==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER KINASE INHIBITOR/PEPTIDE 23-JUN-99 1QJB . COMPND 2 MOLECULE: 14-3-3 PROTEIN ZETA/DELTA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.RITTINGER,J.BUDMAN,J.XU,S.VOLINIA,L.C.CANTLEY,S.J.SMERDON, . 475 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23771.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 373 78.5 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 . 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 . 7 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 318 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 0 0 0 0 0 0 4 0 0 4 0 4 1 0 1 0 0 0 0 0 1 0 1 2 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 1 A M 0 0 114 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 175.3 -4.6 9.3 49.6 2 2 A D > - 0 0 124 1,-0.1 4,-2.0 4,-0.0 5,-0.2 -0.398 360.0 -95.6 -92.0 170.9 -6.4 7.0 47.0 3 3 A K H >> S+ 0 0 49 1,-0.2 4,-2.1 2,-0.2 3,-0.7 0.950 121.6 45.7 -57.5 -62.4 -4.7 4.1 45.2 4 4 A N H 3> S+ 0 0 131 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.854 115.2 51.7 -51.9 -36.2 -3.7 5.8 41.9 5 5 A E H 3> S+ 0 0 88 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.843 105.6 53.6 -67.8 -39.1 -2.4 8.7 44.0 6 6 A L H S+ 0 0 0 -4,-2.9 5,-2.7 1,-0.2 4,-0.5 0.913 108.4 54.6 -58.4 -44.1 9.7 8.8 46.2 14 14 A E H ><5S+ 0 0 66 -4,-2.3 3,-1.3 -5,-0.2 -1,-0.2 0.945 108.3 47.3 -55.6 -49.6 11.6 6.5 43.9 15 15 A Q H 3<5S+ 0 0 96 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.899 113.9 48.6 -59.2 -37.7 13.0 9.4 41.9 16 16 A A T 3<5S- 0 0 3 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.483 111.6-124.6 -79.4 -2.0 13.9 11.2 45.2 17 17 A E T < 5 + 0 0 126 -3,-1.3 2,-0.8 -4,-0.5 -3,-0.2 0.883 65.1 141.1 54.5 44.2 15.5 8.0 46.5 18 18 A R >< + 0 0 30 -5,-2.7 4,-1.8 1,-0.2 -1,-0.2 -0.805 21.2 171.4-110.6 74.9 13.3 8.0 49.6 19 19 A Y H > + 0 0 60 -2,-0.8 4,-2.5 1,-0.2 32,-0.2 0.802 69.4 59.7 -66.4 -27.5 12.8 4.2 49.6 20 20 A D H > S+ 0 0 100 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.922 109.2 44.2 -61.1 -50.6 11.0 4.1 53.0 21 21 A D H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.897 111.8 54.4 -58.5 -41.0 8.3 6.4 51.7 22 22 A M H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 5,-0.2 0.948 111.2 44.1 -57.9 -50.2 8.1 4.4 48.4 23 23 A A H X S+ 0 0 4 -4,-2.5 4,-2.4 24,-0.2 -1,-0.2 0.903 109.7 56.1 -66.2 -38.3 7.6 1.1 50.3 24 24 A A H X S+ 0 0 54 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.899 109.2 46.9 -60.9 -41.7 5.0 2.7 52.7 25 25 A C H X S+ 0 0 9 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.922 114.5 45.6 -63.1 -42.6 2.9 3.8 49.6 26 26 A M H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.831 110.6 55.1 -73.7 -29.6 3.1 0.3 47.9 27 27 A K H X S+ 0 0 55 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.946 109.5 45.7 -64.0 -53.9 2.3 -1.3 51.3 28 28 A S H X S+ 0 0 50 -4,-2.2 4,-0.9 2,-0.2 -2,-0.2 0.826 110.9 53.5 -57.6 -37.6 -0.9 0.8 51.6 29 29 A V H >< S+ 0 0 1 -4,-2.2 3,-0.9 1,-0.2 4,-0.5 0.968 111.4 47.7 -58.4 -50.2 -1.8 0.0 47.9 30 30 A T H >< S+ 0 0 2 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.871 105.2 56.8 -57.0 -44.3 -1.4 -3.7 48.8 31 31 A E H 3< S+ 0 0 88 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.721 89.8 73.6 -67.4 -16.9 -3.5 -3.6 52.0 32 32 A Q T << S- 0 0 103 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.773 104.1-134.2 -64.4 -26.6 -6.4 -2.2 50.0 33 33 A G < + 0 0 28 -3,-1.7 2,-0.2 -4,-0.5 -3,-0.1 0.379 58.3 128.1 92.5 -1.1 -6.6 -5.8 48.7 34 34 A A - 0 0 55 -5,-0.4 -1,-0.3 1,-0.1 -2,-0.1 -0.639 69.7 -93.5 -87.5 147.8 -7.0 -5.5 45.0 35 35 A E - 0 0 67 -2,-0.2 2,-0.2 70,-0.1 -1,-0.1 -0.261 46.8-118.8 -53.8 142.1 -4.7 -7.4 