==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 13-AUG-03 1UJZ . COMPND 2 MOLECULE: DESIGNED COLICIN E7 IMMUNITY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR T.KORTEMME,L.A.JOACHIMIAK,A.N.BULLOCK,A.D.SCHULER, . 214 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11678.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 135 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 7.0 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 . 1 0.5 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 . 10 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 67 31.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 2 0 1 1 1 0 0 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 1 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 . 1 1 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 1 A M 0 0 103 0, 0.0 2,-0.6 0, 0.0 17,-0.0 0.000 360.0 360.0 360.0-161.1 35.0 81.4 0.2 2 2 A E - 0 0 154 0, 0.0 2,-0.7 0, 0.0 16,-0.0 -0.899 360.0-154.0-104.8 117.5 36.8 84.8 -0.4 3 3 A L - 0 0 76 -2,-0.6 2,-0.0 2,-0.0 34,-0.0 -0.817 12.5-150.7 -94.1 110.7 40.0 85.2 1.6 4 4 A K - 0 0 57 -2,-0.7 40,-0.1 1,-0.1 3,-0.1 -0.289 14.7-129.2 -73.6 164.8 40.7 88.9 2.2 5 5 A N S S+ 0 0 139 1,-0.1 2,-0.3 -2,-0.0 -1,-0.1 0.758 85.1 37.0 -88.9 -23.8 44.3 90.1 2.5 6 6 A S S > S- 0 0 34 1,-0.1 3,-1.7 39,-0.0 4,-0.3 -0.935 71.2-128.1-132.8 152.8 43.9 92.1 5.8 7 7 A I G > S+ 0 0 2 37,-0.5 3,-1.5 -2,-0.3 78,-0.6 0.813 110.3 66.3 -63.8 -29.0 41.9 91.8 9.0 8 8 A S G 3 S+ 0 0 44 1,-0.3 -1,-0.3 76,-0.2 78,-0.1 0.639 93.3 59.9 -66.5 -15.9 40.7 95.3 8.3 9 9 A D G < S+ 0 0 58 -3,-1.7 2,-0.4 76,-0.1 -1,-0.3 0.585 95.0 81.7 -87.6 -11.1 38.8 94.0 5.3 10 10 A Y < - 0 0 2 -3,-1.5 75,-3.2 -4,-0.3 2,-0.1 -0.823 67.7-147.9-102.0 130.8 36.8 91.6 7.6 11 11 A T B > -a 85 0A 16 -2,-0.4 4,-1.6 73,-0.2 5,-0.2 -0.423 38.1-107.3 -79.5 166.8 33.7 92.5 9.6 12 12 A E H > S+ 0 0 74 73,-0.5 4,-1.6 75,-0.3 3,-0.3 0.944 122.7 51.9 -62.9 -41.9 33.5 90.6 12.8 13 13 A A H > S+ 0 0 69 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.861 108.2 52.0 -60.1 -37.3 30.6 88.5 11.3 14 14 A E H > S+ 0 0 61 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.817 105.8 53.6 -68.6 -33.2 32.7 87.8 8.2 15 15 A F H X S+ 0 0 0 -4,-1.6 4,-1.7 -3,-0.3 3,-0.2 0.850 104.1 56.1 -70.9 -34.2 35.7 86.5 10.3 16 16 A V H X S+ 0 0 35 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.875 101.6 57.1 -64.5 -34.9 33.3 84.1 12.0 17 17 A Q H X S+ 0 0 126 -4,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.828 105.4 51.4 -66.0 -29.6 32.4 82.7 8.6 18 18 A L H X S+ 0 0 0 -4,-1.0 4,-2.3 -3,-0.2 -1,-0.2 0.883 107.6 52.7 -71.8 -39.6 36.1 81.9 8.1 19 19 A L H X S+ 0 0 6 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.892 109.3 47.8 -63.7 -40.6 36.3 80.2 11.4 20 20 A K H X S+ 0 0 99 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.875 108.8 54.8 -69.3 -32.8 33.3 77.9 10.5 21 21 A E H X S+ 0 0 63 