==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 28-DEC-07 3BTC . COMPND 2 MOLECULE: HTH-TYPE TRANSCRIPTIONAL REGULATOR QACR; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR M.A.SCHUMACHER,J.T.SCHUMAN,R.G.BRENNAN . 744 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34827.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 611 82.1 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 . 0 0.0 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 . 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 . 25 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 94 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 474 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 1 3 4 0 0 3 0 0 4 1 1 6 2 1 1 0 1 3 2 0 1 1 0 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 B N 0 0 143 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-157.2 -96.5 -76.1 11.6 2 3 B L > + 0 0 60 3,-0.1 4,-1.6 35,-0.0 5,-0.1 0.565 360.0 45.6-127.8 -63.0 -93.0 -77.1 10.4 3 4 B K H > S+ 0 0 86 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.832 119.4 46.8 -55.7 -33.5 -92.2 -75.3 7.2 4 5 B D H > S+ 0 0 84 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.857 104.1 57.4 -79.5 -36.1 -93.5 -72.1 8.7 5 6 B K H > S+ 0 0 94 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.819 106.6 54.2 -63.2 -27.4 -91.7 -72.4 12.0 6 7 B I H X S+ 0 0 0 -4,-1.6 4,-4.0 2,-0.2 5,-0.4 0.993 108.1 45.0 -65.5 -63.4 -88.5 -72.6 9.9 7 8 B L H X S+ 0 0 26 -4,-1.6 4,-1.4 1,-0.2 -2,-0.2 0.772 117.0 52.0 -51.1 -27.4 -89.2 -69.3 8.1 8 9 B G H X S+ 0 0 36 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.978 114.9 34.5 -75.4 -60.8 -90.1 -68.0 11.5 9 10 B V H X S+ 0 0 27 -4,-3.2 4,-1.9 1,-0.2 -2,-0.2 0.873 118.5 56.0 -62.5 -34.9 -87.0 -69.0 13.5 10 11 B A H X S+ 0 0 0 -4,-4.0 4,-2.9 -5,-0.3 -1,-0.2 0.910 110.1 44.4 -62.4 -43.9 -85.0 -68.3 10.4 11 12 B K H X S+ 0 0 47 -4,-1.4 4,-1.9 -5,-0.4 -2,-0.2 0.957 111.4 51.8 -65.3 -51.6 -86.3 -64.8 10.2 12 13 B E H X S+ 0 0 90 -4,-2.7 4,-1.5 1,-0.2 5,-0.3 0.840 115.3 45.1 -55.4 -33.1 -85.9 -64.1 13.9 13 14 B L H X S+ 0 0 7 -4,-1.9 4,-1.6 -5,-0.2 -2,-0.2 0.955 107.1 54.3 -75.8 -53.0 -82.3 -65.2 13.5 14 15 B F H < S+ 0 0 6 -4,-2.9 83,-0.2 1,-0.2 -2,-0.2 0.788 114.3 45.0 -51.7 -30.8 -81.4 -63.4 10.3 15 16 B I H < S+ 0 0 49 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.983 119.2 34.5 -77.5 -69.4 -82.5 -60.2 12.0 16 17 B K H < S+ 0 0 113 -4,-1.5 -3,-0.2 -5,-0.2 -2,-0.2 0.958 126.5 36.6 -47.7 -67.1 -80.9 -60.3 15.4 17 18 B N S < S- 0 0 46 -4,-1.6 80,-0.1 -5,-0.3 461,-0.1 -0.441 101.4 -96.1 -85.1 164.0 -77.8 -62.1 14.4 18 19 B G - 0 0 13 -2,-0.1 4,-0.3 1,-0.1 -1,-0.2 0.221 36.3 -99.7 -65.5-166.2 -76.1 -61.4 11.1 19 20 B Y S > S+ 0 0 0 2,-0.2 3,-0.7 77,-0.1 -1,-0.1 0.926 123.3 36.4 -82.7 -50.6 -76.6 -63.3 7.9 20 21 B N T 3 S+ 0 0 43 1,-0.2 -1,-0.1 -6,-0.1 -6,-0.0 0.845 109.7 64.9 -69.6 -35.5 -73.4 -65.4 8.2 21 22 B A T 3 S+ 0 0 56 -7,-0.1 2,-0.4 -8,-0.1 -1,-0.2 0.717 93.7 73.5 -60.7 -22.4 -73.8 -65.7 12.0 22 23 B T < + 0 0 2 -3,-0.7 2,-0.3 -4,-0.3 -12,-0.0 -0.817 66.9 177.5 -98.3 133.7 -77.0 -67.7 11.4 23 24 B T > - 0 0 67 -2,-0.4 4,-1.4 1,-0.1 3,-0.3 -0.930 46.1-103.9-135.7 159.7 -76.7 -71.2 10.2 24 25 B T H > S+ 0 0 82 -2,-0.3 4,-1.4 1,-0.2 5,-0.3 0.819 119.0 59.4 -47.3 -36.2 -78.9 -74.2 9.4 25 26 B G H > S+ 0 0 35 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.974 99.0 53.0 -60.3 -56.8 -77.8 -75.7 12.7 26 27 B E H > S+ 0 0 70 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.815 107.8 58.8 -48.7 -31.3 -79.1 -72.9 14.8 27 28 B I H >X S+ 0 0 9 -4,-1.4 4,-1.9 2,-0.2 3,-1.4 0.995 107.5 37.0 -61.0 -78.9 -82.4 -73.4 13.0 28 29 B V H 3X>S+ 0 0 30 -4,-1.4 4,-1.4 1,-0.3 5,-0.9 0.793 114.3 60.8 -44.8 -34.8 -83.3 -77.0 13.8 29 30 B K H 3<5S+ 0 0 173 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.904 119.9 24.0 -64.5 -40.9 -81.8 -76.5 17.2 30 31 B L H <<5S+ 0 0 109 -4,-1.6 -2,-0.2 -3,-1.4 -1,-0.2 0.389 124.4 55.6-103.5 1.1 -84.3 -73.8 18.1 31 32 B S H <5S- 0 0 13 -4,-1.9 -3,-0.2 -5,-0.1 -2,-0.2 0.490 97.2-136.2-107.4 -9.1 -86.9 -75.0 15.6 32 33 B E T <5 + 0 0 158 -4,-1.4 2,-0.2 -5,-0.3 -3,-0.2 0.962 66.7 97.8 47.3 66.6 -87.1 -78.6 17.0 33 34 B S S S+ 0 0 63 1,-0.1 2,-1.6 2,-0.1 3,-0.9 0.772 77.5 92.6 -56.2 -23.8 -87.0 -80.8 5.4 38 39 B L T 3 S+ 0 0 38 1,-0.2 -1,-0.1 -4,-0.1 10,-0.0 -0.550 70.3 64.8 -75.0 89.2 -85.0 -77.9 3.9 39 40 B Y T 3 S+ 0 0 155 -2,-1.6 -1,-0.2 5,-0.0 -2,-0.1 0.303 70.9 77.7-173.2 -34.8 -85.0 -78.7 0.3 40 41 B Y S < S- 0 0 197 -3,-0.9 3,-0.1 1,-0.2 -2,-0.1 0.893 130.6 -5.3 -60.2 -40.7 -88.5 -78.7 -1.3 41 42 B H S S+ 0 0 80 1,-0.1 2,-0.8 3,-0.0 -1,-0.2 0.465 132.2 69.8-126.1 -18.3 -88.4 -74.8 -1.5 42 43 B F + 0 0 11 -5,-0.3 -1,-0.1 1,-0.2 -2,-0.1 -0.762 48.3 162.3-108.5 83.6 -85.2 -74.3 0.4 43 44 B K S S- 0 0 118 -2,-0.8 2,-0.3 -3,-0.1 -1,-0.2 0.649 72.2 -11.3 -74.3 -16.0 -82.3 -75.5 -1.9 44 45 B T S > S- 0 0 51 -3,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.969 81.3 -83.0-167.4 176.9 -79.8 -73.5 0.1 45 46 B K H > S+ 0 0 34 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.898 125.4 58.8 -59.1 -38.2 -79.3 -70.9 2.8 46 47 B E H > S+ 0 0 21 2,-0.2 4,-3.6 1,-0.2 5,-0.4 0.973 106.1 43.1 -55.3 -62.6 -79.8 -68.4 -0.1 47 48 B N H > S+ 0 0 29 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.895 112.2 54.8 -52.7 -43.3 -83.3 -69.5 -1.1 48 49 B L H X S+ 0 0 14 -4,-2.2 4,-2.2 2,-0.2 -1,-0.3 0.923 117.8 36.8 -56.2 -43.7 -84.3 -69.7 2.6 49 50 B F H X S+ 0 0 0 -4,-2.4 4,-3.0 -3,-0.3 -2,-0.2 0.991 115.0 51.2 -70.8 -63.7 -83.2 -66.1 2.9 50 51 B L H X S+ 0 0 3 -4,-3.6 4,-1.3 1,-0.2 -1,-0.2 0.666 113.1 52.0 -49.4 -15.5 -84.3 -64.8 -0.5 51 52 B E H X S+ 0 0 51 -4,-1.4 4,-2.6 -5,-0.4 -1,-0.2 0.942 108.0 45.5 -84.0 -62.8 -87.6 -66.5 0.5 52 53 B I H X S+ 0 0 2 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.831 112.9 56.3 -48.5 -34.5 -88.1 -64.8 3.9 53 54 B L H X S+ 0 0 5 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.992 107.0 45.0 -62.3 -60.0 -87.1 -61.6 2.2 54 55 B N H X S+ 0 0 58 -4,-1.3 4,-1.9 1,-0.2 -2,-0.2 0.878 112.6 53.5 -50.4 -43.0 -89.8 -61.8 -0.4 55 56 B I H X S+ 0 0 46 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.947 111.2 44.8 -57.3 -52.3 -92.3 -62.7 2.3 56 57 B Q H X S+ 0 0 5 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.874 106.8 58.8 -61.2 -41.4 -91.4 -59.7 4.4 57 58 B E H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 -1,-0.2 0.918 109.3 46.2 -53.8 -43.9 -91.4 -57.4 1.3 58 59 B S H X S+ 0 0 51 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.899 107.1 56.0 -65.1 -43.8 -95.1 -58.4 0.9 59 60 B K H X S+ 0 0 83 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.879 114.4 42.2 -55.1 -38.9 -95.8 -58.0 4.5 60 61 B W H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.936 110.7 52.0 -75.0 -49.1 -94.5 -54.4 4.0 61 62 B Q H X S+ 0 0 29 -4,-3.1 4,-1.2 1,-0.2 -2,-0.2 0.745 108.8 56.2 -60.4 -21.9 -96.2 -53.7 0.7 62 63 B E H X S+ 0 0 123 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.927 106.1 46.6 -74.4 -49.3 -99.4 -54.8 2.4 63 64 B Q H X S+ 0 0 22 -4,-1.4 4,-1.1 1,-0.2 5,-0.3 0.911 107.8 59.4 -59.4 -43.9 -99.2 -52.3 5.2 64 65 B W H >X S+ 0 0 2 -4,-2.4 4,-2.9 1,-0.2 3,-0.5 0.894 105.0 48.4 -53.2 -44.9 -98.4 -49.6 2.7 65 66 B K H 3< S+ 0 0 97 -4,-1.2 4,-0.5 1,-0.2 -1,-0.2 0.927 110.8 49.9 -62.9 -46.8 -101.7 -50.2 0.9 66 67 B K H 3< S+ 0 0 146 