42.7 36 36 A L - 0 0 9 1,-0.1 -1,-0.1 66,-0.1 2,-0.0 -0.600 17.3-123.6 -86.9 148.5 -1.7 -5.3 41.6 37 37 A S > - 0 0 51 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.257 35.7 -99.3 -72.4 175.0 -0.8 -4.3 38.0 38 38 A N H > S+ 0 0 76 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.881 126.7 50.3 -57.1 -47.8 2.6 -5.1 36.5 39 39 A E H > S+ 0 0 90 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.899 110.2 48.7 -64.0 -39.9 3.7 -1.6 37.3 40 40 A E H > S+ 0 0 12 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.899 109.8 53.0 -72.7 -28.4 2.5 -1.8 40.9 41 41 A R H X S+ 0 0 8 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.878 110.0 47.4 -70.0 -44.8 4.3 -5.1 41.3 42 42 A N H X S+ 0 0 70 -4,-2.0 4,-3.0 1,-0.2 5,-0.3 0.930 112.1 50.2 -61.5 -44.2 7.6 -3.7 40.1 43 43 A L H X S+ 0 0 14 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.884 111.2 47.6 -62.5 -45.7 7.2 -0.6 42.4 44 44 A L H X S+ 0 0 2 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.927 115.1 47.5 -58.5 -48.7 6.6 -2.8 45.4 45 45 A S H X S+ 0 0 13 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.897 112.8 45.5 -62.0 -49.3 9.5 -5.0 44.6 46 46 A V H X S+ 0 0 42 -4,-3.0 4,-1.8 2,-0.2 5,-0.2 0.915 113.5 51.9 -64.5 -42.8 12.0 -2.1 43.9 47 47 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 -24,-0.2 0.947 113.9 40.5 -60.6 -53.2 10.9 -0.3 47.1 48 48 A Y H X S+ 0 0 9 -4,-2.5 4,-3.0 1,-0.2 5,-0.4 0.879 111.2 58.0 -65.0 -38.0 11.4 -3.3 49.4 49 49 A K H X S+ 0 0 13 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.871 110.1 44.0 -56.1 -43.5 14.6 -4.4 47.7 50 50 A N H X S+ 0 0 52 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.881 115.5 47.9 -69.7 -38.5 16.2 -1.0 48.5 51 51 A V H X S+ 0 0 10 -4,-2.1 4,-1.0 -5,-0.2 3,-0.4 0.966 119.8 36.4 -65.8 -54.3 14.9 -0.8 52.0 52 52 A V H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 3,-0.3 0.890 111.8 63.1 -64.9 -37.8 16.0 -4.4 53.0 53 53 A G H X S+ 0 0 20 -4,-2.2 4,-2.2 -5,-0.4 -1,-0.2 0.774 97.9 55.2 -57.5 -34.8 19.2 -4.0 50.8 54 54 A A H X S+ 0 0 50 -4,-1.4 4,-2.3 -3,-0.4 -1,-0.2 0.926 110.1 46.1 -68.7 -38.9 20.4 -1.1 53.1 55 55 A R H X S+ 0 0 52 -4,-1.0 4,-3.1 -3,-0.3 5,-0.2 0.941 112.6 51.1 -68.1 -41.8 20.1 -3.4 56.1 56 56 A R H X S+ 0 0 15 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.872 112.3 45.2 -62.8 -44.1 21.9 -6.2 54.2 57 57 A S H X S+ 0 0 41 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.955 115.4 47.1 -64.6 -41.8 24.8 -4.1 53.2 58 58 A S H X S+ 0 0 7 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.916 110.0 53.5 -65.4 -45.6 25.1 -2.6 56.7 59 59 A W H X S+ 0 0 33 -4,-3.1 4,-2.9 1,-0.2 -1,-0.2 0.888 105.5 54.0 -59.7 -39.9 24.9 -6.0 58.3 60 60 A R H X S+ 0 0 99 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.910 111.7 44.5 -58.5 -49.4 27.8 -7.3 56.1 61 61 A V H X S+ 0 0 44 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.960 119.1 40.4 -58.1 -53.1 30.0 -4.5 57.2 62 62 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.936 113.3 55.5 -70.7 -38.7 29.2 -4.7 60.9 63 63 A S H X S+ 0 0 5 -4,-2.9 4,-0.6 -5,-0.3 -1,-0.2 0.881 113.1 42.2 -53.0 -49.2 29.2 -8.5 60.9 64 64 A S H >< S+ 0 0 69 -4,-1.9 3,-1.1 -5,-0.2 4,-0.4 0.903 109.2 55.4 -69.1 -45.5 32.7 -8.5 59.4 65 65 A I H >< S+ 0 0 62 -4,-2.6 3,-2.0 1,-0.3 -2,-0.2 0.968 108.7 52.4 -48.7 -56.7 34.1 -5.7 61.7 66 66 A E H 3< S+ 0 0 24 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.624 108.2 47.6 -47.3 -33.4 33.0 -7.8 64.6 67 67 A Q T << 0 0 130 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.271 360.0 360.0 -99.6 6.4 34.8 -11.0 63.5 68 68 A K < 0 0 220 -3,-2.0 5,-0.1 -4,-0.4 -3,-0.0 -0.708 360.0 360.0-129.2 360.0 38.0 -9.2 62.8 69 ! 