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.919 110.5 46.4 -63.9 -41.7 34.9 77.2 7.1 22 22 A I H X S+ 0 0 1 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.909 109.2 54.2 -65.4 -40.7 38.0 76.1 9.1 23 23 A E H X S+ 0 0 40 -4,-2.4 4,-0.7 1,-0.2 -2,-0.2 0.859 108.1 51.5 -61.9 -33.4 35.8 74.0 11.4 24 24 A K H >< S+ 0 0 115 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.936 110.8 45.0 -68.2 -47.3 34.3 72.3 8.3 25 25 A E H >< S+ 0 0 25 -4,-2.0 3,-1.2 1,-0.2 9,-0.3 0.764 101.4 71.0 -68.9 -22.9 37.8 71.4 6.9 26 26 A N H 3< S+ 0 0 0 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.837 104.1 39.8 -60.9 -34.9 38.8 70.3 10.3 27 27 A V T << S+ 0 0 61 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.315 93.6 115.2 -98.3 6.4 36.4 67.3 10.0 28 28 A A S < S- 0 0 24 -3,-1.2 137,-0.1 2,-0.2 -3,-0.0 -0.378 82.9-105.4 -74.1 158.2 37.3 66.7 6.3 29 29 A A S S+ 0 0 100 -2,-0.1 2,-0.2 2,-0.0 -1,-0.1 0.820 101.8 22.9 -50.5 -40.6 39.0 63.4 5.3 30 30 A T - 0 0 73 -5,-0.1 4,-0.2 137,-0.0 -2,-0.2 -0.729 69.1-130.9-123.8 175.0 42.4 65.2 4.8 31 31 A D S > S+ 0 0 27 -2,-0.2 4,-2.9 1,-0.1 5,-0.3 0.319 74.7 106.4-106.9 4.2 44.1 68.4 6.0 32 32 A D H > S+ 0 0 121 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.926 90.6 32.1 -50.8 -53.6 45.2 69.7 2.6 33 33 A V H > S+ 0 0 76 1,-0.2 4,-1.9 2,-0.2 3,-0.4 0.901 115.6 60.6 -73.0 -39.9 42.6 72.5 2.4 34 34 A L H > S+ 0 0 0 -9,-0.3 4,-2.7 -4,-0.2 5,-0.2 0.915 101.1 52.9 -52.7 -48.0 42.6 73.0 6.1 35 35 A Y H X S+ 0 0 26 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.848 106.7 52.8 -61.1 -32.4 46.3 73.9 6.2 36 36 A V H X S+ 0 0 80 -4,-0.9 4,-1.7 -3,-0.4 -1,-0.2 0.911 111.8 45.9 -68.1 -41.1 45.8 76.6 3.5 37 37 A L H X S+ 0 0 15 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.884 112.2 50.9 -68.4 -38.5 43.0 78.1 5.6 38 38 A L H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.874 107.2 53.6 -66.4 -37.9 45.1 78.0 8.8 39 39 A E H X S+ 0 0 105 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.913 110.4 47.5 -62.5 -41.3 48.0 79.7 7.1 40 40 A H H X S+ 0 0 33 -4,-1.7 4,-2.3 2,-0.2 5,-0.3 0.897 109.7 52.7 -67.3 -39.8 45.7 82.5 6.0 41 41 A F H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 5,-0.3 0.929 111.9 46.8 -60.5 -44.2 44.3 82.8 9.6 42 42 A V H X S+ 0 0 44 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.943 111.5 50.6 -64.7 -46.7 47.8 83.1 10.9 43 43 A K H < S+ 0 0 161 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.905 115.2 39.8 -60.6 -43.1 48.9 85.6 8.4 44 44 A I H < S+ 0 0 8 -4,-2.3 -37,-0.5 1,-0.2 -1,-0.2 0.823 116.1 47.6 -78.8 -31.6 46.0 88.1 8.8 45 45 A T H < S- 0 0 1 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.823 82.7-160.6 -76.9 -31.0 45.6 87.9 12.6 46 46 A E < + 0 0 89 -4,-1.8 -3,-0.1 -5,-0.3 -4,-0.1 0.506 32.4 155.7 63.3 4.3 49.4 88.3 13.1 47 47 A H > - 0 0 12 -5,-0.2 3,-1.8 1,-0.1 -1,-0.2 -0.404 47.7-132.6 -64.0 133.2 48.9 86.9 16.6 48 48 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.783 