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.627 124.0 30.9 -68.4 -13.6 -103.8 -50.1 4.1 67 68 B E H X< S+ 0 0 65 -4,-1.1 3,-1.7 -3,-0.5 4,-0.2 0.627 92.8 84.7-120.9 -16.9 -102.1 -46.9 5.1 68 69 B Q G >< S+ 0 0 33 -4,-2.9 3,-2.2 1,-0.3 -3,-0.1 0.728 75.9 77.9 -60.8 -19.0 -101.3 -45.0 2.0 69 70 B I G 3 S+ 0 0 111 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.848 75.6 74.6 -59.1 -32.6 -104.8 -43.6 2.0 70 71 B K G < S+ 0 0 145 -3,-1.7 2,-0.5 2,-0.0 -1,-0.3 0.751 90.3 72.0 -52.3 -21.2 -103.8 -41.1 4.7 71 72 B A < + 0 0 9 -3,-2.2 6,-0.0 -4,-0.2 3,-0.0 -0.872 58.6 178.4-104.1 129.3 -102.0 -39.4 1.9 72 73 B K + 0 0 141 -2,-0.5 -1,-0.2 1,-0.0 2,-0.1 0.945 66.0 47.2 -88.2 -70.3 -103.9 -37.5 -0.7 73 74 B T S >> S- 0 0 54 1,-0.1 3,-1.5 4,-0.0 4,-1.4 -0.463 84.7-122.7 -73.1 149.3 -101.5 -35.9 -3.1 74 75 B N H 3> S+ 0 0 11 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.849 114.4 68.1 -60.0 -32.1 -98.7 -38.1 -4.4 75 76 B R H 3> S+ 0 0 91 1,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.870 105.1 43.7 -54.8 -30.6 -96.4 -35.5 -3.0 76 77 B E H <> S+ 0 0 72 -3,-1.5 4,-2.7 2,-0.2 -1,-0.3 0.823 104.7 61.1 -83.3 -32.5 -97.7 -36.8 0.3 77 78 B K H X S+ 0 0 26 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.950 104.6 51.4 -57.4 -45.1 -97.5 -40.5 -0.8 78 79 B F H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.959 112.0 44.1 -55.7 -58.1 -93.8 -40.0 -1.1 79 80 B Y H X S+ 0 0 47 -4,-1.3 4,-2.4 1,-0.2 -1,-0.2 0.899 114.4 50.0 -52.8 -47.6 -93.3 -38.4 2.4 80 81 B L H X S+ 0 0 32 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.851 109.2 51.9 -62.9 -37.7 -95.6 -41.0 4.0 81 82 B Y H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.976 112.2 43.9 -64.0 -54.1 -93.7 -43.9 2.4 82 83 B N H X S+ 0 0 0 -4,-2.3 4,-0.8 1,-0.2 -2,-0.2 0.871 115.8 49.2 -60.3 -37.8 -90.3 -42.7 3.5 83 84 B E H >X S+ 0 0 58 -4,-2.4 4,-0.9 -5,-0.2 3,-0.7 0.916 111.5 48.5 -66.2 -46.3 -91.7 -41.9 7.1 84 85 B L H >X S+ 0 0 23 -4,-2.6 4,-2.5 1,-0.2 3,-0.9 0.883 101.2 64.8 -63.0 -37.3 -93.4 -45.3 7.4 85 86 B S H 3< S+ 0 0 1 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.817 101.4 51.9 -53.9 -34.1 -90.2 -47.1 6.2 86 87 B L H << S+ 0 0 10 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.780 117.4 35.8 -73.4 -30.8 -88.6 -45.8 9.4 87 88 B T H << S+ 0 0 82 -3,-0.9 -2,-0.2 -4,-0.9 -1,-0.2 0.641 91.3 106.5-102.4 -15.2 -91.3 -47.1 11.7 88 89 B T < - 0 0 14 -4,-2.5 -28,-0.0 1,-0.1 -3,-0.0 -0.018 57.6-148.6 -60.5 168.7 -92.3 -50.4 10.1 89 90 B E S S+ 0 0 105 3,-0.1 2,-0.4 4,-0.0 -1,-0.1 0.131 70.6 97.7-120.2 11.8 -91.4 -53.8 11.4 90 91 B Y S S- 0 0 55 -31,-0.1 2,-3.7 -30,-0.1 -2,-0.1 -0.881 96.2 -32.8-114.5 139.4 -91.3 -55.3 7.9 91 92 B Y S > S+ 0 0 9 -2,-0.4 3,-1.7 1,-0.2 4,-0.2 -0.151 118.4 76.6 57.5 -49.3 -88.5 -55.9 5.5 92 93 B Y G > S+ 0 0 15 -2,-3.7 3,-1.5 1,-0.3 4,-0.3 0.805 81.2 67.0 -62.2 -30.8 -86.3 -53.0 6.6 93 94 B P G 3 S+ 0 0 41 0, 0.0 -1,-0.3 0, 0.0 4,-0.2 0.541 100.9 53.2 -69.1 0.0 -85.2 -54.7 9.8 94 95 B L G <> S+ 0 0 2 -3,-1.7 4,-2.8 2,-0.1 -2,-0.2 0.447 72.4 102.9-109.5 -5.1 -83.3 -57.2 7.5 95 96 B Q H <> S+ 0 0 5 -3,-1.5 4,-2.8 -4,-0.2 5,-0.2 0.863 82.3 55.1 -47.3 -37.7 -81.4 -54.6 5.4 96 97 B N H > S+ 0 0 16 -4,-0.3 4,-2.0 2,-0.2 3,-0.3 0.993 107.8 44.3 -58.6 -65.6 -78.4 -55.6 7.5 97 98 B A H > S+ 0 0 1 -83,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.851 113.9 56.3 -46.3 -36.7 -78.5 -59.3 6.8 98 99 B I H X S+ 0 0 11 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.955 103.2 49.7 -62.7 -53.5 -79.2 -58.2 3.2 99 100 B I H < S+ 0 0 13 -4,-2.8 4,-0.3 -3,-0.3 3,-0.3 0.935 113.8 48.4 -47.0 -54.2 -76.0 -56.1 2.8 100 101 B E H >< S+ 0 0 5 -4,-2.0 3,-2.2 1,-0.3 -1,-0.2 0.935 109.5 50.7 -53.5 -53.8 -74.0 -59.0 4.2 101 102 B F H >X S+ 0 0 7 -4,-2.6 3,-1.2 1,-0.3 4,-1.0 0.811 103.1 61.4 -58.2 -29.9 -75.6 -61.5 1.9 102 103 B Y T 3< S+ 0 0 36 -4,-2.2 -1,-0.3 -3,-0.3 -2,-0.2 0.553 99.0 57.5 -75.5 -5.1 -74.9 -59.2 -1.0 103 104 B T T <4 S+ 0 0 33 -3,-2.2 -1,-0.3 -4,-0.3 -2,-0.2 0.020 119.0 23.9-111.6 25.6 -71.2 -59.6 -0.3 104 105 B E T <4 S+ 0 0 60 -3,-1.2 2,-0.9 0, 0.0 3,-0.4 0.295 121.7 39.6-145.9 -71.8 -71.1 -63.4 -0.6 105 106 B Y S < S+ 0 0 72 -4,-1.0 -3,-0.1 1,-0.2 -2,-0.1 -0.172 85.0 102.1 -85.3 43.5 -73.7 -65.1 -2.6 106 107 B Y S S+ 0 0 93 -2,-0.9 -1,-0.2 1,-0.1 -4,-0.1 0.143 71.9 63.0-109.2 16.3 -73.6 -62.3 -5.3 107 108 B K S S+ 0 0 152 -3,-0.4 -2,-0.1 0, 0.0 -1,-0.1 0.764 83.7 83.8-105.0 -43.8 -71.6 -64.5 -7.7 108 109 B T - 0 0 55 1,-0.1 4,-0.1 2,-0.0 0, 0.0 -0.018 59.4-160.3 -55.9 166.7 -74.1 -67.3 -8.2 109 110 B N S S+ 0 0 130 2,-0.1 3,-0.4 3,-0.1 4,-0.2 0.691 77.2 72.3-121.1 -38.7 -76.8 -66.9 -10.9 110 111 B S S S+ 0 0 113 1,-0.3 4,-0.4 2,-0.2 3,-0.2 0.670 105.7 47.6 -55.5 -14.8 -79.6 -69.4 -10.2 111 112 B I S >> S+ 0 0 7 1,-0.2 4,-2.3 2,-0.2 3,-0.6 0.796 89.4 76.7 -95.8 -34.7 -80.4 -67.1 -7.3 112 113 B N H 3> S+ 0 0 62 -3,-0.4 4,-1.1 1,-0.2 -1,-0.2 0.422 88.1 68.6 -58.9 5.7 -80.3 -63.8 -9.1 113 114 B E H 3> S+ 0 0 123 -4,-0.2 4,-1.4 -3,-0.2 -1,-0.2 0.920 105.4 33.4 -87.1 -60.1 -83.7 -64.8 -10.4 114 115 B K H <> S+ 0 0 62 -3,-0.6 4,-1.6 -4,-0.4 -2,-0.2 0.864 118.8 63.1 -61.4 -35.2 -85.6 -64.6 -7.1 115 116 B M H >X S+ 0 0 15 -4,-2.3 4,-1.5 1,-0.2 3,-1.1 0.978 103.0 39.2 -53.4 -74.6 -83.3 -61.7 -6.3 116 117 B N H 3< S+ 0 0 68 -4,-1.1 4,-0.4 1,-0.3 -1,-0.2 0.806 109.1 64.2 -51.2 -32.2 -84.1 -59.2 -9.0 117 118 B K H >X S+ 0 0 134 -4,-1.4 3,-1.0 1,-0.2 4,-1.0 0.938 106.6 43.5 -56.8 -45.7 -87.8 -60.1 -8.7 118 119 B L H S+ 0 0 82 -3,-1.0 4,-2.7 -4,-0.4 3,-0.4 0.896 101.1 48.5 -89.4 -48.6 -88.7 -54.8 -8.2 121 122 B K H X S+ 0 0 55 -4,-1.0 4,-0.9 1,-0.2 -2,-0.2 0.773 108.6 63.1 -60.4 -24.3 -91.3 -54.7 -5.4 122 123 B Y H < S+ 0 0 10 -4,-1.1 4,-0.3 1,-0.2 -1,-0.2 0.905 115.9 24.4 -67.0 -47.7 -88.7 -52.6 -3.7 123 124 B I H >X S+ 0 0 17 -4,-0.8 4,-1.5 -3,-0.4 3,-0.5 0.620 104.3 84.2 -96.4 -12.0 -88.7 -49.8 -6.3 124 125 B D H >X S+ 0 0 81 -4,-2.7 4,-2.8 1,-0.2 3,-0.7 0.920 83.2 59.2 -55.3 -49.8 -92.3 -50.3 -7.5 125 126 B A H 3X S+ 0 0 2 -4,-0.9 4,-2.2 1,-0.3 -1,-0.2 0.871 110.8 43.6 -46.0 -43.3 -93.9 -48.3 -4.8 126 127 B Y H <> S+ 0 0 1 -3,-0.5 4,-2.6 -4,-0.3 -1,-0.3 0.750 108.9 57.9 -74.3 -28.3 -91.8 -45.4 -6.0 127 128 B H H X S+ 0 0 107 -4,-2.5 3,-2.1 -5,-0.3 4,-1.3 0.958 109.1 50.7 -65.8 -51.9 -95.7 -42.0 -12.3 132 133 B E H 3X S+ 0 0 85 -4,-3.4 4,-1.8 1,-0.3 -1,-0.2 0.718 107.8 58.7 -57.8 -20.0 -99.1 -41.1 -10.9 133 134 B G H 3<>S+ 0 0 0 -4,-0.8 5,-1.4 -5,-0.4 6,-1.3 0.699 97.2 58.1 -82.4 -21.5 -97.4 -37.8 -10.2 134 135 B N H <<5S+ 0 0 47 -3,-2.1 3,-0.3 -4,-0.6 -2,-0.2 0.828 108.4 47.1 -75.9 -30.0 -96.7 -37.3 -13.8 135 136 B L H <5S+ 0 0 131 -4,-1.3 -2,-0.2 1,-0.2 -3,-0.1 0.976 110.5 48.4 -71.2 -58.4 -100.4 -37.6 -14.6 136 137 B N T <5S- 0 0 103 -4,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.431 110.5-124.0 -64.2 5.5 -101.5 -35.2 -11.9 137 138 B G T 5 + 0 0 58 -3,-0.3 -3,-0.2 2,-0.2 -1,-0.1 0.722 69.0 139.2 58.0 21.2 -98.9 -32.9 -13.2 138 139 B E S - 0 0 13 -2,-0.4 3,-0.5 -11,-0.2 -7,-0.1 -0.940 14.0-173.6-113.3 115.6 -89.9 -36.9 -14.6 142 143 B N T 3 S+ 0 0 152 -2,-0.6 -1,-0.1 1,-0.2 -2,-0.0 -0.088 85.5 45.9 -98.4 37.8 -88.8 -38.3 -17.9 143 144 B D T >> + 0 0 50 2,-0.0 4,-1.8 3,-0.0 3,-1.1 -0.052 62.7 160.4-168.6 45.0 -86.8 -41.1 -16.3 144 145 B V H <> S+ 0 0 16 -3,-0.5 4,-2.9 1,-0.3 5,-0.2 0.813 73.4 57.5 -42.8 -47.1 -89.1 -42.6 -13.6 145 146 B N H 3> S+ 0 