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 70 73 A E 0 0 208 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -38.5 38.0 -8.7 72.6 71 74 A K + 0 0 203 2,-0.1 3,-0.4 3,-0.0 4,-0.2 0.826 360.0 29.5-100.0 -55.8 37.3 -5.5 74.5 72 75 A K S > S+ 0 0 148 1,-0.2 3,-2.1 2,-0.1 2,-0.6 0.997 99.2 87.7 -62.1 -69.0 35.5 -3.4 72.0 73 76 A Q T 3> S+ 0 0 88 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.268 72.7 68.0 -1.8 -48.4 33.9 -6.2 70.0 74 77 A Q H 3> S+ 0 0 108 -2,-0.6 4,-2.8 -3,-0.4 -1,-0.3 0.935 99.0 56.0 -48.9 -48.8 30.7 -6.6 72.1 75 78 A M H <> S+ 0 0 24 -3,-2.1 4,-2.4 2,-0.2 5,-0.2 0.922 106.0 47.3 -46.4 -57.6 29.7 -3.2 70.7 76 79 A A H > S+ 0 0 7 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.932 113.2 51.1 -54.2 -43.5 30.0 -4.3 67.1 77 80 A R H X S+ 0 0 90 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.899 109.7 48.6 -59.6 -47.4 28.0 -7.4 68.1 78 81 A E H X S+ 0 0 91 -4,-2.8 4,-1.3 2,-0.2 -1,-0.2 0.858 112.6 47.9 -61.4 -41.9 25.2 -5.3 69.7 79 82 A Y H X S+ 0 0 7 -4,-2.4 4,-2.3 2,-0.2 3,-0.2 0.908 109.5 53.9 -64.3 -44.1 25.0 -3.0 66.6 80 83 A R H X S+ 0 0 20 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.872 108.8 49.4 -58.2 -38.9 24.9 -6.1 64.3 81 84 A E H X S+ 0 0 71 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.798 109.1 51.2 -71.0 -39.3 21.9 -7.5 66.3 82 85 A K H X S+ 0 0 84 -4,-1.3 4,-1.6 -3,-0.2 -1,-0.2 0.885 112.2 46.5 -61.5 -44.2 20.1 -4.2 66.1 83 86 A I H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.944 110.1 55.8 -65.5 -38.3 20.6 -4.1 62.3 84 87 A E H X S+ 0 0 10 -4,-2.4 4,-3.4 1,-0.3 5,-0.2 0.916 104.9 50.7 -60.4 -46.8 19.5 -7.7 62.2 85 88 A T H X S+ 0 0 67 -4,-2.0 4,-2.5 2,-0.2 -1,-0.3 0.893 110.2 50.3 -59.0 -41.2 16.2 -7.0 63.9 86 89 A E H X S+ 0 0 48 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.972 112.7 47.6 -64.0 -45.6 15.5 -4.2 61.5 87 90 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.939 113.0 47.1 -56.3 -48.7 16.3 -6.6 58.6 88 91 A R H X S+ 0 0 83 -4,-3.4 4,-2.9 1,-0.3 -1,-0.2 0.895 110.0 53.8 -66.0 -39.1 14.1 -9.4 60.0 89 92 A D H X S+ 0 0 101 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.3 0.873 109.7 46.8 -61.2 -44.9 11.3 -6.9 60.6 90 93 A I H X S+ 0 0 21 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.943 113.9 48.3 -62.8 -44.3 11.4 -5.7 56.9 91 94 A C H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.940 113.0 47.6 -64.1 -41.2 11.4 -9.4 55.7 92 95 A N H X S+ 0 0 81 -4,-2.9 4,-2.4 -5,-0.2 -1,-0.2 0.887 109.2 54.9 -67.6 -37.3 8.5 -10.3 58.0 93 96 A D H X S+ 0 0 44 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.964 114.0 39.8 -57.0 -50.8 6.6 -7.2 56.8 94 97 A V H X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.918 113.8 53.7 -66.2 -42.8 7.0 -8.3 53.1 95 98 A L H X S+ 0 0 11 -4,-3.1 4,-2.5 -5,-0.2 -1,-0.2 0.889 109.3 49.7 -61.3 -36.4 6.4 -12.0 53.9 96 99 A S H X S+ 0 0 63 -4,-2.4 4,-3.1 -5,-0.2 5,-0.3 0.907 109.5 49.9 -69.9 -36.9 3.1 -11.1 55.7 97 100 A L H X>S+ 0 0 2 -4,-2.0 4,-2.2 -5,-0.2 5,-2.1 0.883 112.7 49.0 -63.6 -39.0 1.9 -8.9 52.8 98 101 A L H <>S+ 0 0 0 -4,-2.1 5,-2.7 3,-0.2 -2,-0.2 0.956 116.7 40.5 -68.5 -45.6 2.7 -11.8 50.4 99 102 A E H <5S+ 0 0 105 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.863 122.8 38.8 -75.5 -33.5 0.9 -14.4 52.6 100 103 A K H <5S+ 0 0 134 -4,-3.1 -3,-0.2 -5,-0.2 -1,-0.2 0.808 135.7 1.4 -88.1 -35.8 -2.1 -12.2 53.5 101 104 A F T X5S+ 0 0 30 -4,-2.2 4,-1.2 -5,-0.3 -3,-0.2 0.740 122.6 45.9-120.4 -49.5 -2.8 -10.3 50.2 102 105 A L T 44 S- 0 0 118 1,-0.1 4,-2.2 -3,-0.1 5,-0.1 -0.790 79.7-127.4-111.1 145.9 -2.6 -15.1 36.9 109 112 A A H > S+ 0 0 35 -2,-0.3 4,-2.4 2,-0.2 5,-0.3 0.869 108.8 55.5 -55.5 -44.3 0.4 -17.3 36.5 110 113 A E H > S+ 0 0 52 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.925 