5,-0.2 -0.860 13.8-167.4-137.7 95.4 14.7 47.7 16.4 503 64 D R H > S+ 0 0 133 -2,-0.4 4,-2.0 1,-0.2 5,-0.2 0.850 87.4 53.2 -60.7 -33.7 17.3 45.5 14.8 504 65 D I H > S+ 0 0 131 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.935 111.3 44.9 -68.6 -40.6 15.6 45.5 11.4 505 66 D Q H > S+ 0 0 38 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.910 111.8 54.0 -64.4 -39.8 15.4 49.4 11.3 506 67 D E H X S+ 0 0 24 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.898 111.2 44.4 -62.2 -40.6 19.0 49.6 12.5 507 68 D E H X S+ 0 0 63 -4,-2.0 4,-3.1 2,-0.2 5,-0.4 0.888 110.0 54.9 -72.6 -41.4 20.3 47.4 9.7 508 69 D K H X S+ 0 0 133 -4,-2.3 4,-2.8 -5,-0.2 5,-0.2 0.960 112.9 44.2 -47.8 -53.5 18.2 49.2 7.1 509 70 D V H X S+ 0 0 28 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.903 115.8 46.5 -61.8 -45.6 19.8 52.4 8.2 510 71 D I H X S+ 0 0 7 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.937 117.8 41.5 -65.3 -47.8 23.4 50.9 8.3 511 72 D N H X S+ 0 0 90 -4,-3.1 4,-2.7 2,-0.2 5,-0.2 0.913 113.6 53.7 -66.6 -41.7 23.1 49.2 4.9 512 73 D S H X S+ 0 0 49 -4,-2.8 4,-2.6 -5,-0.4 5,-0.2 0.938 109.8 48.6 -54.1 -49.3 21.3 52.2 3.5 513 74 D A H X S+ 0 0 3 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.874 111.0 49.0 -60.9 -41.9 24.3 54.4 4.7 514 75 D X H X S+ 0 0 37 -4,-2.0 4,-2.2 2,-0.2 10,-0.2 0.956 112.8 47.1 -65.0 -49.3 26.9 52.1 3.2 515 76 D A H X S+ 0 0 67 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.945 117.5 43.7 -52.8 -52.7 25.2 51.9 -0.2 516 77 D Q H X S+ 0 0 57 -4,-2.6 4,-1.0 -5,-0.2 -2,-0.2 0.890 110.5 54.5 -61.4 -39.3 24.8 55.7 -0.2 517 78 D A H ><>S+ 0 0 0 -4,-2.8 5,-2.5 -5,-0.2 3,-0.5 0.894 105.8 53.9 -63.3 -38.7 28.3 56.3 1.1 518 79 D E H ><5S+ 0 0 87 -4,-2.2 3,-2.2 1,-0.2 -1,-0.2 0.942 105.4 51.9 -62.5 -48.5 29.6 54.2 -1.9 519 80 D S H 3<5S+ 0 0 105 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.716 108.2 54.0 -59.9 -20.6 27.8 56.4 -4.4 520 81 D L T <<5S- 0 0 54 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.174 125.2-102.4 -97.5 16.0 29.4 59.5 -2.8 521 82 D G T < 5S+ 0 0 28 -3,-2.2 104,-2.0 1,-0.2 2,-0.3 0.801 79.5 132.3 68.7 29.5 32.9 58.0 -3.2 522 83 D L E < -D 624 0D 0 -5,-2.5 2,-0.9 103,-0.4 -1,-0.2 -0.870 62.0 -98.8-107.6 145.6 33.3 56.9 0.4 523 84 D N E -D 623 0D 33 100,-2.5 100,-0.6 -2,-0.3 -5,-0.0 -0.849 32.1-142.1 -77.7 107.5 34.5 53.6 1.8 524 85 D G S > S+ 0 0 1 -2,-0.9 3,-1.1 2,-0.3 4,-0.4 0.587 88.3 31.1 101.7-125.3 32.0 51.7 2.6 525 86 D E G > S+ 0 0 122 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.684 107.0 76.7 -66.6 -19.9 32.6 49.6 5.7 526 87 D S G 3 S+ 0 0 13 1,-0.2 -2,-0.3 2,-0.1 4,-0.2 0.740 94.9 50.9 -61.1 -19.0 34.8 52.6 6.9 527 88 D I G X> S+ 0 0 0 -3,-1.1 4,-2.2 1,-0.1 3,-0.6 0.641 