0 98 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.901 110.4 44.2 -57.1 -42.0 -87.2 -45.9 -13.4 146 147 B A H <> S+ 0 0 19 -3,-1.1 4,-3.0 2,-0.2 -2,-0.2 0.987 115.7 44.5 -66.0 -59.7 -83.9 -44.1 -12.5 147 148 B V H X S+ 0 0 2 -4,-1.8 4,-2.7 1,-0.2 5,-0.2 0.846 111.5 56.6 -53.5 -36.7 -85.4 -41.7 -10.0 148 149 B S H X S+ 0 0 0 -4,-2.9 4,-2.8 -5,-0.3 -1,-0.2 0.972 110.2 42.3 -60.1 -53.0 -87.3 -44.5 -8.5 149 150 B K H X S+ 0 0 46 -4,-2.0 4,-2.5 -5,-0.2 5,-0.3 0.908 113.2 54.6 -59.0 -45.5 -84.2 -46.6 -7.9 150 151 B I H X S+ 0 0 1 -4,-3.0 4,-3.2 1,-0.2 -2,-0.2 0.957 112.9 41.9 -52.4 -57.1 -82.3 -43.4 -6.6 151 152 B A H X S+ 0 0 0 -4,-2.7 4,-3.3 2,-0.2 5,-0.3 0.919 111.3 53.5 -59.6 -49.8 -85.0 -42.7 -4.1 152 153 B A H X S+ 0 0 0 -4,-2.8 4,-2.9 -5,-0.2 5,-0.2 0.968 116.2 40.6 -52.3 -53.6 -85.6 -46.2 -2.9 153 154 B N H X S+ 0 0 2 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.920 113.4 52.3 -64.8 -41.0 -81.9 -46.6 -2.2 154 155 B A H X S+ 0 0 0 -4,-3.2 4,-1.9 -5,-0.3 3,-0.3 0.969 114.0 44.3 -57.3 -50.9 -81.4 -43.1 -0.7 155 156 B V H X S+ 0 0 0 -4,-3.3 4,-2.5 1,-0.3 -2,-0.2 0.930 110.0 54.1 -57.7 -49.0 -84.3 -43.7 1.7 156 157 B N H X S+ 0 0 0 -4,-2.9 4,-2.4 -5,-0.3 -1,-0.3 0.848 105.9 55.6 -55.4 -33.1 -83.1 -47.2 2.5 157 158 B G H X S+ 0 0 0 -4,-2.0 4,-3.0 -3,-0.3 -1,-0.2 0.953 107.7 47.5 -63.3 -48.3 -79.8 -45.5 3.4 158 159 B I H < S+ 0 0 0 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.874 113.8 46.9 -62.0 -41.7 -81.4 -43.2 5.8 159 160 B V H >< S+ 0 0 10 -4,-2.5 3,-0.8 -5,-0.1 4,-0.4 0.973 119.2 40.3 -64.9 -50.8 -83.4 -46.0 7.5 160 161 B T H >< S+ 0 0 11 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.892 113.7 47.4 -65.5 -49.6 -80.4 -48.3 7.8 161 162 B F T 3< S+ 0 0 26 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.1 -0.017 114.6 46.3 -89.7 34.5 -77.5 -46.0 8.8 162 163 B T T X S+ 0 0 0 -3,-0.8 3,-2.5 -2,-0.1 2,-2.4 0.284 70.2 123.6-145.8 -3.7 -79.4 -44.2 11.5 163 164 B H T < S+ 0 0 95 -3,-0.8 3,-0.1 -4,-0.4 -4,-0.1 -0.419 73.9 49.1 -69.7 79.6 -80.9 -47.1 13.3 164 165 B E T 3 S+ 0 0 63 -2,-2.4 -1,-0.3 1,-0.4 2,-0.2 0.155 93.2 82.8 173.1 -14.6 -79.4 -46.3 16.7 165 166 B Q S < S- 0 0 35 -3,-2.5 -1,-0.4 1,-0.2 5,-0.1 -0.666 98.6 -54.7-106.3 164.2 -80.2 -42.6 17.1 166 167 B N > - 0 0 90 -2,-0.2 4,-2.3 1,-0.2 3,-0.5 -0.043 43.5-140.5 -38.8 118.6 -83.5 -41.0 18.4 167 168 B I H > S+ 0 0 67 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.738 102.7 58.0 -56.0 -24.4 -86.4 -42.2 16.3 168 169 B N H > S+ 0 0 109 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.928 105.1 46.6 -72.4 -46.3 -87.8 -38.7 16.5 169 170 B E H > S+ 0 0 58 -3,-0.5 4,-3.1 1,-0.2 5,-0.2 0.924 109.3 59.1 -59.3 -42.6 -84.7 -37.2 14.9 170 171 B R H X S+ 0 0 7 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.932 106.6 44.3 -49.9 -56.6 -84.9 -40.0 12.3 171 172 B I H X S+ 0 0 49 -4,-1.9 4,-2.7 1,-0.2 5,-0.3 0.926 112.4 53.6 -56.8 -45.5 -88.4 -38.9 11.2 172 173 B K H X S+ 0 0 163 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.953 112.1 43.7 -54.6 -54.2 -87.3 -35.3 11.2 173 174 B L H X S+ 0 0 7 -4,-3.1 4,-1.7 1,-0.2 -2,-0.2 0.909 111.6 53.7 -57.4 -47.2 -84.3 -36.1 8.9 174 175 B M H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 3,-0.3 0.926 111.1 45.7 -55.8 -48.0 -86.3 -38.3 6.6 175 176 B N H X S+ 0 0 35 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.873 107.9 56.0 -66.3 -35.9 -88.9 -35.6 6.0 176 177 B K H X S+ 0 0 55 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.825 110.6 48.6 -64.1 -28.0 -86.3 -33.0 5.4 177 178 B F H X S+ 0 0 0 -4,-1.7 4,-3.3 -3,-0.3 5,-0.3 0.969 107.4 50.7 -72.7 -58.9 -85.0 -35.4 2.7 178 179 B S H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.899 110.2 53.3 -46.4 -45.8 -88.4 -36.0 1.0 179 180 B Q H X S+ 0 0 77 -4,-2.4 4,-3.0 -5,-0.2 5,-0.2 0.983 113.7 40.6 -54.0 -61.7 -88.8 -32.3 0.9 180 181 B I H X S+ 0 0 10 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.908 114.0 52.1 -54.0 -49.4 -85.5 -31.7 -0.8 181 182 B F H >< S+ 0 0 0 -4,-3.3 3,-0.6 1,-0.2 4,-0.2 0.955 115.9 40.9 -53.9 -55.3 -85.7 -34.7 -3.2 182 183 B L H >< S+ 0 0 3 -4,-2.5 3,-1.9 -5,-0.3 4,-0.2 0.894 111.5 55.5 -60.5 -43.5 -89.1 -33.6 -4.4 183 184 B N H >< S+ 0 0 73 -4,-3.0 3,-0.6 -5,-0.3 -1,-0.3 0.770 105.6 54.9 -63.5 -21.9 -88.2 -30.0 -4.5 184 185 B G T << S+ 0 0 7 -4,-1.6 -1,-0.3 -3,-0.6 -2,-0.2 0.480 87.9 79.0 -89.6 -0.8 -85.4 -31.0 -6.8 185 186 B L T < 0 0 18 -3,-1.9 -45,-0.5 -4,-0.2 -1,-0.2 0.502 360.0 360.0 -83.8 -5.2 -87.6 -32.7 -9.3 186 187 B S < 0 0 113 -3,-0.6 -45,-0.0 -4,-0.2 -47,-0.0 -0.965 360.0 360.0-158.7 360.0 -88.7 -29.5 -11.0 187 !* 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 0.0 188 2 D N 0 0 150 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 175.5 -28.4 -18.7 43.3 189 3 D L > + 0 0 52 3,-0.1 4,-2.4 31,-0.0 5,-0.2 0.584 360.0 47.2-128.9 -44.2 -31.8 -19.9 42.3 190 4 D K H > S+ 0 0 76 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.964 119.4 41.7 -64.8 -52.7 -31.6 -20.9 38.7 191 5 D D H > S+ 0 0 90 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.906 110.6 59.3 -60.5 -41.2 -28.4 -22.9 39.3 192 6 D K H > S+ 0 0 81 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.956 107.5 44.6 -50.0 -57.4 -30.0 -24.2 42.5 193 7 D I H X S+ 0 0 0 -4,-2.4 4,-3.7 1,-0.2 5,-0.3 0.965 110.6 55.7 -51.1 -56.8 -32.9 -25.8 40.6 194 8 D L H X S+ 0 0 17 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.888 110.5 45.8 -42.4 -49.3 -30.4 -27.1 38.0 195 9 D G H X S+ 0 0 37 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.946 114.8 43.6 -62.9 -53.3 -28.5 -28.8 40.8 196 10 D V H X S+ 0 0 21 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.967 113.4 53.8 -58.9 -49.9 -31.5 -30.3 42.6 197 11 D A H X S+ 0 0 0 -4,-3.7 4,-3.5 -5,-0.2 5,-0.3 0.941 110.3 46.0 -47.5 -57.8 -33.0 -31.4 39.2 198 12 D K H X S+ 0 0 33 -4,-2.6 4,-2.4 -5,-0.3 5,-0.2 0.915 111.7 52.4 -52.2 -47.9 -29.8 -33.2 38.2 199 13 D E H X S+ 0 0 122 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.905 115.9 40.1 -56.7 -43.0 -29.6 -34.9 41.6 200 14 D L H X>S+ 0 0 11 -4,-2.7 4,-3.0 2,-0.2 5,-0.9 0.883 110.7 55.7 -75.0 -41.8 -33.2 -36.1 41.3 201 15 D F H X5S+ 0 0 0 -4,-3.5 4,-1.5 -5,-0.3 -2,-0.2 0.938 111.2 46.9 -57.1 -42.4 -33.0 -37.0 37.7 202 16 D I H <5S+ 0 0 46 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.922 117.9 41.8 -63.9 -44.7 -30.1 -39.3 38.5 203 17 D K H <5S+ 0 0 149 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.974 133.4 14.4 -69.8 -55.9 -31.8 -40.8 41.5 204 18 D N H <5S- 0 0 26 -4,-3.0 4,-0.3 1,-0.3 377,-0.3 0.659 101.7-121.6 -97.9 -17.6 -35.3 -41.4 40.3 205 19 D G X< - 0 0 1 -4,-1.5 4,-0.9 -5,-0.9 -1,-0.3 -0.399 40.3 -66.7 98.8 177.4 -35.0 -41.0 36.5 206 20 D Y T >4 S+ 0 0 4 77,-0.2 3,-0.6 2,-0.2 -1,-0.1 0.980 126.3 44.0 -71.5 -60.3 -36.9 -38.5 34.3 207 21 D N T 34 S+ 0 0 33 371,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.828 111.9 54.2 -56.9 -35.6 -40.5 -39.6 34.5 208 22 D A T 34 S+ 0 0 26 -4,-0.3 2,-0.5 370,-0.2 -1,-0.2 0.824 93.9 77.7 -71.4 -31.9 -40.5 -40.2 38.2 209 23 D T << - 0 0 0 -4,-0.9 2,-0.4 -3,-0.6 3,-0.0 -0.676 68.6-159.6 -84.1 126.8 -39.2 -36.7 39.2 210 24 D T > - 0 0 72 -2,-0.5 4,-2.2 1,-0.1 3,-0.4 -0.830 29.5-118.9-109.6 146.7 -41.8 -34.0 39.1 211 25 D T H > S+ 0 0 18 -2,-0.4 4,-3.2 1,-0.3 5,-0.1 0.864 115.9 58.1 -44.5 -41.3 -41.3 -30.2 38.8 212 26 D G H > S+ 0 0 16 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.953 