110.6 46.6 -59.5 -41.5 2.8 -14.4 36.0 111 114 A S H > S+ 0 0 2 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.893 110.7 50.9 -66.4 -44.3 1.7 -12.9 39.3 112 115 A K H X S+ 0 0 63 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.929 112.3 46.9 -60.9 -45.6 2.0 -16.1 41.2 113 116 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.936 112.7 50.3 -60.5 -46.5 5.5 -16.7 40.0 114 117 A F H X S+ 0 0 20 -4,-2.3 4,-1.8 -5,-0.3 -2,-0.2 0.924 115.4 42.4 -59.5 -48.3 6.5 -13.1 40.8 115 118 A Y H X S+ 0 0 2 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.844 113.3 50.5 -69.9 -36.0 5.1 -13.4 44.3 116 119 A L H X S+ 0 0 4 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.887 110.2 51.7 -69.8 -35.3 6.5 -16.9 45.0 117 120 A K H X S+ 0 0 16 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.919 109.6 49.4 -62.5 -45.8 9.9 -15.6 43.8 118 121 A M H X S+ 0 0 5 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.895 109.4 51.5 -59.9 -42.0 9.7 -12.6 46.2 119 122 A K H X S+ 0 0 18 -4,-2.2 4,-2.1 1,-0.2 5,-0.3 0.923 110.5 50.5 -59.7 -40.8 8.7 -15.1 49.1 120 123 A G H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.931 110.8 48.5 -55.9 -55.4 11.8 -17.0 48.1 121 124 A D H X S+ 0 0 5 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.903 111.3 47.2 -56.3 -51.5 14.0 -13.9 48.2 122 125 A Y H X S+ 0 0 7 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.885 112.5 49.3 -71.0 -30.6 12.8 -12.6 51.6 123 126 A Y H X S+ 0 0 43 -4,-2.1 4,-2.9 -5,-0.2 -1,-0.2 0.906 110.4 53.5 -68.4 -34.9 13.2 -16.1 53.3 124 127 A R H X S+ 0 0 1 -4,-2.0 4,-1.9 -5,-0.3 -2,-0.2 0.926 106.3 50.5 -64.6 -44.1 16.7 -16.2 51.7 125 128 A Y H < S+ 0 0 2 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.906 111.7 48.8 -60.6 -39.1 17.5 -12.8 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5,-0.2 0.807 86.9 49.0 -56.7 -39.8 13.9 -7.2 25.6 209 212 A K H > S+ 0 0 133 -4,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.928 115.8 42.1 -66.7 -45.6 16.0 -4.9 27.7 210 213 A D H > S+ 0 0 66 -4,-0.2 4,-2.4 2,-0.2 5,-0.2 0.909 114.9 50.6 -67.3 -44.1 15.1 -6.6 31.0 211 214 A S H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.940 113.1 45.1 -58.0 -44.7 15.4 -10.1 29.6 212 215 A T H X S+ 0 0 70 -4,-1.7 4,-1.9 -5,-0.3 -1,-0.2 0.883 110.1 54.7 -71.9 -34.8 18.8 -9.4 28.1 213 216 A L H X S+ 0 0 86 -4,-1.7 4,-1.5 -5,-0.2 -1,-0.2 0.953 109.9 46.7 -65.9 -45.6 20.1 -7.7 31.2 214 217 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.893 107.5 58.4 -63.2 -36.1 19.1 -10.8 33.4 215 218 A M H X S+ 0 0 9 -4,-2.2 4,-2.2 1,-0.3 -1,-0.2 0.930 106.3 47.4 -60.0 -44.9 20.8 -13.1 30.8 216 219 A Q H X S+ 0 0 94 -4,-1.9 4,-3.2 2,-0.2 -1,-0.3 0.860 108.5 55.7 -63.6 -36.3 24.1 -11.3 31.3 217 220 A L H X S+ 0 0 26 -4,-1.5 4,-2.5 2,-0.2 250,-0.3 0.908 107.6 49.2 -63.4 -40.8 23.6 -11.5 35.1 218 221 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.938 112.5 48.4 -60.5 -46.1 23.3 -15.3 34.7 219 222 A R H X S+ 0 0 129 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.951 110.4 50.3 -64.1 -44.4 26.5 -15.3 32.6 220 223 A D H X S+ 0 0 57 -4,-3.2 4,-3.0 1,-0.2 -1,-0.2 0.900 110.8 48.9 -60.1 -44.2 28.4 -13.2 35.1 221 224 A N H X S+ 0 0 0 -4,-2.5 4,-3.4 2,-0.2 5,-0.3 0.959 110.2 52.7 -60.6 -45.9 27.4 -15.5 38.0 222 225 A L H X S+ 0 0 31 -4,-2.7 4,-0.8 2,-0.2 -2,-0.2 0.930 112.6 43.6 -54.6 -48.8 28.5 -18.5 35.8 223 226 A T H >< S+ 0 0 95 -4,-2.7 3,-1.0 1,-0.2 -1,-0.2 0.960 115.8 49.8 -58.2 -49.7 32.0 -16.8 35.2 224 227 A L H >< S+ 0 0 52 -4,-3.0 3,-1.0 1,-0.2 -2,-0.2 0.907 113.2 43.7 -56.9 -42.9 32.1 -15.9 38.9 225 228 A W H 3< S+ 0 0 21 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.567 116.6 48.0 -83.7 -4.1 31.2 -19.4 40.2 226 229 A T T << S+ 0 0 109 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.2 -0.010 92.3 124.1-119.8 20.9 33.6 -21.0 37.6 227 230 A S < - 0 0 72 -3,-1.0 2,-0.4 -5,-0.1 -3,-0.1 -0.130 55.8-125.6 -79.3 180.0 36.5 -18.7 38.5 228 231 A D 0 0 97 1,-0.2 -2,-0.1 0, 0.0 -1,-0.0 -0.980 360.0 360.0-131.6 141.1 40.0 -19.4 39.6 229 232 A T 0 0 159 -2,-0.4 -1,-0.2 0, 0.0 -2,-0.0 0.988 360.0 360.0 -72.1 360.0 41.9 -18.0 42.7 230 !