86.7 86.6 -92.1 -17.2 31.5 54.4 7.6 528 89 D K H <> S+ 0 0 75 -3,-0.8 4,-2.9 -4,-0.4 5,-0.2 0.882 85.7 49.5 -58.3 -51.2 29.9 51.6 9.7 529 90 D P H 3> S+ 0 0 43 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.790 111.7 50.6 -59.6 -30.9 31.4 52.5 13.1 530 91 D L H <> S+ 0 0 0 -3,-0.6 4,-1.7 88,-0.3 -2,-0.2 0.883 111.2 48.6 -68.4 -45.0 30.3 56.1 12.7 531 92 D X H X S+ 0 0 1 -4,-2.2 4,-2.3 1,-0.2 3,-0.3 0.952 112.2 48.3 -61.3 -49.7 26.8 54.9 11.8 532 93 D V H X S+ 0 0 51 -4,-2.9 4,-3.0 1,-0.2 -2,-0.2 0.904 110.8 51.0 -55.0 -47.0 26.7 52.6 14.8 533 94 D A H X S+ 0 0 5 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.807 110.8 49.2 -61.2 -35.6 27.9 55.4 17.2 534 95 D Q H X S+ 0 0 3 -4,-1.7 4,-2.0 -3,-0.3 -1,-0.2 0.885 112.4 46.3 -69.1 -46.5 25.2 57.7 15.8 535 96 D I H X S+ 0 0 13 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.886 113.4 50.5 -60.4 -43.9 22.5 55.1 16.3 536 97 D N H X S+ 0 0 36 -4,-3.0 4,-2.8 2,-0.2 -2,-0.2 0.929 110.6 48.4 -60.6 -50.1 23.8 54.4 19.8 537 98 D A H X S+ 0 0 1 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.905 113.2 49.2 -54.2 -42.3 23.8 58.1 20.7 538 99 D A H X S+ 0 0 4 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.889 111.9 46.8 -66.6 -41.3 20.3 58.2 19.4 539 100 D K H X S+ 0 0 12 -4,-2.5 4,-3.2 2,-0.2 5,-0.2 0.880 108.6 56.7 -65.2 -38.9 19.1 55.2 21.4 540 101 D A H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.922 108.4 46.3 -58.5 -46.7 20.8 56.5 24.5 541 102 D I H X S+ 0 0 3 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.968 115.6 46.8 -59.6 -52.2 18.7 59.8 24.2 542 103 D Q H X S+ 0 0 8 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.881 110.3 51.2 -55.7 -46.7 15.5 57.7 23.6 543 104 D Y H X S+ 0 0 6 -4,-3.2 4,-1.7 1,-0.2 -1,-0.2 0.870 110.8 50.6 -60.7 -42.0 16.1 55.3 26.5 544 105 D R H X S+ 0 0 20 -4,-1.9 4,-2.5 -5,-0.2 -2,-0.2 0.874 109.2 49.1 -66.7 -38.1 16.7 58.2 28.8 545 106 D Y H X S+ 0 0 8 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.941 110.2 51.7 -62.1 -47.5 13.4 60.0 27.8 546 107 D R H X S+ 0 0 15 -4,-2.5 4,-0.6 1,-0.2 -2,-0.2 0.876 112.0 48.5 -56.4 -40.3 11.5 56.7 28.3 547 108 D A H >X S+ 0 0 0 -4,-1.7 3,-0.9 -5,-0.2 4,-0.6 0.943 113.5 44.1 -63.5 -48.4 13.1 56.5 31.7 548 109 D D H >X S+ 0 0 39 -4,-2.5 4,-2.8 1,-0.2 3,-0.8 0.911 106.9 61.3 -65.8 -39.5 12.3 60.1 32.7 549 110 D W H 3< S+ 0 0 36 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.663 89.3 70.6 -63.9 -19.4 8.7 59.9 31.4 550 111 D L H << S+ 0 0 43 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.933 119.9 15.4 -64.1 -45.9 7.8 57.1 33.7 551 112 D S H << S+ 0 0 31 -3,-0.8 -2,-0.2 -4,-0.6 -1,-0.2 0.624 138.9 36.8-102.2 -19.2 7.8 59.5 36.8 552 113 D Q S < S- 0 0 102 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 -0.652 76.2-168.2-135.7 82.5 7.8 62.8 34.9 553 114 D P - 0 0 92 0, 0.0 -3,-0.0 0, 0.0 3,-0.0 -0.485 23.2-126.0 -66.2 143.5 5.7 63.1 31.6 554 115 D E > - 0 0 77 -2,-0.1 3,-0.7 3,-0.1 -5,-0.0 -0.988 23.4-179.8 58.7 36.3 5.7 65.5 29.3 555 116 D P T 3 S+ 0 0 119 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.879 86.5 47.6 -57.1 -50.6 2.1 66.9 28.6 556 117 D G T 3 S+ 0 0 45 1,-0.0 2,-1.0 2,-0.0 -273,-0.2 0.571 88.0 102.9 -74.4 -10.5 3.2 69.5 25.9 557 118 D W < + 0 0 16 -3,-0.7 -3,-0.1 -274,-0.1 -1,-0.0 -0.636 44.6 173.9 -75.8 102.7 5.3 66.8 24.1 558 119 D Q - 0 0 124 -2,-1.0 2,-0.1 -66,-0.0 -66,-0.1 -0.912 27.6-134.9-107.5 109.9 3.3 65.7 21.0 559 120 D P - 0 0 20 0, 0.0 3,-0.1 0, 0.0 -71,-0.1 -0.361 16.1-124.5 -65.2 130.6 5.5 63.4 18.9 560 121 D K - 0 0 48 1,-0.1 -68,-0.1 -2,-0.1 5,-0.1 -0.307 49.4 -72.5 -63.2 157.8 5.5 64.0 15.1 561 122 D P > - 0 0 65 0, 0.0 4,-2.2 0, 0.0 3,-0.3 -0.302 44.5-130.4 -58.7 135.6 4.5 61.0 12.9 562 123 D L H > S+ 0 0 15 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.828 103.6 53.4 -63.0 -38.2 7.4 58.5 12.9 563 124 D D H > S+ 0 0 115 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.933 111.1 47.8 -61.8 -41.1 7.6 58.0 9.2 564 125 D D H > S+ 0 0 68 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.928 113.0 47.9 -64.3 -43.2 8.0 61.8 8.7 565 126 D V H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.906 109.8 53.1 -64.5 -40.5 10.6 62.0 11.4 566 127 D R H X S+ 0 0 69 -4,-2.9 4,-2.7 2,-0.2 -1,-0.2 0.861 106.8 51.9 -63.6 -35.9 12.5 59.0 9.9 567 128 D A H X S+ 0 0 64 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.916 111.0 48.5 -64.0 -41.1 12.6 60.8 6.4 568 129 D N H X S+ 0 0 17 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.905 113.6 46.1 -64.4 -44.7 14.0 63.9 8.1 569 130 D I H X S+ 0 0 13 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.922 113.0 50.5 -62.5 -44.6 16.6 61.7 9.9 570 131 D G H X S+ 0 0 31 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.881 107.3 53.3 -62.6 -39.2 17.5 59.8 6.7 571 132 D E H X S+ 0 0 82 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.936 110.6 47.4 -67.0 -42.5 17.9 63.1 4.8 572 133 D L H X S+ 0 0 4 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.893 106.6 56.4 -61.3 -42.2 20.4 64.3 7.4 573 134 D S H X S+ 0 0 11 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.927 110.2 46.7 -50.9 -49.3 22.3 60.9 7.4 574 135 D T H X S+ 0 0 36 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.930 112.3 49.1 -55.2 -50.6 22.8 61.5 3.6 575 136 D K H X S+ 0 0 58 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.826 108.7 54.1 -63.8 -32.3 23.9 65.1 4.1 576 137 D I H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.912 110.6 45.2 -65.9 -44.7 26.3 64.0 6.8 577 138 D L H X S+ 0 0 1 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.963 113.8 49.5 -62.8 -49.7 27.9 61.5 4.3 578 139 D E H X S+ 0 0 77 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.929 112.9 47.8 -50.8 -54.6 28.0 64.2 1.6 579 140 D Q H X S+ 0 0 19 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.851 111.5 49.0 -58.9 -42.5 29.6 66.7 4.0 580 141 D I H X S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.907 112.4 49.7 -62.6 -45.1 32.2 64.1 5.2 581 142 D A H X S+ 0 0 7 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.913 111.5 48.1 -62.6 -44.1 33.0 63.3 1.5 582 143 D E H X S+ 0 0 91 -4,-3.0 4,-0.7 -5,-0.2 -1,-0.2 0.912 114.8 46.2 -60.3 -38.2 33.4 67.0 0.6 583 144 D E H X S+ 0 0 5 -4,-2.0 4,-2.6 -5,-0.2 -2,-0.2 0.819 107.9 54.0 -79.9 -33.1 35.7 67.6 3.6 584 145 D L H < S+ 0 0 55 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.930 112.0 45.8 -62.8 -48.8 37.9 64.6 3.2 585 146 D K H < S+ 0 0 147 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.766 132.3 15.2 -57.7 -27.1 38.7 65.6 -0.4 586 147 D T H < S+ 0 0 107 -4,-0.7 2,-0.2 -5,-0.1 -2,-0.2 0.744 93.9 85.3-134.3 -37.1 39.3 69.2 0.6 587 148 D d S < S- 0 0 12 -4,-2.6 -114,-0.0 -5,-0.1 3,-0.0 -0.599 71.7-109.5 -87.5 146.1 39.8 70.5 4.2 588 149 D K > - 0 0 134 -2,-0.2 4,-2.0 1,-0.1 -1,-0.1 -0.433 26.5-120.0 -63.5 138.3 43.2 70.6 6.0 589 150 D P T 4 S+ 0 0 91 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.935 112.4 49.3 -36.6 -67.5 43.6 68.1 8.9 590 151 D A T 4 S+ 0 0 86 1,-0.2 -3,-0.0 4,-0.0 0, 0.0 0.939 109.0 51.9 -39.7 -73.9 44.2 70.9 11.5 591 152 D E T 4 S+ 0 0 106 2,-0.0 -1,-0.2 -344,-0.0 3,-0.1 0.793 88.4 98.8 -29.7 -51.4 41.1 72.9 10.4 592 153 D X S < S- 0 0 42 -4,-2.0 -120,-0.0 -3,-0.3 0, 0.0 -0.174 94.5 -75.1 -52.3 135.3 38.9 69.7 10.7 593 154 D G - 0 0 20 1,-0.1 2,-0.2 4,-0.1 -1,-0.1 0.239 44.6-146.5 -36.5 141.4 37.0 69.8 14.1 594 155 D D > - 0 0 56 -3,-0.1 4,-2.2 1,-0.0 5,-0.1 -0.461 32.8 -96.1-100.7-176.4 38.7 69.0 17.4 595 156 D K H > S+ 0 0 115 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.890 122.2 53.2 -72.2 -45.5 37.1 67.2 20.4 596 157 D A H > S+ 0 0 34 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.877 110.9 48.2 -52.4 -44.3 36.2 70.4 22.2 597 158 D H H > S+ 0 0 9 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.891 110.9 51.0 -69.9 -39.4 34.3 71.7 19.1 598 159 D F H X S+ 0 0 5 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.908 111.7 47.9 -59.7 -41.7 32.6 68.4 18.7 599 160 D I H < S+ 0 0 58 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.913 113.0 46.4 -68.1 -46.2 31.5 68.6 22.3 600 161 D N H < S+ 0 0 16 -4,-2.7 -308,-0.2 1,-0.2 -2,-0.2 0.931 118.1 44.2 -58.2 -42.9 30.3 72.2 22.1 601 162 