104.4 47.5 -55.4 -53.9 -43.0 -30.0 42.2 213 27 D E H > S+ 0 0 58 -3,-0.4 4,-0.9 1,-0.2 -1,-0.2 0.902 114.2 50.7 -54.5 -41.7 -40.5 -32.3 43.9 214 28 D I H >X S+ 0 0 0 -4,-2.2 4,-1.1 2,-0.2 3,-0.8 0.986 112.5 44.1 -58.6 -63.2 -37.8 -30.2 42.3 215 29 D V H >X S+ 0 0 9 -4,-3.2 3,-2.6 1,-0.2 4,-0.8 0.945 113.7 45.9 -46.0 -71.9 -39.1 -26.8 43.4 216 30 D K H 3< S+ 0 0 141 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.645 114.7 50.0 -51.1 -19.7 -40.0 -27.5 47.0 217 31 D L H << S+ 0 0 103 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.617 114.1 44.5 -95.0 -15.1 -36.7 -29.3 47.5 218 32 D S H << S- 0 0 1 -3,-2.6 -2,-0.2 -4,-1.1 -1,-0.1 0.332 117.7-110.4-107.2 3.9 -34.8 -26.4 46.0 219 33 D E S < S+ 0 0 160 -4,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.987 78.3 93.7 62.3 82.5 -36.8 -23.7 47.9 220 34 D S - 0 0 37 -5,-0.1 2,-0.3 -27,-0.0 -1,-0.2 -0.904 68.1 -87.7-170.6-163.0 -38.8 -22.0 45.2 221 35 D S > - 0 0 58 -2,-0.3 4,-1.8 1,-0.2 3,-0.5 -0.980 27.8-116.8-135.6 147.1 -42.1 -22.0 43.4 222 36 D K H >> S+ 0 0 110 -2,-0.3 3,-1.6 1,-0.3 4,-1.4 0.917 115.0 42.8 -39.4 -74.4 -43.6 -23.8 40.4 223 37 D G H 3> S+ 0 0 50 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.787 108.9 61.9 -46.4 -33.3 -44.2 -20.8 38.1 224 38 D N H 3> S+ 0 0 64 -3,-0.5 4,-0.6 1,-0.2 -1,-0.3 0.908 101.1 51.1 -62.0 -42.2 -40.8 -19.5 39.2 225 39 D L H XX S+ 0 0 1 -4,-1.8 4,-2.3 -3,-1.6 3,-0.8 0.868 110.0 49.9 -62.6 -36.6 -39.1 -22.6 37.7 226 40 D Y H 3X S+ 0 0 101 -4,-1.4 4,-2.1 1,-0.2 -1,-0.3 0.818 101.3 65.1 -69.2 -30.3 -41.1 -21.9 34.5 227 41 D Y H 3< S+ 0 0 191 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.696 116.4 26.8 -64.2 -20.6 -39.8 -18.3 34.8 228 42 D H H << S+ 0 0 78 -3,-0.8 -2,-0.2 -4,-0.6 -1,-0.2 0.646 140.5 18.0-114.9 -25.3 -36.3 -19.6 34.2 229 43 D F H < S- 0 0 0 -4,-2.3 2,-2.5 -5,-0.2 -3,-0.2 0.406 79.1-147.5-129.1 -1.0 -36.7 -22.8 32.2 230 44 D K S < S+ 0 0 140 -4,-2.1 2,-0.3 -5,-0.3 -1,-0.1 -0.404 75.3 20.6 69.2 -75.4 -40.2 -22.6 30.7 231 45 D T S > S- 0 0 56 -2,-2.5 4,-1.8 1,-0.1 5,-0.1 -0.788 76.6-116.6-122.5 166.0 -40.9 -26.3 30.8 232 46 D K H >> S+ 0 0 40 -2,-0.3 4,-2.3 1,-0.2 3,-0.5 0.979 115.7 52.5 -64.9 -55.1 -39.6 -29.4 32.6 233 47 D E H 3> S+ 0 0 24 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.791 108.3 53.9 -52.7 -26.1 -38.3 -31.1 29.5 234 48 D N H 3> S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.910 104.0 53.7 -75.2 -39.6 -36.5 -27.8 28.8 235 49 D L H X S+ 0 0 44 -4,-2.3 4,-2.4 2,-0.2 3,-0.6 0.932 109.2 52.1 -72.7 -43.4 -30.4 -27.5 29.6 239 53 D I H 3X S+ 0 0 5 -4,-2.6 4,-2.6 1,-0.3 -2,-0.2 0.908 106.9 55.2 -56.6 -41.8 -29.0 -29.9 32.2 240 54 D L H 3X S+ 0 0 9 -4,-2.8 4,-1.8 1,-0.2 -1,-0.3 0.809 106.8 49.5 -63.4 -30.3 -27.9 -32.1 29.3 241 55 D N H < S+ 0 0 130 -4,-2.5 3,-0.7 1,-0.2 4,-0.2 0.905 121.1 44.8 -66.6 -42.3 -7.7 -31.2 29.7 254 68 D E H >< S+ 0 0 76 -4,-1.9 3,-0.6 -5,-0.4 -1,-0.2 0.621 95.5 74.4 -81.7 -10.9 -7.2 -34.8 30.7 255 69 D Q G >< S+ 0 0 33 -4,-1.7 3,-1.4 1,-0.2 -1,-0.2 0.645 77.8 78.1 -77.3 -10.0 -6.4 -36.2 27.2 256 70 D I G < S+ 0 0 126 -3,-0.7 -1,-0.2 -4,-0.3 -2,-0.1 0.894 79.6 68.0 -63.0 -39.5 -2.9 -34.7 27.3 257 71 D K G < S+ 0 0 188 -3,-0.6 2,-0.5 -4,-0.2 -1,-0.3 0.474 94.2 70.5 -59.9 -2.1 -1.6 -37.5 29.6 258 72 D A < + 0 0 5 -3,-1.4 -1,-0.1 1,-0.2 6,-0.0 -0.976 58.1 178.3-123.3 118.5 -2.1 -39.9 26.6 259 73 D K + 0 0 167 -2,-0.5 -1,-0.2 4,-0.0 -2,-0.0 0.973 65.2 51.0 -80.8 -67.0 0.2 -39.5 23.6 260 74 D T S > S- 0 0 49 1,-0.1 4,-1.5 4,-0.0 60,-0.1 -0.185 83.8-123.1 -67.1 165.3 -0.9 -42.2 21.2 261 75 D N H > S+ 0 0 8 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.739 111.2 65.1 -82.4 -23.0 -4.5 -42.5 20.2 262 76 D R H > S+ 0 0 100 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.925 106.1 43.3 -62.9 -41.7 -4.6 -46.1 21.3 263 77 D E H > S+ 0 0 61 1,-0.2 4,-4.0 2,-0.2 5,-0.2 0.928 109.0 59.2 -66.7 -43.6 -4.0 -44.7 24.9 264 78 D K H X S+ 0 0 33 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.874 107.3 46.3 -49.1 -45.7 -6.6 -42.0 24.2 265 79 D F H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.985 114.8 45.8 -61.6 -62.2 -9.2 -44.7 23.6 266 80 D Y H X S+ 0 0 39 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.917 115.6 48.0 -45.3 -52.6 -8.2 -46.7 26.7 267 81 D L H X S+ 0 0 42 -4,-4.0 4,-2.7 1,-0.2 3,-0.3 0.915 110.9 49.3 -60.1 -47.1 -8.1 -43.5 28.7 268 82 D Y H X S+ 0 0 4 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.942 109.5 50.1 -58.8 -52.6 -11.5 -42.2 27.5 269 83 D N H X S+ 0 0 0 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.785 114.1 48.8 -57.3 -28.1 -13.4 -45.4 28.2 270 84 D E H >X S+ 0 0 55 -4,-1.3 4,-1.0 -5,-0.3 3,-0.7 0.897 107.0 52.4 -78.2 -45.6 -11.8 -45.4 31.6 271 85 D L H >X S+ 0 0 19 -4,-2.7 4,-3.0 1,-0.2 3,-1.0 0.914 98.4 67.0 -58.1 -42.0 -12.7 -41.8 32.5 272 86 D S H 3< S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.852 99.4 51.5 -43.8 -46.1 -16.3 -42.5 31.6 273 87 D L H << S+ 0 0 13 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.837 119.7 33.7 -62.8 -36.8 -16.6 -44.8 34.6 274 88 D T H << S+ 0 0 80 -4,-1.0 -2,-0.2 -3,-1.0 -1,-0.2 0.677 91.9 105.7 -98.8 -17.4 -15.2 -42.3 37.0 275 89 D T < - 0 0 7 -4,-3.0 -28,-0.0 -5,-0.2 4,-0.0 -0.356 59.4-147.5 -68.3 138.6 -16.5 -39.0 35.6 276 90 D E S S+ 0 0 104 -2,-0.1 2,-0.4 3,-0.1 -1,-0.1 0.312 70.9 93.7 -87.6 15.0 -19.3 -37.3 37.4 277 91 D Y S S- 0 0 50 -5,-0.1 2,-2.1 -31,-0.1 -2,-0.1 -0.885 95.9 -30.6-115.0 139.6 -20.6 -35.9 34.1 278 92 D Y S > S+ 0 0 26 -2,-0.4 3,-3.3 1,-0.2 4,-0.2 -0.372 115.9 74.3 67.0 -74.8 -23.3 -37.1 31.7 279 93 D Y G > S+ 0 0 5 -2,-2.1 3,-1.1 1,-0.3 4,-0.2 0.717 88.2 62.6 -44.4 -30.8 -23.0 -40.9 32.2 280 94 D P G 3 S+ 0 0 30 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.600 100.2 55.0 -75.8 -5.6 -24.7 -40.9 35.5 281 95 D L G <> S+ 0 0 3 -3,-3.3 4,-3.5 1,-0.1 3,-0.4 0.321 71.5 108.7-106.2 7.4 -27.9 -39.6 33.9 282 96 D Q H <> S+ 0 0 2 -3,-1.1 4,-3.4 -4,-0.2 5,-0.2 0.893 74.0 57.7 -49.8 -49.7 -28.3 -42.3 31.3 283 97 D N H > S+ 0 0 13 -4,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.923 116.0 36.6 -48.3 -49.5 -31.3 -43.9 33.1 284 98 D A H > S+ 0 0 0 -3,-0.4 4,-3.3 2,-0.2 5,-0.3 0.953 114.7 54.6 -70.0 -50.3 -33.1 -40.6 32.8 285 99 D I H X S+ 0 0 23 -4,-3.5 4,-0.8 1,-0.2 -2,-0.2 0.842 109.4 50.4 -52.5 -34.6 -31.6 -39.7 29.4 286 100 D I H >X S+ 0 0 26 -4,-3.4 4,-1.9 -5,-0.3 3,-1.1 0.982 113.2 43.7 -66.7 -56.8 -33.0 -43.1 28.2 287 101 D E H 3< S+ 0 0 4 -4,-2.0 4,-0.5 1,-0.3 -2,-0.2 0.888 110.6 55.5 -54.0 -45.6 -36.5 -42.5 29.6 288 102 D F H 3X S+ 0 0 0 -4,-3.3 4,-1.2 1,-0.2 -1,-0.3 0.739 107.8 51.4 -63.0 -22.5 -36.6 -38.9 28.3 289 103 D Y H S- 0 0 56 -4,-0.2 4,-1.3 1,-0.1 3,-0.1 -0.551 77.6-148.1 -73.7 132.9 -41.8 -34.8 18.4 296 110 D N H > S+ 0 0 110 -2,-0.3 4,-1.5 1,-0.2 -1,-0.1 0.840 88.1 69.8 -70.6 -34.7 -39.3 -33.4 15.9 297 111 D S H > S+ 0 0 69 1,-0.2 4,-0.9 2,-0.2 3,-0.5 0.928 108.0 34.7 -46.7 -57.8 -38.5 -30.3 17.9 298 112 D I H > S+ 0 0 11 -6,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.868 108.9 64.5 -68.7 -39.9 -36.6 -32.2 20.7 299 113 D N H X S+ 0 0 39 -4,-1.3 4,-2.2 -7,-0.5 5,-0.2 0.782 98.4 59.0 -56.9 -26.4 -35.1 -34.8 18.4 300 114 D E H X S+ 0 0 116 -4,-1.5 4,-1.6 -3,-0.5 -1,-0.2 0.982 110.7 37.3 -65.0 -57.6 -33.2 -32.0 16.8 301 115 D K H X S+ 0 0 91 -4,-0.9 4,-2.2 2,-0.2 -2,-0.2 0.849 116.0 58.9 -61.4 -37.8 -31.4 -30.9 