* 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 0.0 231 1 B M 0 0 139 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-163.0 26.6 6.9 78.2 232 2 B D > - 0 0 100 1,-0.1 4,-1.7 2,-0.0 5,-0.1 -0.359 360.0-128.8 -65.8 152.0 30.4 7.3 78.3 233 3 B K H > S+ 0 0 45 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.811 105.1 56.0 -75.4 -37.4 31.9 9.5 75.5 234 4 B N H > S+ 0 0 114 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.767 112.2 48.8 -66.5 -21.0 34.6 7.0 74.2 235 5 B E H > S+ 0 0 88 2,-0.2 4,-2.9 3,-0.1 -2,-0.2 0.938 109.1 48.5 -79.7 -51.2 31.7 4.5 73.7 236 6 B L H X S+ 0 0 9 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.862 114.2 47.9 -56.6 -40.4 29.3 7.0 71.9 237 7 B V H X S+ 0 0 10 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.834 109.5 52.5 -69.7 -37.4 32.2 7.9 69.5 238 8 B Q H X S+ 0 0 52 -4,-0.9 4,-1.8 1,-0.2 -2,-0.2 0.941 111.1 47.2 -64.3 -48.0 33.1 4.2 68.9 239 9 B K H X S+ 0 0 50 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.848 108.2 56.2 -63.6 -33.1 29.4 3.7 68.0 240 10 B A H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.891 108.1 47.9 -63.4 -41.6 29.5 6.8 65.7 241 11 B K H X S+ 0 0 83 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.830 112.1 48.6 -67.1 -39.6 32.4 5.3 63.8 242 12 B L H X S+ 0 0 15 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.911 111.8 50.3 -62.9 -45.2 30.7 2.0 63.5 243 13 B A H <>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.2 4,-0.3 0.935 109.2 52.3 -57.5 -44.0 27.5 3.8 62.3 244 14 B E H ><5S+ 0 0 55 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.924 108.5 49.5 -62.7 -40.5 29.7 5.6 59.8 245 15 B Q H 3<5S+ 0 0 111 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.882 111.8 48.5 -68.3 -35.0 31.1 2.3 58.5 246 16 B A T 3<5S- 0 0 2 -4,-2.2 -1,-0.3 2,-0.1 -2,-0.2 0.362 112.2-121.7 -77.7 -1.6 27.6 0.9 58.1 247 17 B E T < 5 + 0 0 126 -3,-1.2 2,-0.9 -4,-0.3 -3,-0.2 0.842 66.5 141.6 56.4 39.2 26.4 4.1 56.3 248 18 B R >< + 0 0 30 -5,-2.6 4,-2.0 1,-0.2 3,-0.4 -0.752 21.4 172.1-108.1 80.8 23.8 4.7 58.9 249 19 B Y H > S+ 0 0 59 -2,-0.9 4,-2.3 1,-0.2 32,-0.2 0.749 71.9 56.5 -70.6 -25.3 24.1 8.4 59.1 250 20 B D H > S+ 0 0 92 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.827 109.5 47.6 -70.9 -35.4 21.1 9.1 61.4 251 21 B D H > S+ 0 0 29 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.905 113.0 49.2 -67.0 -42.5 22.7 6.7 64.0 252 22 B M H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.914 112.2 48.4 -63.0 -42.5 26.0 8.5 63.5 253 23 B A H X S+ 0 0 6 -4,-2.3 4,-2.8 24,-0.2 -1,-0.2 0.912 110.2 49.6 -60.8 -57.8 24.3 11.9 64.0 254 24 B A H X S+ 0 0 56 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.867 111.2 51.9 -48.0 -44.4 22.4 10.8 67.1 255 25 B C H X S+ 0 0 6 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.937 114.0 41.4 -57.4 -53.6 25.6 9.5 68.6 256 26 B M H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.810 110.3 57.4 -70.8 -27.3 27.5 12.7 68.0 257 27 B K H X S+ 0 0 59 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.948 108.9 47.6 -63.2 -44.7 24.6 14.9 69.1 258 28 B S H X S+ 0 0 56 -4,-2.0 4,-0.5 2,-0.2 -2,-0.2 0.921 110.5 51.3 -61.6 -46.9 24.7 13.0 72.4 259 29 B V H >< S+ 0 0 1 -4,-2.0 3,-1.8 1,-0.2 4,-0.4 0.965 111.8 46.5 -53.8 -51.0 28.5 