104.1 54.3 -57.7 -30.5 52.1 85.3 17.9 49 49 A D T > S- 0 0 80 1,-0.2 3,-2.5 2,-0.1 124,-0.4 0.474 85.7-176.8 -86.9 2.0 50.4 82.1 19.1 50 50 A G T X + 0 0 4 -3,-1.8 3,-1.8 1,-0.3 4,-0.3 -0.073 67.4 9.0 43.3-125.0 48.9 81.5 15.6 51 51 A T T >> S+ 0 0 5 1,-0.3 4,-2.4 2,-0.2 3,-1.5 0.614 110.4 85.7 -63.1 -10.2 46.7 78.5 15.4 52 52 A D H <> S+ 0 0 10 -3,-2.5 4,-2.6 1,-0.3 -1,-0.3 0.826 79.0 65.6 -60.3 -30.0 46.8 78.1 19.2 53 53 A L H <4 S+ 0 0 5 -3,-1.8 -1,-0.3 2,-0.2 -2,-0.2 0.820 112.7 34.2 -59.7 -28.8 43.9 80.6 19.4 54 54 A I H <4 S+ 0 0 4 -3,-1.5 104,-0.4 -4,-0.3 -2,-0.2 0.905 131.6 26.5 -91.9 -50.3 41.8 77.9 17.6 55 55 A Y H < S+ 0 0 0 -4,-2.4 101,-0.6 1,-0.2 -3,-0.2 0.597 131.2 34.1 -93.1 -13.1 43.2 74.6 19.0 56 56 A Y S < S+ 0 0 50 -4,-2.6 -1,-0.2 -5,-0.4 -2,-0.1 -0.371 76.3 179.2-139.8 58.6 44.5 75.7 22.4 57 57 A P - 0 0 24 0, 0.0 6,-0.1 0, 0.0 -4,-0.1 -0.270 34.3-105.1 -63.4 146.5 42.2 78.5 23.7 58 58 A S > - 0 0 46 1,-0.1 3,-1.1 4,-0.1 -2,-0.0 -0.319 20.6-125.5 -67.9 153.7 42.9 80.1 27.1 59 59 A D T 3 S+ 0 0 173 1,-0.2 -1,-0.1 3,-0.0 4,-0.1 0.685 105.3 72.9 -74.6 -17.8 40.7 79.1 30.0 60 60 A N T 3 S+ 0 0 139 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 0.412 102.6 43.3 -77.2 2.3 40.0 82.8 30.6 61 61 A R S < S- 0 0 26 -3,-1.1 2,-0.2 9,-0.0 6,-0.1 -0.956 95.1 -88.0-144.2 161.6 37.8 82.9 27.5 62 62 A D - 0 0 123 -2,-0.3 2,-1.5 1,-0.1 -4,-0.1 -0.484 31.3-130.1 -73.3 138.1 35.1 80.8 25.7 63 63 A D S S+ 0 0 40 -2,-0.2 -1,-0.1 4,-0.1 94,-0.1 -0.711 74.0 96.3 -88.2 85.8 36.3 78.2 23.3 64 64 A S S > S- 0 0 30 -2,-1.5 4,-2.3 1,-0.1 5,-0.2 -0.961 92.2 -90.9-163.0 167.3 34.0 79.3 20.5 65 65 A P H > S+ 0 0 13 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.881 127.6 50.2 -55.4 -40.2 34.1 81.5 17.3 66 66 A E H > S+ 0 0 126 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.862 109.1 51.4 -66.0 -37.6 33.0 84.5 19.4 67 67 A G H > S+ 0 0 4 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.874 109.9 49.7 -67.5 -37.9 35.7 83.8 22.0 68 68 A I H X S+ 0 0 7 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.936 111.3 47.8 -63.6 -50.3 38.3 83.7 19.2 69 69 A V H X S+ 0 0 3 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.929 111.0 52.9 -57.9 -46.8 37.2 87.0 17.7 70 70 A K H X S+ 0 0 111 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.925 109.4 47.1 -56.4 -49.2 37.1 88.6 21.2 71 71 A E H X S+ 0 0 35 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.903 112.8 50.0 -61.5 -41.4 40.7 87.6 22.0 72 72 A I H X S+ 0 0 2 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.925 109.7 51.1 -61.6 -46.0 41.9 88.8 18.5 73 73 A K H X S+ 0 0 89 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.920 112.9 45.4 -56.6 -47.8 40.2 92.1 19.0 74 74 A E H X S+ 0 0 105 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.871 114.1 47.6 -66.3 -40.7 41.8 92.7 22.5 75 75 A W H X S+ 0 0 61 -4,-2.4 4,-1.5 -5,-0.2 6,-0.2 0.960 115.1 44.3 -66.9 -51.3 45.3 91.6 21.4 76 76 A R H <>S+ 0 0 3 -4,-2.7 5,-2.8 1,-0.2 -2,-0.2 0.889 114.9 49.4 -61.1 -40.4 45.3 93.8 18.2 77 77 A A H ><5S+ 0 0 71 -4,-2.2 3,-1.9 -5,-0.3 -1,-0.2 0.950 109.8 50.6 -64.0 -47.5 43.8 96.8 20.1 78 78 A A H 3<5S+ 0 0 88 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.781 113.0 47.7 -60.7 -28.0 46.3 96.5 22.9 79 79 A N T 3<5S- 0 0 96 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.252 114.9-114.9 -97.7 11.4 49.1 96.4 20.3 80 80 A G T < 5 + 0 0 73 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.710 66.2 146.2 64.5 21.6 47.7 99.4 18.4 81 81 A K < - 0 0 85 -5,-2.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.578 58.6 -90.9 -88.8 152.0 47.0 97.3 15.3 82 82 A P - 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -75,-0.1 -0.343 47.9-144.4 -62.5 141.4 44.0 98.0 13.0 83 83 A G - 0 0 40 1,-0.2 -73,-0.1 -75,-0.1 3,-0.1 -0.171 32.1 -51.9 -96.7-169.2 40.9 96.1 14.0 84 84 A F - 0 0 17 1,-0.1 -73,-0.2 -75,-0.1 -1,-0.2 -0.196 68.7 -87.5 -62.1 154.5 37.9 94.4 12.2 85 85 A K B -a 11 0A 108 -75,-3.2 -73,-0.5 -78,-0.6 -1,-0.1 -0.462 28.9-142.5 -65.6 128.2 35.9 96.4 9.6 86 86 A Q 0 0 191 -2,-0.2 -1,-0.2 -75,-0.1 -75,-0.1 0.725 360.0 360.0 -64.6 -21.6 33.2 98.3 11.3 87 87 A G 0 0 99 -76,-0.0 -75,-0.3 -77,-0.0 -3,-0.0 0.105 360.0 360.0 -51.5 360.0 30.9 97.5 8.3 88 !* 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 89 447 B R 0 0 237 0, 0.0 44,-0.1 0, 0.0 43,-0.0 0.000 360.0 360.0 360.0 -69.3 49.6 50.8 3.7 90 448 B N - 0 0 45 1,-0.1 0, 0.0 107,-0.0 0, 0.0 0.106 360.0 -81.0 -84.5-157.2 50.8 48.2 6.1 91 449 B K - 0 0 133 1,-0.1 -1,-0.1 42,-0.0 40,-0.1 -0.801 47.2 -92.8-112.3 155.0 49.4 44.7 6.6 92 450 B P + 0 0 100 0, 0.0 2,-0.3 0, 0.0 40,-0.2 -0.084 56.6 138.5 -60.0 162.9 46.3 43.6 8.6 93 451 B G E -B 131 0B 23 38,-2.0 38,-3.1 40,-0.1 2,-0.4 -0.960 46.1 -89.7 173.3 173.9 46.6 42.4 12.2 94 452 B K E -B 130 0B 117 -2,-0.3 36,-0.2 36,-0.3 2,-0.2 -0.853 37.2-114.4-111.2 145.7 45.0 42.5 15.7 95 453 B A + 0 0 0 34,-2.6 33,-2.9 31,-0.5 2,-0.3 -0.525 38.3 171.0 -78.3 140.1 45.7 45.0 18.4 96 454 B T B +c 199 0C 65 102,-1.8 104,-3.0 31,-0.2 105,-0.4 -0.943 23.6 73.8-143.2 162.5 47.4 43.8 21.6 97 455 B G - 0 0 17 -2,-0.3 30,-0.1 102,-0.2 102,-0.0 -0.644 59.2-117.5 123.3 178.3 48.9 45.4 24.8 98 456 B K - 0 0 145 -2,-0.2 25,-0.3 1,-0.1 26,-0.2 0.575 35.7-162.9-129.1 -26.9 47.7 47.1 27.9 99 457 B G - 0 0 14 24,-0.1 21,-0.1 23,-0.1 -1,-0.1 -0.371 28.3 -79.1 72.3-154.6 49.1 50.6 27.8 100 458 B K B -d 119 0D 132 18,-2.4 20,-1.2 -2,-0.1 21,-0.2 -0.985 34.7 -95.8-148.6 157.0 49.3 52.7 31.0 101 459 B P - 0 0 104 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.450 43.6-161.6 -71.5 146.4 47.1 54.9 33.3 102 460 B V - 0 0 37 -2,-0.1 4,-0.1 1,-0.1 14,-0.0 -0.928 10.2-135.1-131.1 157.2 47.2 58.6 32.6 103 461 B N > - 0 0 99 -2,-0.3 3,-0.6 3,-0.1 -1,-0.1 0.031 48.8 -77.5 -89.4-159.5 46.4 61.8 34.4 104 462 B N T 3 S+ 0 0 90 1,-0.2 3,-0.1 2,-0.1 -1,-0.0 0.228 127.7 58.0 -88.4 13.2 44.5 64.9 33.2 105 463 B K T > + 0 0 118 1,-0.1 3,-2.4 2,-0.0 4,-0.4 -0.260 67.4 157.5-134.0 42.1 47.6 66.1 31.3 106 464 B W G X S+ 0 0 7 -3,-0.6 3,-0.5 1,-0.3 -1,-0.1 0.802 74.0 34.4 -37.2 -54.0 48.0 63.0 29.1 107 465 B L G > S+ 0 0 21 1,-0.2 3,-2.3 2,-0.1 -1,-0.3 0.339 83.4 105.8 -92.7 10.5 50.0 64.5 26.3 108 466 B N G < S+ 0 0 118 -3,-2.4 -1,-0.2 1,-0.3 4,-0.1 0.814 88.2 44.0 -57.0 -28.2 52.0 67.0 28.4 109 467 B N G < S+ 0 0 94 -3,-0.5 6,-0.4 -4,-0.4 -1,-0.3 0.316 84.0 143.5 -98.0 6.3 55.0 64.7 27.9 110 468 B A S < S+ 0 0 6 -3,-2.3 2,-2.0 1,-0.2 96,-0.3 -0.157 76.4 0.0 -48.1 134.9 54.3 64.2 24.2 111 469 B G S S+ 0 0 0 94,-0.8 -1,-0.2 1,-0.2 4,-0.2 -0.440 103.2 109.3 82.6 -67.6 57.6 64.0 22.3 112 470 B K S > S- 0 0 97 -2,-2.0 3,-2.8 2,-0.2 2,-0.4 -0.116 99.0 -22.0 -44.4 134.9 59.8 64.4 25.3 113 471 B D T 3 S- 0 0 127 1,-0.3 3,-0.1 -3,-0.1 101,-0.1 -0.455 139.4 -23.4 60.4-116.6 61.5 61.1 26.0 114 472 B L T 3 S- 0 0 103 1,-0.4 -1,-0.3 -2,-0.4 2,-0.2 0.284 97.9-126.0-106.7 7.3 59.3 58.6 24.3 115 473 B G < - 0 0 15 -3,-2.8 -1,-0.4 -6,-0.4 91,-0.2 -0.535 52.6 -25.6 85.8-151.0 56.2 60.8 24.5 116 474 B S E -E 205 0E 2 89,-2.8 89,-3.2 -2,-0.2 -5,-0.1 -0.792 64.5-125.1-104.4 145.8 52.9 59.8 26.0 117 475 B P E -E 204 0E 45 0, 0.0 87,-0.2 0, 0.0 84,-0.1 -0.252 33.8 -85.4 -82.6 172.0 51.7 56.1 26.3 118 476 B V - 0 0 2 85,-0.6 -18,-2.4 82,-0.5 5,-0.1 -0.676 51.5-115.0 -77.9 121.6 48.5 54.5 25.1 119 477 B P B > -d 100 0D 0 0, 0.0 4,-1.9 0, 0.0 3,-0.3 -0.275 16.6-130.8 -56.3 142.6 45.9 55.0 27.8 120 478 B D H > S+ 0 0 39 -20,-1.2 4,-2.3 1,-0.2 5,-0.2 0.870 107.5 55.9 -65.0 -36.9 44.8 51.7 29.3 121 479 B R H 4 S+ 0 0 94 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.817 108.8 49.2 -65.0 -28.2 41.1 52.5 28.9 122 480 B I H >> S+ 0 0 1 -3,-0.3 4,-1.2 2,-0.2 3,-0.9 0.886 107.9 52.5 -77.1 -39.7 41.8 53.0 25.2 123 481 B A H >X S+ 0 0 0 -4,-1.9 4,-3.1 -25,-0.3 3,-0.6 0.910 103.5 58.2 -61.3 -41.5 43.7 49.7 24.9 124 482 B N H 3< S+ 0 0 94 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.734 108.1 47.7 -60.9 -21.5 40.7 47.9 26.5 125 483 B K H <4 S+ 0 0 115 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.2 0.712 120.5 34.6 -91.1 -23.0 38.6 49.2 23.6 126 484 B L H X< S+ 0 0 0 -4,-1.2 3,-1.6 -3,-0.6 -31,-0.5 0.657 86.5 120.0-104.9 -20.9 41.0 48.2 20.8 127 485 B R T 3< S+ 0 0 66 -4,-3.1 -31,-0.2 1,-0.3 3,-0.1 -0.085 84.9 3.8 -49.7 141.7 42.5 45.0 22.2 128 486 B D T 3 S+ 0 0 118 -33,-2.9 -1,-0.3 1,-0.2 -32,-0.1 0.242 98.8 129.6 67.1 -15.1 41.9 41.8 20.1 129 487 B K < - 0 0 112 -3,-1.6 -34,-2.6 -35,-0.1 2,-0.3 -0.408 56.4-125.0 -71.1 146.8 40.3 43.9 17.4 130 488 B E E -B 94 0B 132 -36,-0.2 2,-0.3 -3,-0.1 -36,-0.3 -0.661 23.1-166.3 -95.0 149.9 41.5 43.5 13.8 131 489 B F E -B 93 0B 8 -38,-3.1 -38,-2.0 -2,-0.3 3,-0.1 -0.983 26.2-140.2-136.0 145.7 42.7 46.3 11.5 132 490 B K S S- 0 0 142 -2,-0.3 2,-0.3 -40,-0.2 -1,-0.1 0.729 85.7 -23.2 -74.7 -23.3 43.4 46.5 7.8 133 491 B S S > S- 0 0 14 -40,-0.1 4,-1.6 -44,-0.1 -1,-0.2 -0.971 71.4 -88.1-172.6 174.3 46.5 48.6 8.4 134 492 B F H > S+ 0 0 17 -2,-0.3 4,-2.9 1,-0.2 5,-0.1 0.820 124.1 57.0 -67.2 -30.9 48.2 50.9 10.9 135 493 B D H > S+ 0 0 62 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.902 106.3 48.2 -66.0 -40.9 46.5 53.8 9.3 136 494 B D H > S+ 0 0 47 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.858 112.3 51.6 -65.9 -33.8 43.1 52.2 10.0 137 495 B F H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.931 107.5 50.8 -66.5 -47.8 44.4 51.6 13.5 138 496 B R H X S+ 0 0 60 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.876 110.5 49.6 -58.1 -40.6 45.4 55.3 13.9 139 497 B K H X S+ 0 0 98 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.889 113.2 45.5 -67.1 -39.9 42.0 56.4 12.8 140 498 B K H X S+ 0 0 55 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.866 110.1 57.6 -70.9 -35.3 40.3 54.0 15.3 141 499 B F H X S+ 0 0 1 -4,-2.8 4,-1.6 1,-0.2 3,-0.4 0.974 108.8 41.7 -59.0 -59.1 42.7 55.1 18.0 142 500 B W H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.840 110.8 58.1 -61.2 -32.2 41.8 58.8 17.9 143 501 B E H X S+ 0 0 37 -4,-1.5 4,-1.0 1,-0.2 -1,-0.2 0.907 105.7 49.8 -64.4 -38.6 38.1 58.1 17.5 144 502 B E H X S+ 0 0 14 -4,-1.9 4,-1.0 -3,-0.4 -1,-0.2 0.853 106.8 55.8 -67.9 -32.6 38.3 56.2 20.8 145 503 B V H >< S+ 0 0 0 -4,-1.6 3,-0.6 1,-0.2 7,-0.5 0.910 104.6 52.9 -64.6 -40.6 40.0 59.1 22.4 146 504 B S H 3< S+ 0 0 20 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.761 109.8 48.9 -67.0 -24.4 37.1 61.4 21.4 147 505 B K H 3< S+ 0 0 114 -4,-1.0 -1,-0.2 -3,-0.2 -2,-0.2 0.611 88.3 92.8 -90.7 -13.5 34.6 59.0 23.0 148 506 B D XX - 0 0 22 -4,-1.0 4,-2.9 -3,-0.6 3,-1.5 -0.728 65.7-154.1 -85.0 110.0 36.5 58.7 26.3 149 507 B P H 3> S+ 0 0 73 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.837 92.5 51.0 -49.9 -42.2 35.0 61.4 28.7 150 508 B E H 34 S+ 0 0 97 1,-0.1 -2,-0.0 2,-0.1 -5,-0.0 0.662 118.3 38.4 -75.2 -15.3 38.2 61.7 30.8 151 509 B L H X4 S+ 0 0 1 -3,-1.5 3,-2.1 -6,-0.2 -1,-0.1 0.845 110.0 54.0 -99.9 -46.1 40.4 62.2 27.7 152 510 B S H >< S+ 0 0 21 -4,-2.9 3,-2.0 -7,-0.5 -2,-0.1 0.816 98.8 66.5 -59.4 -30.4 38.3 64.3 25.4 153 511 B K T 3< S+ 0 0 146 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.1 0.657 91.4 64.5 -65.4 -13.7 37.9 66.9 28.2 154 512 B Q T < S+ 0 0 65 -3,-2.1 2,-0.3 2,-0.1 -1,-0.3 0.375 98.9 67.4 -89.7 3.9 41.7 67.5 27.8 155 513 B F S < S- 0 0 29 -3,-2.0 -99,-0.1 -4,-0.1 -100,-0.0 -0.880 84.0-109.9-125.1 156.9 41.2 68.8 24.3 156 514 B S > - 0 0 12 -101,-0.6 4,-2.0 -2,-0.3 5,-0.1 -0.211 38.9-103.2 -74.2 172.0 39.6 71.9 22.7 157 515 B R H > S+ 0 0 169 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.888 121.9 51.5 -64.5 -42.4 36.4 71.6 20.7 158 516 B N H > S+ 0 0 13 -104,-0.4 4,-1.2 1,-0.2 -1,-0.2 0.871 111.8 47.5 -64.5 -36.1 38.2 72.0 17.3 159 517 B N H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.872 