19.9 302 116 D M H X S+ 0 0 15 -4,-2.7 4,-2.4 2,-0.2 3,-0.5 0.984 108.0 39.4 -55.9 -68.5 -31.1 -34.5 21.0 303 117 D N H X S+ 0 0 47 -4,-2.2 4,-2.2 1,-0.3 -1,-0.2 0.808 110.0 64.4 -55.6 -28.8 -29.2 -35.8 18.0 304 118 D K H X S+ 0 0 128 -4,-1.6 4,-0.9 -5,-0.2 3,-0.3 0.965 108.9 37.8 -58.7 -51.9 -27.2 -32.6 18.1 305 119 D L H X S+ 0 0 17 -4,-2.2 4,-2.5 -3,-0.5 3,-0.2 0.836 111.1 63.5 -67.2 -32.0 -25.9 -33.6 21.5 306 120 D E H X S+ 0 0 39 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.861 100.5 50.0 -60.9 -39.1 -25.7 -37.2 20.3 307 121 D N H X S+ 0 0 99 -4,-2.2 4,-2.4 -3,-0.3 -1,-0.2 0.792 110.3 50.3 -72.1 -27.9 -23.1 -36.4 17.7 308 122 D K H X S+ 0 0 96 -4,-0.9 4,-1.2 -3,-0.2 -2,-0.2 0.939 106.4 54.6 -72.2 -47.4 -20.9 -34.5 20.2 309 123 D Y H < S+ 0 0 11 -4,-2.5 4,-0.2 1,-0.2 -1,-0.2 0.726 118.8 36.3 -56.5 -22.9 -21.1 -37.5 22.6 310 124 D I H >X S+ 0 0 12 -4,-0.8 4,-2.1 -5,-0.2 3,-1.2 0.724 98.1 79.2 -99.9 -32.9 -19.8 -39.6 19.6 311 125 D D H 3X S+ 0 0 79 -4,-2.4 4,-3.0 1,-0.3 5,-0.2 0.851 85.6 63.6 -40.8 -47.6 -17.4 -37.0 18.1 312 126 D A H 3X S+ 0 0 5 -4,-1.2 4,-1.6 1,-0.3 -1,-0.3 0.887 107.1 41.4 -47.1 -50.1 -14.9 -37.8 20.8 313 127 D Y H <> S+ 0 0 2 -3,-1.2 4,-2.4 -4,-0.2 5,-0.3 0.899 111.2 57.6 -68.5 -39.4 -14.5 -41.3 19.5 314 128 D H H X S+ 0 0 46 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.921 105.5 50.7 -56.8 -45.2 -14.6 -40.1 15.9 315 129 D V H X S+ 0 0 56 -4,-3.0 4,-2.9 2,-0.2 5,-0.2 0.944 111.4 46.9 -55.2 -55.0 -11.6 -37.9 16.5 316 130 D I H X S+ 0 0 4 -4,-1.6 4,-3.2 1,-0.2 5,-0.2 0.943 114.9 43.9 -53.2 -59.3 -9.5 -40.6 18.1 317 131 D F H X S+ 0 0 0 -4,-2.4 4,-1.2 2,-0.2 11,-0.2 0.844 113.2 53.7 -59.8 -35.1 -10.2 -43.3 15.4 318 132 D K H >X S+ 0 0 113 -4,-2.2 4,-2.0 -5,-0.3 3,-0.9 0.978 112.4 42.0 -63.8 -55.5 -9.7 -40.7 12.7 319 133 D E H 3X S+ 0 0 71 -4,-2.9 4,-3.5 1,-0.3 -2,-0.2 0.919 109.3 59.5 -56.7 -44.8 -6.3 -39.7 14.0 320 134 D G H 3<>S+ 0 0 0 -4,-3.2 5,-3.9 1,-0.2 6,-1.4 0.813 105.8 50.3 -54.2 -29.9 -5.5 -43.3 14.6 321 135 D N H X<5S+ 0 0 48 -4,-1.2 3,-0.9 -3,-0.9 -1,-0.2 0.926 115.9 40.0 -73.8 -46.0 -6.1 -43.8 10.8 322 136 D L H 3<5S+ 0 0 129 -4,-2.0 2,-0.6 1,-0.3 -2,-0.2 0.982 113.6 51.9 -66.2 -58.1 -3.8 -40.9 9.9 323 137 D N T 3<5S- 0 0 111 -4,-3.5 -1,-0.3 1,-0.1 -2,-0.1 0.145 116.5-116.0 -68.0 24.9 -1.1 -41.7 12.5 324 138 D G T < 5S+ 0 0 65 -3,-0.9 -3,-0.2 -2,-0.6 -4,-0.1 0.831 76.8 130.2 40.0 53.8 -1.1 -45.2 11.1 325 139 D E S + 0 0 86 1,-0.2 4,-2.2 2,-0.1 3,-0.5 -0.662 68.0 167.8 -97.2 83.1 -16.3 -46.6 8.3 331 145 D V H > S+ 0 0 13 -2,-1.2 4,-3.3 -3,-0.4 5,-0.3 0.915 74.7 59.5 -59.3 -45.4 -15.1 -44.4 11.2 332 146 D N H > S+ 0 0 100 1,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.848 109.3 45.9 -53.5 -35.5 -18.6 -43.0 11.8 333 147 D A H > S+ 0 0 11 -3,-0.5 4,-3.0 2,-0.2 5,-0.3 0.970 112.2 47.0 -72.5 -56.2 -19.8 -46.6 12.4 334 148 D V H X S+ 0 0 6 -4,-2.2 4,-3.8 1,-0.2 5,-0.2 0.918 111.2 54.2 -52.9 -42.7 -17.0 -47.7 14.6 335 149 D S H X S+ 0 0 0 -4,-3.3 4,-3.1 1,-0.2 -1,-0.2 0.951 110.4 45.5 -57.0 -48.3 -17.4 -44.5 16.6 336 150 D K H X S+ 0 0 51 -4,-1.7 4,-2.4 -5,-0.3 5,-0.3 0.924 115.6 46.3 -60.2 -47.1 -21.0 -45.2 17.2 337 151 D I H X S+ 0 0 2 -4,-3.0 4,-2.7 2,-0.2 5,-0.3 0.963 113.0 50.7 -60.6 -50.3 -20.4 -48.8 18.1 338 152 D A H X S+ 0 0 0 -4,-3.8 4,-2.6 -5,-0.3 5,-0.2 0.950 111.2 48.0 -50.9 -58.7 -17.6 -47.8 20.4 339 153 D A H X S+ 0 0 0 -4,-3.1 4,-3.2 1,-0.2 5,-0.3 0.918 115.3 42.3 -49.3 -56.9 -19.7 -45.2 22.2 340 154 D N H X S+ 0 0 5 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.861 112.1 54.1 -64.3 -35.9 -22.7 -47.4 22.8 341 155 D A H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.2 0.964 114.2 42.2 -62.9 -48.0 -20.7 -50.4 23.8 342 156 D V H X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.3 3,-0.3 0.968 113.7 49.5 -61.2 -56.3 -18.8 -48.3 26.4 343 157 D N H X S+ 0 0 0 -4,-3.2 4,-2.7 1,-0.3 -1,-0.2 0.880 110.3 55.2 -50.3 -37.1 -21.9 -46.5 27.6 344 158 D G H X S+ 0 0 0 -4,-2.2 4,-1.1 -5,-0.3 -1,-0.3 0.930 109.3 44.7 -61.9 -45.8 -23.4 -50.0 27.8 345 159 D I H < S+ 0 0 4 -4,-2.2 -2,-0.2 -3,-0.3 -1,-0.2 0.869 114.3 50.6 -66.4 -36.9 -20.5 -51.2 30.0 346 160 D V H >< S+ 0 0 6 -4,-2.8 3,-0.6 1,-0.2 -2,-0.2 0.929 116.0 36.5 -68.5 -48.0 -20.7 -48.1 32.2 347 161 D T H 3< S+ 0 0 1 -4,-2.7 3,-0.3 1,-0.2 -1,-0.2 0.543 110.4 59.0 -89.7 -3.1 -24.4 -48.1 33.0 348 162 D F T 3< S+ 0 0 11 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.1 -0.064 107.5 44.6-112.8 30.6 -25.1 -51.8 33.3 349 163 D T < + 0 0 3 -3,-0.6 -1,-0.2 3,-0.1 -2,-0.1 0.020 69.0 137.2-154.0 20.0 -22.6 -52.5 36.1 350 164 D H S S+ 0 0 75 -3,-0.3 -2,-0.1 1,-0.2 4,-0.1 0.780 71.7 49.4 -41.6 -38.1 -23.5 -49.5 38.2 351 165 D E S S+ 0 0 38 2,-0.1 -1,-0.2 3,-0.0 3,-0.2 0.963 89.8 86.1 -72.4 -59.2 -23.4 -51.6 41.4 352 166 D Q S S- 0 0 56 1,-0.2 2,-0.3 -3,-0.1 -3,-0.1 0.347 92.0 -60.2 -45.8 172.2 -20.1 -53.6 41.4 353 167 D N >> - 0 0 90 1,-0.2 4,-2.0 4,-0.1 3,-1.8 -0.401 41.0-136.1 -60.3 116.3 -16.6 -52.7 42.7 354 168 D I H 3> S+ 0 0 82 -2,-0.3 4,-2.0 1,-0.3 -1,-0.2 0.740 104.7 60.6 -45.5 -27.3 -15.3 -49.6 40.8 355 169 D N H 3> S+ 0 0 110 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.890 105.8 44.4 -69.8 -40.7 -12.0 -51.5 40.6 356 170 D E H <> S+ 0 0 83 -3,-1.8 4,-3.6 2,-0.2 5,-0.3 0.869 108.5 57.6 -71.3 -37.6 -13.5 -54.3 38.6 357 171 D R H X S+ 0 0 13 -4,-2.0 4,-3.2 1,-0.2 -2,-0.2 0.972 110.5 43.7 -56.6 -51.4 -15.5 -51.9 36.4 358 172 D I H X S+ 0 0 44 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.870 114.5 50.8 -61.4 -36.5 -12.2 -50.3 35.4 359 173 D K H X S+ 0 0 105 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.931 113.6 43.3 -67.4 -45.4 -10.6 -53.7 35.0 360 174 D L H X S+ 0 0 11 -4,-3.6 4,-2.3 2,-0.2 -2,-0.2 0.904 111.6 55.8 -66.4 -40.8 -13.4 -54.9 32.8 361 175 D M H X S+ 0 0 0 -4,-3.2 4,-3.0 -5,-0.3 5,-0.2 0.954 109.3 45.8 -56.2 -51.1 -13.4 -51.7 30.9 362 176 D N H X S+ 0 0 36 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.879 107.5 56.1 -62.0 -38.5 -9.8 -52.0 30.0 363 177 D K H X S+ 0 0 48 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.935 111.5 47.0 -58.3 -42.0 -10.1 -55.6 29.0 364 178 D F H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.981 106.6 54.1 -61.2 -60.9 -12.7 -54.4 26.6 365 179 D S H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.830 111.4 50.1 -45.2 -34.9 -10.7 -51.5 25.3 366 180 D Q H X S+ 0 0 67 -4,-2.2 4,-2.7 -5,-0.2 5,-0.3 0.999 111.4 43.6 -67.1 -67.6 -8.0 -54.1 24.5 367 181 D I H < S+ 0 0 3 -4,-2.2 4,-0.3 1,-0.2 -2,-0.2 0.878 113.1 54.1 -40.6 -53.7 -10.2 -56.6 22.7 368 182 D F H >X S+ 0 0 1 -4,-2.9 3,-1.6 1,-0.2 4,-0.8 0.941 112.5 40.8 -51.6 -57.3 -11.9 -53.9 20.7 369 183 D L H >X S+ 0 0 11 -4,-1.7 3,-1.4 1,-0.3 4,-0.6 0.936 108.6 58.7 -59.6 -49.3 -8.7 -52.3 19.3 370 184 D N H 3< S+ 0 0 91 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.549 106.5 54.9 -59.4 -0.1 -7.0 -55.6 18.7 371 185 D G H <4 S+ 0 0 1 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.719 91.6 72.7-102.5 -26.4 -10.0 -56.2 16.5 372 186 D L H << 0 0 20 -3,-1.4 -2,-0.1 -4,-0.8 -3,-0.1 0.955 360.0 360.0 -55.6 -68.3 -9.8 -53.1 14.3 373 187 D S < 0 0 101 -4,-0.6 -1,-0.2 -48,-0.2 -3,-0.1 0.666 360.0 360.0 -87.9 360.0 -6.9 -53.6 11.9 374 !