13.5 72.7 260 30 B T H >< S+ 0 0 2 -4,-2.9 3,-1.9 1,-0.3 -2,-0.2 0.904 104.8 61.0 -66.8 -30.7 28.1 17.3 72.1 261 31 B E H 3< S+ 0 0 106 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.561 84.4 78.3 -72.4 -4.2 25.3 17.6 74.6 262 32 B Q T << S- 0 0 99 -3,-1.8 -1,-0.3 -4,-0.5 -2,-0.2 0.798 104.9-128.1 -72.7 -23.6 27.7 16.3 77.3 263 33 B G < + 0 0 28 -3,-1.9 2,-0.3 -4,-0.4 -2,-0.1 0.370 64.6 121.5 100.6 -5.4 29.0 19.9 77.2 264 34 B A S S- 0 0 59 -5,-0.4 -1,-0.3 1,-0.1 -2,-0.1 -0.710 74.4 -90.5 -92.4 147.6 32.7 19.5 76.8 265 35 B E - 0 0 78 -2,-0.3 2,-0.2 73,-0.1 -1,-0.1 -0.222 48.9-115.8 -48.4 137.1 34.6 21.0 73.8 266 36 B L - 0 0 13 1,-0.1 -1,-0.1 69,-0.1 2,-0.1 -0.558 23.6-124.2 -77.3 148.7 34.7 18.4 71.1 267 37 B S > - 0 0 49 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.334 34.5 -98.9 -73.3 172.8 38.1 17.1 70.1 268 38 B N H > S+ 0 0 90 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.941 126.3 50.3 -55.8 -49.6 39.1 17.4 66.4 269 39 B E H > S+ 0 0 103 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.927 111.4 48.6 -58.8 -46.3 38.1 13.8 65.7 270 40 B E H > S+ 0 0 15 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.880 111.3 48.5 -62.7 -44.2 34.7 14.4 67.4 271 41 B R H X S+ 0 0 14 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.936 111.6 50.7 -66.2 -41.2 34.0 17.6 65.5 272 42 B N H X S+ 0 0 72 -4,-3.2 4,-2.0 1,-0.2 -2,-0.2 0.886 111.6 47.4 -58.6 -42.6 34.9 15.9 62.2 273 43 B L H X S+ 0 0 12 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.847 111.4 50.4 -64.0 -40.7 32.6 13.0 63.0 274 44 B L H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.919 112.3 48.6 -61.3 -44.1 29.7 15.3 64.0 275 45 B S H X S+ 0 0 17 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.863 111.7 47.1 -64.1 -48.5 30.2 17.3 60.7 276 46 B V H X S+ 0 0 50 -4,-2.0 4,-2.0 -5,-0.2 5,-0.2 0.945 112.0 51.6 -60.5 -51.8 30.3 14.2 58.4 277 47 B A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -24,-0.2 0.917 115.7 38.9 -55.2 -53.6 27.2 12.7 60.1 278 48 B Y H X S+ 0 0 6 -4,-2.1 4,-3.0 2,-0.2 5,-0.4 0.842 110.6 57.9 -69.1 -35.8 25.0 15.8 59.7 279 49 B K H X S+ 0 0 20 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.920 111.3 45.4 -59.8 -39.6 26.3 16.7 56.2 280 50 B N H X S+ 0 0 63 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.877 113.9 47.1 -68.2 -44.9 25.1 13.3 55.1 281 51 B V H X S+ 0 0 10 -4,-1.9 4,-0.8 -5,-0.2 -2,-0.2 0.931 120.6 37.3 -64.0 -50.4 21.7 13.5 56.9 282 52 B V H X S+ 0 0 0 -4,-3.0 4,-2.2 2,-0.2 3,-0.4 0.863 112.5 61.7 -70.0 -37.0 20.9 17.0 55.6 283 53 B G H X S+ 0 0 22 -4,-2.2 4,-2.6 -5,-0.4 5,-0.2 0.889 98.4 54.9 -57.4 -37.8 22.6 16.1 52.2 284 54 B A H X S+ 0 0 49 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.887 112.2 44.5 -60.2 -45.4 20.0 13.3 51.5 285 55 B R H X S+ 0 0 49 -4,-0.8 4,-2.8 -3,-0.4 -2,-0.2 0.902 111.3 51.5 -68.3 -42.4 17.2 15.9 52.0 286 56 B R H X S+ 0 0 6 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.907 113.1 46.9 -60.7 -44.1 18.9 18.6 49.9 287 57 B S H X S+ 0 0 55 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.957 114.2 45.5 -65.1 -44.1 19.3 16.1 47.1 288 58 B S H X S+ 0 0 7 -4,-2.0 4,-2.7 -5,-0.2 5,-0.2 0.879 111.6 54.3 -62.3 -43.0 15.7 14.8 47.3 289 59 B W H X S+ 0 0 50 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.907 107.9 48.7 -59.0 -48.0 14.5 18.3 47.5 290 60 B R H X S+ 0 0 95 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.853 112.0 49.1 -58.9 -42.9 16.3 19.3 44.3 291 61 B V H X S+ 0 0 46 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.962 115.1 43.8 -61.8 -51.0 15.0 16.2 42.4 292 62 B V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.862 112.5 52.5 -67.9 -34.7 11.4 16.9 43.5 293 63 B S H X S+ 