D T H < S+ 0 0 10 -4,-2.6 2,-1.3 1,-0.2 -2,-0.2 0.886 104.6 60.9 -74.8 -40.6 28.4 71.4 18.9 602 163 D I < + 0 0 4 -4,-2.5 2,-0.5 -5,-0.2 -1,-0.2 -0.722 70.0 148.2 -94.7 87.7 26.8 68.1 19.8 603 164 D R + 0 0 82 -2,-1.3 2,-0.3 -313,-0.2 -313,-0.1 -0.994 8.0 150.3-127.4 119.0 24.6 69.1 22.7 604 165 D Q > - 0 0 14 -2,-0.5 3,-1.3 3,-0.2 2,-0.2 -0.968 51.7-104.1-141.9 151.5 21.4 67.4 23.4 605 166 D H T 3 S+ 0 0 76 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.599 111.2 26.8 -66.4 137.2 19.6 66.8 26.6 606 167 D N T 3 S+ 0 0 24 1,-0.3 2,-0.4 -2,-0.2 -1,-0.2 0.582 96.3 110.5 86.0 14.2 20.1 63.1 27.5 607 168 D L < - 0 0 24 -3,-1.3 -1,-0.3 -63,-0.1 -3,-0.2 -0.965 53.9-153.0-118.7 129.5 23.4 62.8 25.6 608 169 D T > - 0 0 45 -2,-0.4 4,-1.9 -3,-0.1 5,-0.2 -0.572 30.0-107.5-101.1 172.3 26.6 62.3 27.6 609 170 D S H > S+ 0 0 67 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.893 121.7 56.5 -58.7 -43.2 30.2 63.1 27.0 610 171 D A H > S+ 0 0 17 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.866 106.2 50.6 -56.0 -41.2 30.8 59.4 26.5 611 172 D D H > S+ 0 0 3 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.906 113.0 44.5 -59.8 -48.6 28.1 59.3 23.7 612 173 D V H X S+ 0 0 4 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.913 111.1 54.9 -65.6 -42.3 29.7 62.3 21.9 613 174 D E H X S+ 0 0 80 -4,-2.9 4,-2.1 1,-0.2 5,-0.2 0.847 103.3 54.5 -61.5 -37.4 33.2 60.9 22.3 614 175 D A H X S+ 0 0 34 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.919 111.1 46.4 -61.7 -39.9 32.2 57.6 20.6 615 176 D I H X S+ 0 0 0 -4,-1.4 4,-2.2 -82,-0.2 -2,-0.2 0.917 110.6 54.0 -65.1 -43.6 30.9 59.6 17.6 616 177 D F H X S+ 0 0 26 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.959 109.0 45.2 -58.4 -55.6 34.0 61.7 17.5 617 178 D S H < S+ 0 0 73 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.860 115.2 47.8 -56.8 -37.6 36.5 58.7 17.4 618 179 D T H >< S+ 0 0 18 -4,-1.6 3,-1.9 -5,-0.2 -88,-0.3 0.866 104.7 59.2 -72.6 -34.3 34.5 56.9 14.7 619 180 D F H >< S+ 0 0 19 -4,-2.2 3,-1.4 1,-0.3 -1,-0.2 0.880 99.3 61.7 -60.8 -37.0 34.2 60.0 12.6 620 181 D N T 3< S+ 0 0 95 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.344 98.6 54.4 -72.7 2.9 38.0 60.1 12.5 621 182 D Q T < S+ 0 0 107 -3,-1.9 -1,-0.2 -95,-0.1 -2,-0.2 0.260 78.2 115.5-120.0 7.4 38.3 56.6 10.7 622 183 D V < - 0 0 12 -3,-1.4 2,-0.3 -4,-0.2 -98,-0.1 -0.520 45.3-179.9 -71.4 147.1 36.0 57.5 7.8 623 184 D K E -D 523 0D 120 -100,-0.6 -100,-2.5 -2,-0.2 -97,-0.1 -0.995 29.3-103.4-152.3 150.1 37.9 57.5 4.5 624 185 D L E D 522 0D 62 -2,-0.3 -102,-0.3 -102,-0.2 -103,-0.1 -0.343 360.0 360.0 -67.2 150.0 37.4 58.1 0.8 625 186 D K 0 0 136 -104,-2.0 -103,-0.4 -107,-0.1 -104,-0.1 0.282 360.0 360.0 152.1 360.0 37.2 55.1 -1.7