* 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 0.0 375 2 A N > 0 0 150 0, 0.0 4,-3.6 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -39.8 -43.7 -49.9 15.8 376 3 A L H > + 0 0 53 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.894 360.0 45.8 -63.1 -34.3 -44.7 -53.2 17.4 377 4 A K H > S+ 0 0 84 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.935 112.1 48.6 -70.3 -47.5 -48.0 -51.4 17.7 378 5 A D H > S+ 0 0 106 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.887 110.2 53.4 -59.0 -37.8 -47.8 -50.2 14.1 379 6 A K H X S+ 0 0 96 -4,-3.6 4,-3.0 2,-0.2 5,-0.3 0.899 106.9 51.3 -63.9 -42.6 -46.9 -53.7 13.0 380 7 A I H X S+ 0 0 0 -4,-1.8 4,-3.3 2,-0.2 5,-0.3 0.942 111.1 47.8 -60.6 -46.8 -50.0 -55.1 14.7 381 8 A L H X S+ 0 0 23 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.957 114.2 47.4 -58.2 -50.1 -52.2 -52.6 13.0 382 9 A G H X S+ 0 0 40 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.892 117.2 40.5 -58.7 -43.7 -50.6 -53.4 9.7 383 10 A V H X S+ 0 0 32 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.950 113.6 53.2 -72.0 -47.4 -50.8 -57.1 10.0 384 11 A A H X S+ 0 0 0 -4,-3.3 4,-2.7 -5,-0.3 5,-0.3 0.946 106.2 55.0 -51.8 -51.5 -54.2 -57.1 11.5 385 12 A K H X S+ 0 0 41 -4,-2.9 4,-2.7 -5,-0.3 5,-0.2 0.933 107.8 47.8 -49.2 -52.5 -55.4 -55.1 8.6 386 13 A E H X S+ 0 0 115 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.911 111.3 51.9 -58.0 -41.3 -54.2 -57.6 6.0 387 14 A L H X S+ 0 0 20 -4,-2.5 4,-3.5 2,-0.2 5,-0.3 0.935 109.9 47.3 -62.0 -44.4 -55.8 -60.4 8.0 388 15 A F H X S+ 0 0 2 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.917 113.4 49.8 -61.6 -41.5 -59.2 -58.7 8.1 389 16 A I H < S+ 0 0 46 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.879 116.7 42.3 -62.8 -38.0 -58.8 -58.0 4.4 390 17 A K H < S+ 0 0 161 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.882 135.1 11.8 -79.4 -38.4 -57.9 -61.7 3.8 391 18 A N H X S- 0 0 76 -4,-3.5 4,-0.6 1,-0.3 -3,-0.2 0.294 100.9-115.9-125.7 12.8 -60.5 -63.4 6.0 392 19 A G H X - 0 0 7 -4,-2.5 4,-0.7 -5,-0.3 -1,-0.3 -0.073 43.0 -68.9 76.7 174.6 -63.0 -60.8 7.1 393 20 A Y H 4 S+ 0 0 0 77,-0.2 3,-0.3 2,-0.2 -1,-0.1 0.927 126.3 45.6 -71.2 -49.5 -63.6 -59.6 10.7 394 21 A N H 4 S+ 0 0 65 1,-0.2 -1,-0.1 -6,-0.1 -2,-0.1 0.917 109.6 52.3 -63.4 -47.9 -65.1 -62.6 12.3 395 22 A A H < S+ 0 0 61 -4,-0.6 2,-0.3 -7,-0.1 -1,-0.2 0.736 92.2 91.9 -63.0 -24.7 -62.7 -65.2 11.0 396 23 A T < - 0 0 0 -4,-0.7 2,-0.3 -3,-0.3 -8,-0.0 -0.542 61.5-161.0 -76.9 134.2 -59.6 -63.3 12.2 397 24 A T > - 0 0 66 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.835 29.4-127.8-114.4 154.5 -58.3 -64.1 15.7 398 25 A T H > S+ 0 0 54 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.783 110.4 66.7 -67.5 -22.7 -56.1 -62.1 17.9 399 26 A G H > S+ 0 0 37 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.977 102.2 43.6 -58.9 -56.1 -54.0 -65.2 18.0 400 27 A E H > S+ 0 0 71 1,-0.2 4,-3.8 2,-0.2 5,-0.3 0.947 114.0 50.8 -52.1 -53.5 -53.1 -64.9 14.4 401 28 A I H X S+ 0 0 0 -4,-1.9 4,-1.5 2,-0.2 6,-0.2 0.912 114.9 44.1 -51.7 -48.6 -52.5 -61.2 14.8 402 29 A V H ><>S+ 0 0 14 -4,-3.0 5,-2.1 2,-0.2 3,-0.8 0.994 117.8 42.0 -60.8 -64.7 -50.3 -61.8 17.7 403 30 A K H ><5S+ 0 0 154 -4,-3.1 3,-0.7 1,-0.2 -2,-0.2 0.856 117.4 48.7 -52.0 -40.7 -48.4 -64.8 16.3 404 31 A L H 3<5S+ 0 0 104 -4,-3.8 -1,-0.2 -5,-0.3 -2,-0.2 0.717 113.5 43.6 -75.8 -22.9 -48.0 -63.1 12.8 405 32 A S T <<5S- 0 0 1 -4,-1.5 -1,-0.2 -3,-0.8 -2,-0.2 0.311 110.0-121.7-103.2 7.9 -46.8 -59.7 14.0 406 33 A E T < 5S+ 0 0 129 -3,-0.7 -3,-0.2 -4,-0.5 2,-0.1 0.860 74.1 117.9 56.0 40.4 -44.4 -61.5 16.4 407 34 A S < - 0 0 9 -5,-2.1 2,-0.3 -6,-0.2 -1,-0.2 -0.302 60.2-108.0-113.8-157.5 -46.0 -59.7 19.4 408 35 A S > - 0 0 23 -2,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.959 20.3-114.3-140.2 156.5 -47.8 -61.1 22.4 409 36 A K H > S+ 0 0 165 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.865 118.5 55.3 -54.5 -36.8 -51.3 -61.2 23.8 410 37 A G H > S+ 0 0 19 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.935 109.1 43.4 -64.8 -47.4 -50.1 -59.0 26.6 411 38 A N H > S+ 0 0 2 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.883 114.8 51.0 -67.9 -33.6 -48.8 -56.3 24.3 412 39 A L H X>S+ 0 0 10 -4,-2.7 4,-3.0 1,-0.2 5,-0.6 0.941 110.3 48.3 -66.0 -47.5 -51.9 -56.5 22.1 413 40 A Y H X5S+ 0 0 23 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.834 110.2 53.5 -60.6 -35.8 -54.2 -56.2 25.1 414 41 A Y H <5S+ 0 0 34 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.886 115.7 38.4 -69.9 -35.8 -52.2 -53.3 26.3 415 42 A H H <5S+ 0 0 45 -4,-1.8 -2,-0.2 -5,-0.1 -1,-0.2 0.832 140.7 3.0 -84.1 -33.3 -52.5 -51.5 23.0 416 43 A F H <5S- 0 0 1 -4,-3.0 2,-3.7 -5,-0.1 5,-0.3 0.441 71.0-150.8-134.5 -1.0 -56.1 -52.3 22.1 417 44 A K S < S- 0 0 52 -2,-3.7 4,-2.5 1,-0.1 5,-0.2 -0.870 77.3-114.0-132.1 165.2 -60.1 -56.2 22.4 419 46 A K H > S+ 0 0 37 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.904 116.7 59.0 -61.0 -41.1 -60.4 -57.2 18.8 420 47 A E H > S+ 0 0 46 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.915 110.1 42.2 -50.6 -50.6 -63.3 -54.8 18.4 421 48 A N H > S+ 0 0 52 -5,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.900 110.2 54.9 -66.2 -46.0 -61.1 -51.9 19.5 422 49 A L H X S+ 0 0 1 -4,-2.5 4,-1.9 -6,-0.2 3,-0.4 0.947 110.7 47.9 -53.3 -48.6 -58.2 -52.9 17.4 423 50 A F H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.914 107.1 56.1 -58.9 -44.4 -60.5 -52.9 14.4 424 51 A L H X S+ 0 0 9 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.828 106.6 50.0 -57.4 -35.5 -61.9 -49.5 15.4 425 52 A E H X S+ 0 0 71 -4,-2.0 4,-2.6 -3,-0.4 -1,-0.2 0.893 107.8 52.2 -72.0 -41.6 -58.4 -48.0 15.3 426 53 A I H X S+ 0 0 4 -4,-1.9 4,-2.9 1,-0.2 5,-0.2 0.928 109.7 51.0 -58.4 -43.1 -57.7 -49.5 11.9 427 54 A L H X S+ 0 0 18 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.855 108.6 52.2 -61.9 -34.9 -60.9 -47.9 10.8 428 55 A N H X S+ 0 0 56 -4,-1.4 4,-1.6 -5,-0.2 -1,-0.2 0.898 110.0 47.4 -68.6 -40.8 -59.7 -44.6 12.3 429 56 A I H X S+ 0 0 79 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.936 112.0 48.7 -66.5 -44.5 -56.5 -44.8 10.4 430 57 A Q H X S+ 0 0 23 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.898 106.5 59.7 -60.1 -38.8 -58.3 -45.7 7.1 431 58 A E H X S+ 0 0 23 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.903 105.6 47.1 -54.9 -43.9 -60.6 -42.8 7.8 432 59 A S H X S+ 0 0 55 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.815 108.4 54.2 -71.7 -30.3 -57.6 -40.4 7.9 433 60 A K H X S+ 0 0 103 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.956 110.3 48.3 -66.3 -46.3 -56.2 -41.8 4.7 434 61 A W H X S+ 0 0 40 -4,-2.9 4,-3.0 1,-0.2 5,-0.2 0.966 110.6 49.6 -56.0 -56.4 -59.5 -41.2 3.1 435 62 A Q H X S+ 0 0 82 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.894 112.7 48.8 -50.0 -42.7 -59.7 -37.6 4.4 436 63 A E H X S+ 0 0 126 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.896 110.0 50.0 -66.4 -39.6 -56.1 -37.1 3.1 437 64 A Q H >X S+ 0 0 62 -4,-2.8 4,-3.1 1,-0.2 3,-0.8 0.951 110.7 51.4 -62.5 -46.4 -57.0 -38.5 -0.4 438 65 A W H 3X S+ 0 0 19 -4,-3.0 4,-2.8 1,-0.3 -2,-0.2 0.898 102.8 58.6 -54.3 -47.0 -60.0 -36.2 -0.5 439 66 A K H 3< S+ 0 0 163 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.814 115.5 36.3 -54.0 -33.3 -57.9 -33.2 0.3 440 67 A K H X< S+ 0 0 150 -4,-1.1 3,-1.1 -3,-0.8 -2,-0.2 0.865 115.6 52.7 -88.9 -41.2 -55.8 -33.9 -2.7 441 68 A E H >< S+ 0 0 44 -4,-3.1 3,-1.9 1,-0.2 -2,-0.2 0.815 92.9 71.7 -66.5 -32.2 -58.6 -35.1 -5.0 442 69 A Q G >< S+ 0 0 55 -4,-2.8 3,-1.3 