0 0 23 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.896 108.2 51.4 -65.0 -39.1 11.7 20.7 42.8 294 64 B S H X S+ 0 0 53 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.918 110.8 47.9 -63.7 -45.2 12.9 19.9 39.3 295 65 B I H X S+ 0 0 29 -4,-1.9 4,-1.0 2,-0.2 -2,-0.2 0.949 109.1 54.0 -59.5 -48.1 9.9 17.6 38.7 296 66 B E H >< S+ 0 0 29 -4,-2.5 3,-0.6 2,-0.2 -2,-0.2 0.902 110.9 46.8 -53.1 -44.9 7.5 20.3 40.0 297 67 B Q H >< S+ 0 0 67 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.973 112.5 49.0 -63.4 -50.9 9.0 22.7 37.5 298 68 B K H 3< S+ 0 0 168 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.505 103.8 60.5 -67.4 -10.5 8.8 20.3 34.6 299 69 B T T X< + 0 0 20 -4,-1.0 3,-2.3 -3,-0.6 7,-0.4 0.105 69.1 139.6-106.6 17.8 5.1 19.4 35.4 300 70 B E T < S+ 0 0 145 -3,-1.4 3,-0.1 1,-0.3 -3,-0.1 -0.489 75.8 24.1 -54.6 124.5 3.9 22.9 34.9 301 71 B G T 3 S+ 0 0 82 -2,-0.2 2,-0.6 1,-0.1 -1,-0.3 0.459 102.0 95.2 89.4 1.3 0.6 22.5 33.0 302 72 B A <> - 0 0 37 -3,-2.3 4,-3.1 1,-0.2 5,-0.3 -0.868 59.5-172.3-128.4 85.6 0.2 18.9 34.4 303 73 B E H > S+ 0 0 154 -2,-0.6 4,-2.0 2,-0.2 5,-0.2 0.827 73.9 44.0 -52.2 -57.0 -2.0 19.7 37.3 304 74 B K H > S+ 0 0 171 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.963 119.0 44.9 -60.9 -50.3 -2.3 16.4 39.3 305 75 B K H > S+ 0 0 118 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.918 113.2 49.7 -55.2 -49.0 1.5 15.7 38.9 306 76 B Q H X S+ 0 0 57 -4,-3.1 4,-2.3 -7,-0.4 -1,-0.2 0.895 110.7 48.8 -68.1 -36.0 2.5 19.2 39.8 307 77 B Q H X S+ 0 0 96 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.843 111.3 49.6 -71.5 -32.4 0.4 19.4 42.9 308 78 B M H X S+ 0 0 17 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.919 112.2 48.6 -69.5 -36.0 1.7 16.1 44.2 309 79 B A H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.912 109.9 53.7 -67.5 -39.5 5.3 17.2 43.6 310 80 B R H X S+ 0 0 135 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.940 110.5 44.2 -59.4 -57.7 4.5 20.4 45.4 311 81 B E H X S+ 0 0 94 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.864 113.6 50.5 -58.6 -38.9 3.2 18.6 48.5 312 82 B Y H X S+ 0 0 4 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.926 108.6 52.5 -65.6 -40.2 6.1 16.1 48.5 313 83 B R H X S+ 0 0 8 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.933 108.8 51.1 -61.0 -42.5 8.6 19.0 48.2 314 84 B E H X S+ 0 0 78 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.928 108.8 50.3 -64.4 -40.3 6.9 20.7 51.3 315 85 B K H X S+ 0 0 85 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.943 112.3 47.3 -60.3 -47.5 7.1 17.5 53.3 316 86 B I H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.890 108.1 56.6 -61.8 -40.0 10.8 17.2 52.5 317 87 B E H X S+ 0 0 13 -4,-2.5 4,-2.9 -5,-0.2 -1,-0.2 0.857 102.9 54.1 -57.3 -45.3 11.4 20.8 53.3 318 88 B T H X S+ 0 0 76 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.931 110.2 46.6 -58.4 -42.1 10.0 20.3 56.8 319 89 B E H X S+ 0 0 44 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.893 112.7 49.9 -63.0 -43.0 12.5 17.5 57.5 320 90 B L H X S+ 0 0 1 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.949 111.3 48.2 -61.1 -45.0 15.4 19.6 56.0 321 91 B R H X S+ 0 0 68 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.866 110.7 51.7 -65.6 -35.6 14.4 22.6 58.2 322 92 B D H X S+ 0 0 100 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.888 110.2 48.9 -64.5 -44.2 14.2 20.3 61.3 323 93 B I H X S+ 0 0 18 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.932 113.3 46.5 -61.7 -47.0 17.7 18.9 60.6 324 94 B C H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.886 111.4 50.6 -61.8 -47.2 19.2 22.4 60.1 325 95 B N H X S+ 0 0 88 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.911 