108.4 53.6 -74.2 -33.8 40.6 69.2 18.4 160 518 B N H X S+ 0 0 32 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.904 105.9 54.3 -64.4 -40.0 37.9 66.9 19.5 161 519 B D H X S+ 0 0 62 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.863 107.2 51.4 -60.1 -37.6 36.2 67.3 16.1 162 520 B R H ><>S+ 0 0 1 -4,-1.2 5,-2.4 1,-0.2 3,-1.1 0.950 111.4 46.1 -65.3 -49.0 39.4 66.2 14.4 163 521 B M H ><5S+ 0 0 0 -4,-2.1 3,-2.1 1,-0.2 -2,-0.2 0.840 102.1 66.0 -62.6 -34.8 39.7 63.0 16.6 164 522 B K H 3<5S+ 0 0 125 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.759 105.6 43.9 -59.4 -27.1 36.0 62.2 16.0 165 523 B V T <<5S- 0 0 52 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.161 128.0 -96.5-104.1 16.7 36.8 61.6 12.3 166 524 B G T < 5S+ 0 0 9 -3,-2.1 2,-0.3 1,-0.3 -24,-0.2 0.520 82.4 129.3 86.3 5.4 40.0 59.7 13.0 167 525 B K < - 0 0 22 -5,-2.4 -1,-0.3 -6,-0.2 -2,-0.1 -0.682 61.3-110.0 -96.4 150.0 42.4 62.5 12.6 168 526 B A - 0 0 12 -2,-0.3 -1,-0.1 1,-0.1 16,-0.1 -0.429 40.1-102.2 -73.4 148.7 45.2 63.3 15.1 169 527 B P - 0 0 0 0, 0.0 14,-2.2 0, 0.0 2,-0.2 -0.324 37.1-104.8 -69.9 154.8 44.8 66.5 17.1 170 528 B Q B -G 182 0F 1 12,-0.2 12,-0.3 1,-0.1 2,-0.2 -0.537 35.0-135.3 -76.7 146.5 46.8 69.6 16.1 171 529 B T - 0 0 2 10,-2.5 -116,-0.1 -2,-0.2 5,-0.1 -0.456 36.2 -76.0 -94.1 173.8 49.8 70.3 18.4 172 530 B R > - 0 0 97 -2,-0.2 3,-2.2 1,-0.1 4,-0.4 -0.365 47.7-109.3 -66.4 151.6 50.7 73.7 19.7 173 531 B T G > S+ 0 0 51 -124,-0.4 3,-2.3 1,-0.3 -1,-0.1 0.911 117.6 60.6 -47.6 -50.4 52.4 75.9 17.2 174 532 B Q G 3 S+ 0 0 128 1,-0.3 -1,-0.3 -125,-0.1 -2,-0.0 0.591 104.3 50.7 -57.1 -11.7 55.7 75.7 19.0 175 533 B D G < S+ 0 0 38 -3,-2.2 34,-1.5 6,-0.1 -1,-0.3 0.421 87.2 110.3-107.9 1.1 55.7 71.9 18.5 176 534 B V < - 0 0 21 -3,-2.3 2,-0.2 -4,-0.4 5,-0.2 -0.318 46.1-165.9 -75.5 156.5 55.0 71.9 14.7 177 535 B S B > -H 180 0G 34 3,-2.6 3,-1.5 1,-0.2 2,-0.2 -0.724 53.1 -63.7-147.3 92.3 57.5 70.9 12.1 178 536 B G T 3 S- 0 0 64 1,-0.3 -1,-0.2 -2,-0.2 -2,-0.0 -0.470 118.0 -8.8 70.0-134.4 56.8 71.8 8.5 179 537 B K T 3 S+ 0 0 164 -2,-0.2 2,-1.0 1,-0.1 -1,-0.3 0.644 121.1 89.5 -70.8 -15.0 53.6 70.2 7.0 180 538 B R B < +H 177 0G 92 -3,-1.5 -3,-2.6 1,-0.1 -1,-0.1 -0.731 40.7 143.6 -88.2 97.9 53.5 68.1 10.2 181 539 B R + 0 0 53 -2,-1.0 -10,-2.5 -5,-0.2 2,-0.3 0.173 49.9 73.6-121.1 19.0 51.5 70.0 12.7 182 540 B S B S-G 170 0F 24 -12,-0.3 -12,-0.2 -7,-0.1 2,-0.1 -0.858 90.5 -81.9-128.1 164.0 49.6 67.2 14.5 183 541 B F - 0 0 13 -14,-2.2 2,-0.3 -2,-0.3 24,-0.2 -0.398 46.7-152.2 -65.3 138.5 50.5 64.5 17.0 184 542 B E E -F 206 0E 39 22,-2.7 22,-2.6 -2,-0.1 2,-0.6 -0.841 13.3-123.0-115.7 150.7 52.1 61.4 15.5 185 543 B L E -F 205 0E 14 -2,-0.3 2,-0.4 20,-0.2 20,-0.2 -0.837 31.8-165.3 -93.9 121.8 52.1 57.7 16.6 186 544 B H E -F 204 0E 32 18,-2.8 18,-1.7 -2,-0.6 2,-0.6 -0.880 16.6-136.1-112.8 138.7 55.7 56.4 17.1 187 545 B H E -F 203 0E 26 -2,-0.4 16,-0.2 16,-0.2 10,-0.1 -0.828 