1,-0.3 -1,-0.2 0.495 74.2 84.5 -66.7 -0.9 -60.9 -32.1 -4.6 443 70 A I G < S+ 0 0 146 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.776 84.1 61.0 -69.0 -24.2 -58.5 -30.0 -6.6 444 71 A K G < S+ 0 0 136 -3,-1.9 2,-0.6 1,-0.2 -1,-0.3 0.557 97.9 65.9 -78.3 -8.9 -60.4 -31.4 -9.6 445 72 A A < + 0 0 5 -3,-1.3 -1,-0.2 1,-0.2 6,-0.1 -0.914 60.7 178.5-119.8 104.8 -63.6 -29.8 -8.2 446 73 A K + 0 0 175 -2,-0.6 -1,-0.2 4,-0.1 2,-0.1 0.990 63.7 43.1 -68.0 -66.1 -63.6 -26.0 -8.3 447 74 A T S > S- 0 0 39 1,-0.1 4,-2.1 65,-0.0 3,-0.1 -0.342 86.9-113.1 -79.9 165.1 -67.0 -24.9 -6.9 448 75 A N H > S+ 0 0 12 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.790 117.2 57.5 -68.9 -29.4 -68.8 -26.5 -4.0 449 76 A R H > S+ 0 0 75 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.868 109.1 47.4 -67.9 -34.4 -71.5 -27.9 -6.2 450 77 A E H > S+ 0 0 81 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.908 106.8 56.1 -71.3 -41.8 -68.7 -29.7 -8.1 451 78 A K H X S+ 0 0 35 -4,-2.1 4,-3.5 1,-0.2 5,-0.3 0.931 106.3 51.4 -54.4 -47.7 -67.2 -30.9 -4.8 452 79 A F H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.902 110.3 49.2 -56.5 -44.3 -70.5 -32.6 -3.9 453 80 A Y H X S+ 0 0 52 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.917 116.1 42.6 -62.6 -42.5 -70.6 -34.3 -7.3 454 81 A L H X S+ 0 0 22 -4,-2.6 4,-3.1 2,-0.2 -2,-0.2 0.875 109.4 54.2 -73.9 -41.8 -67.0 -35.5 -6.9 455 82 A Y H X S+ 0 0 3 -4,-3.5 4,-2.2 -5,-0.2 -1,-0.2 0.919 112.7 44.7 -61.8 -41.4 -67.2 -36.6 -3.3 456 83 A N H X S+ 0 0 0 -4,-1.8 4,-2.1 -5,-0.3 -1,-0.2 0.936 112.0 51.7 -67.0 -46.5 -70.2 -38.8 -4.0 457 84 A E H X S+ 0 0 49 -4,-1.8 4,-2.4 -5,-0.2 3,-0.3 0.973 110.9 50.1 -50.9 -56.6 -68.6 -40.2 -7.2 458 85 A L H X S+ 0 0 14 -4,-3.1 4,-2.9 1,-0.2 5,-0.4 0.879 106.6 53.1 -47.5 -52.5 -65.5 -41.0 -5.2 459 86 A S H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.902 111.1 47.9 -52.5 -47.0 -67.4 -42.9 -2.4 460 87 A L H X S+ 0 0 9 -4,-2.1 4,-1.3 -3,-0.3 -2,-0.2 0.960 117.4 39.5 -61.4 -54.1 -69.1 -45.0 -4.9 461 88 A T H >X S+ 0 0 42 -4,-2.4 3,-0.9 2,-0.2 4,-0.8 0.979 115.5 48.1 -66.2 -55.5 -66.0 -46.0 -6.9 462 89 A T H >X S+ 0 0 17 -4,-2.9 3,-1.3 1,-0.3 4,-0.7 0.915 110.6 52.6 -53.2 -41.6 -63.5 -46.4 -4.0 463 90 A E H >< S+ 0 0 44 -4,-1.9 3,-0.7 -5,-0.4 -1,-0.3 0.841 94.8 72.1 -65.2 -26.9 -66.0 -48.6 -2.1 464 91 A Y H << S+ 0 0 121 -4,-1.3 -1,-0.3 -3,-0.9 -2,-0.2 0.835 118.0 17.7 -55.9 -32.9 -66.4 -50.8 -5.1 465 92 A Y H << S+ 0 0 156 -3,-1.3 -1,-0.3 -4,-0.8 -2,-0.2 0.254 85.3 137.6-125.5 13.4 -63.0 -52.2 -4.5 466 93 A Y << - 0 0 72 -3,-0.7 3,-0.4 -4,-0.7 4,-0.3 -0.441 46.2-147.3 -62.2 126.4 -62.2 -51.2 -1.0 467 94 A P S > S+ 0 0 63 0, 0.0 3,-0.7 0, 0.0 4,-0.3 0.892 93.5 48.3 -64.4 -42.5 -60.5 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112.0 41.4 -57.6 -37.8 -56.4 -48.6 35.5 591 31 E L T 3<5S+ 0 0 47 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.264 110.6 56.4 -98.0 17.2 -55.3 -50.1 32.2 592 32 E S T < 5S- 0 0 0 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.181 104.6-115.5-129.6 18.6 -56.1 -53.7 33.0 593 33 E E T < 5S+ 0 0 135 -3,-0.5 2,-0.2 -4,-0.2 -3,-0.2 0.905 80.0 116.7 48.2 47.2 -59.8 -53.5 33.9 594 34 E S < - 0 0 27 -5,-1.7 2,-0.3 -6,-0.1 -1,-0.2 -0.638 63.3-109.8-131.4-172.2 -58.8 -54.6 37.5 595 35 E S > - 0 0 59 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.918 22.3-124.6-123.5 150.8 -58.7 -53.4 41.1 596 36 E K H > S+ 0 0 117 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.921 116.1 53.7 -58.6 -39.5 -55.7 -52.4 43.3 597 37 E G H > S+ 0 0 55 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.908 108.9 46.4 -59.4 -46.1 -57.0 -55.1 45.7 598 38 E N H > S+ 0 0 34 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.882 111.0 53.0 -65.6 -39.3 -57.0 -57.8 43.1 599 39 E L H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 3,-0.4 0.949 110.4 47.4 -61.6 -46.5 -53.6 -56.8 41.9 600 40 E Y H < S+ 0 0 97 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.727 104.4 61.0 -69.3 -19.6 -52.2 -57.1 45.4 601 41 E Y H < S+ 0 0 183 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.892 114.9 33.7 -70.2 -40.9 -53.9 -60.5 45.9 602 42 E H H < S+ 0 0 64 -4,-1.5 2,-0.5 -3,-0.4 -2,-0.2 0.861 128.9 35.3 -80.6 -42.8 -51.9 -62.0 43.1 603 43 E F S < S- 0 0 0 -4,-2.8 -1,-0.3 -5,-0.2 6,-0.1 -0.970 71.4-148.8-120.5 120.1 -48.7 -60.0 43.6 604 44 E K S S- 0 0 159 -2,-0.5 2,-0.3 -3,-0.1 -1,-0.1 0.861 78.0 -10.8 -50.8 -43.3 -47.7 -59.1 47.1 605 45 E T S > S- 0 0 53 1,-0.1 4,-2.8 -3,-0.1 5,-0.1 -0.959 70.7 -98.6-154.0 169.0 -46.1 -55.8 46.0 606 46 E K H > S+ 0 0 40 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.902 123.8 52.5 -56.1 -47.4 -45.0 -53.8 43.0 607 47 E E H > S+ 0 0 57 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.918 110.2 47.0 -55.7 -49.3 -41.5 -55.0 43.6 608 48 E N H > S+ 0 0 30 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.909 111.1 52.4 -64.0 -39.6 -42.7 -58.6 43.7 609 49 E L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.971 109.5 48.9 -57.8 -54.3 -44.7 -58.0 40.5 610 50 E F H X S+ 0 0 0 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.887 110.3 52.5 -52.9 -41.4 -41.7 -56.6 38.7 611 51 E L H X S+ 0 0 18 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.900 108.9 48.5 -63.2 -43.3 -39.6 -59.6 39.8 612 52 E E H X S+ 0 0 62 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.934 111.1 50.3 -63.8 -44.1 -42.2 -62.1 38.5 613 53 E I H X S+ 0 0 3 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.910 108.6 53.7 -58.3 -42.8 -42.3 -60.2 35.1 614 54 E L H X S+ 0 0 2 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.866 107.2 51.4 -61.6 -35.9 -38.5 -60.4 35.1 615 55 E N H X S+ 0 0 86 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.947 110.4 47.6 -67.9 -45.1 -38.6 -64.1 35.5 616 56 E I H X S+ 0 0 59 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.970 110.6 50.8 -58.5 -54.7 -41.0 -64.7 32.7 617 57 E Q H X S+ 0 0 7 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.908 110.3 52.8 -46.8 -47.1 -39.0 -62.4 30.4 618 58 E E H X S+ 0 0 8 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.916 110.6 44.8 -54.8 -51.6 -36.0 -64.5 31.3 619 59 E S H X S+ 0 0 71 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.952 113.2 50.1 -61.2 -50.5 -37.7 -67.8 30.5 620 60 E K H X S+ 0 0 86 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.927 110.0 51.7 -53.4 -49.4 -39.1 -66.6 27.2 621 61 E W H X S+ 0 0 8 -4,-3.0 4,-2.6 -5,-0.3 -1,-0.2 0.933 112.5 45.2 -53.6 -50.3 -35.7 -65.3 26.2 622 62 E Q H X S+ 0 0 105 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.952 113.4 47.6 -60.2 -53.4 -34.0 -68.6 27.0 623 63 E E H X S+ 0 0 98 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.878 112.5 52.2 -57.2 -37.7 -36.6 -70.7 25.2 624 64 E Q H X S+ 0 0 42 -4,-2.8 4,-2.4 -5,-0.3 -1,-0.2 0.945 112.1 44.3 -64.9 -45.2 -36.4 -68.4 22.3 625 65 E W H X S+ 0 0 21 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.831 106.4 60.6 -68.5 -33.2 -32.6 -68.7 22.1 626 66 E K H X S+ 0 0 137 -4,-2.7 4,-0.5 1,-0.2 -1,-0.2 0.945 112.3 39.0 -57.2 -49.2 -32.7 -72.4 22.5 627 67 E K H >< S+ 0 0 150 -4,-1.7 3,-0.6 -5,-0.2 4,-0.2 0.924 118.1 48.7 -66.5 -46.6 -34.8 -72.7 19.4 628 68 E E H >< S+ 0 0 44 -4,-2.4 3,-2.7 1,-0.2 4,-0.3 0.909 95.7 66.5 -63.1 -49.5 -32.9 -70.0 17.5 629 69 E Q H >< S+ 0 0 62 -4,-2.7 3,-2.5 1,-0.3 -1,-0.2 0.703 82.8 78.4 -48.6 -28.4 -29.2 -71.0 18.0 630 70 E I T << S+ 0 0 128 -3,-0.6 -1,-0.3 -4,-0.5 -2,-0.1 0.804 83.3 65.3 -51.9 -32.2 -29.8 -74.2 16.0 631 71 E K T < S+ 0 0 152 -3,-2.7 2,-0.5 -4,-0.2 -1,-0.3 0.695 94.9 68.8 -68.6 -15.8 -29.5 -72.0 12.9 632 72 E A < - 0 0 8 -3,-2.5 3,-0.1 -4,-0.3 0, 0.0 -0.882 57.7-178.1-104.8 131.8 -25.9 -71.3 13.8 633 73 E K + 0 0 188 -2,-0.5 2,-0.3 1,-0.1 -1,-0.2 0.904 67.6 50.9 -93.5 -47.9 -23.4 -74.1 13.5 634 74 E T S > S- 0 0 51 1,-0.1 4,-2.5 65,-0.0 3,-0.4 -0.660 81.4-125.8 -92.1 145.3 -20.1 -72.4 14.7 635 75 E N H > S+ 0 0 15 -2,-0.3 4,-2.8 1,-0.3 5,-0.2 0.808 113.6 65.4 -55.4 -29.2 -19.9 -70.5 17.9 636 76 E R H > S+ 0 0 113 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.983 107.5 39.6 -53.8 -56.5 -18.6 -67.7 15.8 637 77 E E H > S+ 0 0 87 -3,-0.4 4,-3.3 1,-0.2 -2,-0.2 0.914 110.0 59.4 -60.8 -45.0 -22.0 -67.6 14.1 638 78 E K H X S+ 0 0 27 -4,-2.5 4,-3.5 1,-0.3 5,-0.3 0.937 105.8 50.4 -49.4 -48.5 -23.8 -68.1 17.5 639 79 E F H X S+ 0 0 0 -4,-2.8 4,-1.5 1,-0.2 -1,-0.3 0.893 111.1 47.3 -58.2 -42.2 -22.2 -65.0 18.7 640 80 E Y H X S+ 0 0 41 -4,-1.6 4,-2.1 -5,-0.2 -2,-0.2 0.960 116.9 44.4 -63.7 -49.6 -23.3 -63.1 15.6 641 81 E L H X S+ 0 0 32 -4,-3.3 4,-3.0 1,-0.2 -2,-0.2 0.919 109.8 51.7 -62.7 -51.0 -26.8 -64.4 15.9 642 82 E Y H X S+ 0 0 1 -4,-3.5 4,-2.0 -5,-0.2 -1,-0.2 0.882 112.0 48.6 -56.7 -38.5 -27.4 -64.0 19.7 643 83 E N H X S+ 0 0 0 -4,-1.5 4,-0.8 -5,-0.3 -1,-0.2 0.956 112.4 46.4 -67.1 -47.8 -26.3 -60.3 19.4 644 84 E E H >X S+ 0 0 59 -4,-2.1 3,-1.2 1,-0.2 4,-0.8 0.901 108.8 57.4 -60.3 -41.0 -28.6 -59.6 16.5 645 85 E L H >X S+ 0 0 6 -4,-3.0 4,-2.7 1,-0.3 3,-2.2 0.942 96.1 62.4 -54.0 -51.7 -31.4 -61.4 18.2 646 86 E S H 3< S+ 0 0 2 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.790 100.5 56.4 -45.3 -32.1 -31.1 -59.0 21.2 647 87 E L H << S+ 0 0 8 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.770 119.9 26.4 -73.2 -27.1 -32.0 -56.2 18.8 648 88 E T H << S+ 0 0 71 -3,-2.2 -2,-0.2 -4,-0.8 -1,-0.2 0.588 93.6 102.7-115.0 -12.9 -35.2 -57.8 17.7 649 89 E T < - 0 0 13 -4,-2.7 -28,-0.0 -5,-0.2 0, 0.0 -0.226 59.0-147.4 -66.4 164.2 -36.4 -59.9 20.5 650 90 E E + 0 0 35 3,-0.1 2,-0.4 -33,-0.1 -1,-0.1 0.202 67.6 96.9-116.3 14.8 -39.1 -58.6 22.7 651 91 E Y S S- 0 0 35 -31,-0.1 2,-2.7 3,-0.1 -2,-0.1 -0.881 97.0 -30.3-113.5 138.0 -37.9 -60.3 25.8 652 92 E Y S > S+ 0 0 18 -2,-0.4 3,-3.1 1,-0.2 4,-0.4 -0.357 119.9 74.2 64.8 -71.7 -35.8 -58.9 28.6 653 93 E Y G > S+ 0 0 12 -2,-2.7 3,-1.0 1,-0.3 4,-0.3 0.750 88.7 59.4 -45.0 -33.9 -33.8 -56.4 26.5 654 94 E P G 3 S+ 0 0 42 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.744 106.4 50.3 -71.1 -16.2 -36.7 -54.0 26.2 655 95 E L G <> S+ 0 0 0 -3,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.393 73.5 111.6 -98.6 -0.9 -36.8 -53.7 30.0 656 96 E Q H <> S+ 0 0 4 -3,-1.0 4,-2.4 -4,-0.4 5,-0.3 0.879 77.5 50.9 -39.2 -56.4 -33.1 -53.0 30.6 657 97 E N H > S+ 0 0 20 -4,-0.3 4,-2.3 1,-0.3 5,-0.3 0.955 112.1 44.9 -50.7 -60.1 -33.7 -49.4 31.8 658 98 E A H > S+ 0 0 2 1,-0.2 4,-1.8 -4,-0.2 -1,-0.3 0.818 112.3 58.1 -53.4 -31.5 -36.4 -50.4 34.3 659 99 E I H X S+ 0 0 14 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.959 108.8 38.1 -67.9 -54.1 -34.1 -53.2 35.4 660 100 E I H X S+ 0 0 11 -4,-2.4 4,-3.7 1,-0.2 5,-0.5 0.975 115.2 56.1 -60.9 -49.1 -31.0 -51.2 36.4 661 101 E E H X S+ 0 0 5 -4,-2.3 4,-1.2 -5,-0.3 -1,-0.2 0.888 111.4 44.6 -45.5 -42.6 -33.3 -48.6 37.8 662 102 E F H X S+ 0 0 0 -4,-1.8 4,-1.1 -5,-0.3 -1,-0.3 0.869 114.7 48.7 -72.1 -36.1 -34.8 -51.4 39.9 663 103 E Y H X S+ 0 0 17 -4,-2.4 4,-1.0 2,-0.2 3,-0.2 0.886 108.5 50.2 -72.8 -42.6 -31.4 -52.8 40.8 664 104 E T H < S+ 0 0 48 -4,-3.7 -1,-0.2 1,-0.2 3,-0.2 0.851 113.9 49.5 -66.5 -28.0 -29.7 -49.6 41.9 665 105 E E H < S+ 0 0 79 -4,-1.2 -1,-0.2 -5,-0.5 -2,-0.2 0.745 125.8 22.3 -82.5 -22.8 -32.8 -49.0 44.1 666 106 E Y H >< S+ 0 0 60 -4,-1.1 3,-0.8 -3,-0.2 7,-0.5 0.106 82.7 110.2-129.6 22.2 -32.9 -52.4 45.8 667 107 E Y T 3< S+ 0 0 99 -4,-1.0 -3,-0.1 1,-0.2 -2,-0.1 0.617 78.6 60.4 -76.2 -4.1 -29.4 -53.8 45.5 668 108 E K T 3 S+ 0 0 161 -4,-0.1 2,-0.8 -5,-0.1 -1,-0.2 0.720 82.7 92.0 -89.1 -23.6 -29.0 -53.2 49.2 669 109 E T S <> S- 0 0 61 -3,-0.8 4,-2.7 1,-0.2 5,-0.3 -0.636 71.5-146.4 -78.3 108.9 -31.9 -55.6 50.0 670 110 E N H > S+ 0 0 130 -2,-0.8 4,-2.1 1,-0.2 5,-0.2 0.852 93.0 48.3 -35.4 -64.8 -30.5 -59.1 50.6 671 111 E S H > S+ 0 0 62 2,-0.2 4,-2.0 1,-0.2 3,-0.3 0.951 119.1 37.3 -46.0 -65.8 -33.5 -61.0 49.2 672 112 E I H > S+ 0 0 6 1,-0.2 4,-2.8 2,-0.2 5,-0.4 0.951 110.2 60.0 -53.5 -60.0 -33.8 -59.0 46.0 673 113 E N H X S+ 0 0 42 -4,-2.7 4,-1.5 -7,-0.5 -1,-0.2 0.831 110.6 42.2 -38.8 -47.3 -30.1 -58.5 45.4 674 114 E E H >X S+ 0 0 103 -4,-2.1 4,-2.2 -3,-0.3 3,-0.6 0.979 111.9 52.0 -67.8 -54.8 -29.5 -62.2 45.2 675 115 E K H 3X S+ 0 0 97 -4,-2.0 4,-1.6 1,-0.3 -2,-0.2 0.898 112.1 48.4 -45.0 -48.9 -32.6 -63.1 43.1 676 116 E M H 3X S+ 0 0 9 -4,-2.8 4,-2.9 1,-0.2 -1,-0.3 0.837 107.7 54.2 -63.8 -36.0 -31.5 -60.5 40.6 677 117 E N H X S+ 0 0 13 -4,-1.8 3,-1.6 1,-0.2 4,-0.6 0.990 113.5 43.4 -69.1 -57.4 -28.1 -63.9 30.9 684 124 E I H >X S+ 0 0 18 -4,-1.8 4,-2.0 1,-0.3 3,-0.7 0.809 102.6 71.2 -56.6 -30.5 -24.3 -63.7 30.9 685 125 E D H 3X S+ 0 0 84 -4,-2.9 4,-2.5 1,-0.2 -1,-0.3 0.793 84.7 66.4 -58.8 -29.8 -24.1 -67.5 30.9 686 126 E A H X S+ 0 0 115 -4,-2.1 4,-2.0 -5,-0.3 3,-0.6 0.959 114.9 48.7 -67.3 -47.8 -16.2 -71.9 26.4 693 133 E E H 3< S+ 0 0 80 -4,-3.3 -1,-0.2 1,-0.3 6,-0.2 0.863 108.6 55.8 -57.9 -36.0 -17.6 -74.0 23.5 694 134 E G H ><>S+ 0 0 0 -4,-1.4 5,-2.6 -5,-0.4 6,-1.0 0.847 106.9 50.9 -65.4 -33.9 -15.5 -71.8 21.2 695 135 E N H X<5S+ 0 0 46 -4,-1.5 3,-2.7 -3,-0.6 -2,-0.2 0.989 107.5 47.9 -67.0 -62.4 -12.4 -72.6 23.1 696 136 E L T 3<5S+ 0 0 107 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.291 114.8 51.4 -66.6 17.5 -12.7 -76.4 23.2 697 137 E N T < 5S- 0 0 102 -3,-0.7 -1,-0.3 3,-0.2 -2,-0.2 0.325 111.3-117.0-129.9 -0.6 -13.4 -76.2 19.5 698 138 E G T < 5S+ 0 0 64 -3,-2.7 -3,-0.2 2,-0.3 -2,-0.1 0.670 75.7 129.5 72.3 17.4 -10.4 -74.1 18.5 699 139 E E S - 0 0 77 1,-0.2 4,-1.9 2,-0.0 -1,-0.3 -0.854 69.1-169.0-112.3 96.3 -10.6 -65.4 31.2 705 145 E V H > S+ 0 0 21 -2,-0.7 4,-3.0 -3,-0.5 5,-0.2 0.893 83.7 57.9 -48.3 -50.4 -14.0 -66.5 29.8 706 146 E N H > S+ 0 0 84 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.928 106.8 46.7 -49.1 -54.2 -16.0 -64.9 32.6 707 147 E A H > S+ 0 0 6 -3,-0.2 4,-2.4 1,-0.2 3,-0.3 0.954 113.5 47.1 -56.1 -53.2 -14.6 -61.4 32.0 708 148 E V H X S+ 0 0 2 -4,-1.9 4,-3.2 1,-0.2 5,-0.3 0.924 108.6 57.5 -54.4 -45.0 -15.2 -61.6 28.2 709 149 E S H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.892 110.4 42.1 -51.1 -47.9 -18.7 -62.9 28.9 710 150 E K H X S+ 0 0 87 -4,-2.0 4,-2.2 -3,-0.3 -1,-0.2 0.835 113.9 53.7 -70.9 -33.8 -19.6 -59.8 31.0 711 151 E I H X S+ 0 0 3 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.987 111.7 42.9 -64.5 -57.3 -17.9 -57.5 28.5 712 152 E A H X S+ 0 0 0 -4,-3.2 4,-3.7 2,-0.2 3,-0.4 0.958 114.5 51.6 -49.9 -59.3 -19.8 -58.8 25.5 713 153 E A H X S+ 0 0 11 -4,-2.2 4,-2.7 1,-0.3 5,-0.2 0.918 115.1 38.9 -44.6 -61.2 -23.1 -58.8 27.4 714 154 E N H X S+ 0 0 13 -4,-2.2 4,-1.2 1,-0.2 -1,-0.3 0.759 116.4 54.3 -67.3 -21.7 -22.9 -55.3 28.6 715 155 E A H X S+ 0 0 0 -4,-2.1 4,-1.8 -3,-0.4 3,-0.3 0.967 110.9 42.6 -74.7 -54.1 -21.4 -54.2 25.3 716 156 E V H >X S+ 0 0 0 -4,-3.7 4,-3.5 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