8.2-154.0 -92.7 121.2 56.9 52.8 17.4 188 546 B E S S+ 0 0 49 14,-1.8 -1,-0.2 -2,-0.6 15,-0.1 0.971 93.7 37.9 -56.1 -58.4 59.4 52.4 20.1 189 547 B K S S- 0 0 89 13,-0.2 -1,-0.3 6,-0.2 6,-0.2 -0.843 105.5-122.4 -98.2 100.6 61.0 49.3 18.5 190 548 B P - 0 0 45 0, 0.0 5,-0.5 0, 0.0 3,-0.3 0.050 15.3-115.0 -42.4 144.0 60.8 50.2 14.7 191 549 B I S S+ 0 0 64 1,-0.2 5,-0.1 3,-0.1 6,-0.1 0.803 113.2 69.7 -52.0 -30.4 59.0 47.8 12.4 192 550 B S S S+ 0 0 121 1,-0.1 2,-0.5 3,-0.1 -1,-0.2 0.973 100.2 42.9 -51.6 -66.4 62.4 47.2 10.9 193 551 B Q S S- 0 0 118 -3,-0.3 2,-2.4 2,-0.1 -1,-0.1 -0.740 138.4 -34.8 -89.3 127.3 63.8 45.3 13.9 194 552 B N S S- 0 0 147 -2,-0.5 2,-0.4 2,-0.0 -3,-0.1 -0.379 88.9-138.5 64.1 -78.0 61.5 42.7 15.5 195 553 B G - 0 0 7 -2,-2.4 -6,-0.2 -5,-0.5 -2,-0.1 -0.988 32.2-171.1 134.6-131.2 58.4 44.7 14.9 196 554 B G + 0 0 26 -2,-0.4 -1,-0.1 -5,-0.1 -7,-0.1 0.872 20.4 164.4 96.1 55.1 55.3 45.4 17.0 197 555 B V S S+ 0 0 25 1,-0.2 -102,-0.1 -6,-0.1 -104,-0.1 0.967 79.8 20.8 -67.1 -58.7 53.0 47.1 14.6 198 556 B Y S S+ 0 0 18 -104,-0.2 -102,-1.8 -67,-0.0 2,-1.1 0.239 91.7 120.8 -97.2 12.2 49.7 46.8 16.5 199 557 B D B > -c 96 0C 48 -104,-0.2 3,-2.9 1,-0.2 -102,-0.2 -0.670 50.0-160.6 -81.0 102.3 51.3 46.3 19.9 200 558 B M G > S+ 0 0 2 -104,-3.0 3,-0.6 -2,-1.1 -82,-0.5 0.646 89.8 63.0 -58.2 -15.2 49.9 49.2 21.9 201 559 B D G 3 S+ 0 0 91 -105,-0.4 -1,-0.3 1,-0.2 -104,-0.1 0.577 104.6 47.2 -85.3 -9.4 52.8 48.7 24.4 202 560 B N G < S+ 0 0 14 -3,-2.9 -14,-1.8 -6,-0.1 2,-0.4 0.167 102.4 84.3-112.2 14.9 55.2 49.6 21.5 203 561 B I E < + F 0 187E 6 -3,-0.6 -85,-0.6 -16,-0.2 2,-0.3 -0.945 51.0 166.4-122.6 139.8 53.2 52.6 20.5 204 562 B S E -EF 117 186E 6 -18,-1.7 -18,-2.8 -2,-0.4 2,-0.5 -0.962 34.5-112.8-147.0 162.6 53.3 56.2 21.9 205 563 B V E +EF 116 185E 1 -89,-3.2 -89,-2.8 -2,-0.3 -94,-0.8 -0.883 40.6 167.7-103.2 123.2 52.2 59.7 21.0 206 564 B V E - F 0 184E 1 -22,-2.6 -22,-2.7 -2,-0.5 -96,-0.1 -0.902 34.3-108.0-132.9 160.2 54.8 62.3 20.2 207 565 B T > - 0 0 3 -2,-0.3 4,-2.3 -24,-0.2 5,-0.2 -0.413 34.1-112.0 -81.0 161.5 55.1 65.8 18.8 208 566 B P H > S+ 0 0 0 0, 0.0 4,-1.2 0, 0.0 5,-0.2 0.910 115.6 55.2 -60.1 -43.4 56.4 66.4 15.2 209 567 B K H >> S+ 0 0 103 -34,-1.5 4,-2.1 1,-0.2 3,-0.5 0.941 115.6 35.1 -56.2 -53.8 59.5 68.2 16.6 210 568 B R H 3> S+ 0 0 53 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.805 106.5 69.3 -73.9 -27.5 60.6 65.3 18.9 211 569 B A H 3< S+ 0 0 9 -4,-2.3 -1,-0.2 1,-0.2 4,-0.2 0.841 111.6 34.7 -56.8 -31.4 59.4 62.7 16.4 212 570 B I H X< S+ 0 0 72 -4,-1.2 3,-1.0 -3,-0.5 -2,-0.2 0.858 113.9 58.4 -87.9 -43.4 62.3 64.0 14.3 213 571 B D H 3< S+ 0 0 111 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.941 100.5 55.2 -51.5 -56.3 64.6 64.7 17.3 214 572 B I T 3< 0 0 46 -4,-3.0 -1,-0.3 -101,-0.1 -2,-0.1 0.754 360.0 360.0 -52.0 -25.2 64.6 61.1 18.5 215 573 B H < 0 0 173 -3,-1.0 -3,-0.0 -5,-0.3 0, 0.0 -0.393 360.0 360.0-105.6 360.0 65.7 60.1 15.1