107.6 56.9 -59.0 -38.2 17.5 23.8 63.3 326 96 B D H X S+ 0 0 42 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.968 112.5 38.3 -54.8 -57.1 18.9 20.8 65.2 327 97 B V H X S+ 0 0 3 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.867 113.0 55.2 -70.1 -35.4 22.5 21.6 64.2 328 98 B L H X S+ 0 0 9 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.839 108.8 49.7 -65.0 -34.0 22.1 25.3 64.5 329 99 B S H X S+ 0 0 74 -4,-2.5 4,-2.8 2,-0.2 5,-0.4 0.936 109.4 51.6 -68.8 -40.9 20.9 24.8 68.2 330 100 B L H X>S+ 0 0 6 -4,-2.1 4,-2.1 -5,-0.3 5,-2.0 0.937 112.1 47.3 -57.7 -43.7 23.9 22.5 68.8 331 101 B L H <>S+ 0 0 1 -4,-2.2 5,-2.7 3,-0.2 -2,-0.2 0.919 114.9 44.3 -67.6 -43.4 26.1 25.3 67.4 332 102 B E H <5S+ 0 0 97 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.917 120.5 38.9 -69.4 -39.7 24.5 28.1 69.5 333 103 B K H <5S- 0 0 142 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.812 136.4 -5.3 -83.5 -35.7 24.3 26.1 72.8 334 104 B F T X5S+ 0 0 30 -4,-2.1 4,-1.5 -5,-0.4 -3,-0.2 0.733 120.5 53.2-124.6 -56.7 27.6 24.2 72.8 335 105 B L H >4 S- 0 0 111 1,-0.1 4,-2.2 0, 0.0 3,-0.2 -0.980 83.2-125.9-129.9 145.1 41.0 28.1 69.6 342 112 B A H > S+ 0 0 33 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.880 108.7 57.6 -60.7 -37.4 40.6 30.2 66.4 343 113 B E H > S+ 0 0 86 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.907 111.4 41.6 -52.5 -53.8 40.7 27.1 64.1 344 114 B S H > S+ 0 0 7 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.823 112.7 54.0 -68.2 -36.3 37.7 25.7 65.9 345 115 B K H X S+ 0 0 79 -4,-2.2 4,-2.1 2,-0.2 5,-0.2 0.925 110.9 45.7 -67.1 -42.7 35.9 29.0 66.1 346 116 B V H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.968 111.5 54.5 -63.2 -43.6 36.3 29.5 62.3 347 117 B F H X S+ 0 0 29 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.889 112.2 41.6 -55.7 -51.6 35.1 25.8 61.8 348 118 B Y H X S+ 0 0 2 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.792 113.0 51.2 -71.4 -32.8 31.9 26.3 63.7 349 119 B L H X S+ 0 0 4 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.852 110.1 51.3 -70.7 -37.1 31.0 29.8 62.3 350 120 B K H X S+ 0 0 16 -4,-2.5 4,-3.0 -5,-0.2 -2,-0.2 0.961 110.3 50.4 -55.5 -50.7 31.5 28.4 58.8 351 121 B M H X S+ 0 0 8 -4,-2.0 4,-2.8 -5,-0.2 5,-0.2 0.904 108.8 50.1 -57.0 -43.8 29.1 25.5 59.8 352 122 B K H X S+ 0 0 32 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.905 112.0 48.8 -63.3 -36.1 26.5 28.0 61.1 353 123 B G H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.934 112.2 49.8 -67.8 -48.0 26.8 29.9 57.8 354 124 B D H X S+ 0 0 9 -4,-3.0 4,-2.5 2,-0.2 -2,-0.2 0.940 111.5 45.4 -52.2 -51.8 26.4 26.6 55.9 355 125 B Y H X S+ 0 0 6 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.840 115.1 48.0 -70.8 -31.7 23.3 25.4 57.7 356 126 B Y H X S+ 0 0 46 -4,-1.9 4,-2.7 -5,-0.2 -1,-0.2 0.823 108.6 55.4 -71.6 -35.7 21.7 28.8 57.5 357 127 B R H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.945 106.9 50.9 -57.3 -39.1 22.6 28.8 53.8 358 128 B Y H X S+ 0 0 2 -4,-2.5 4,-0.6 1,-0.2 -2,-0.2 0.906 110.3 48.3 -67.5 -37.4 20.7 25.4 53.5 359 129 B L H >X S+ 0 0 15 -4,-1.7 3,-1.3 1,-0.2 4,-1.0 0.935 109.4 53.9 -63.9 -42.9 17.7 27.0 55.2 360 130 B A H 3< S+ 0 0 0 -4,-2.7 3,-0.3 1,-0.3 -2,-0.2 0.831 97.4 65.8 -57.2 -34.5 18.0 29.9 52.8 361 131 B E H 3< S+ 0 0 30 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.772 119.0 21.8 -61.0 -31.3 17.9 27.5 49.8 362 132 B V H << S+ 0 0 5 -3,-1.3 4,-0.3 -4,-0.6 -1,-0.2 0.339 91.0 144.8-115.9 4.2 14.3 26.5 50.6 363 133 B A X - 0 0 7 -4,-1.0 4,-1.6 4,-0.3 5,-0.2 -0.184 63.9 -89.7 -62.4 133.9 13.2 29.6 52.7 364 134 B A T 4 S+ 0 0 72 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 -0.071 114.8 66.2 -44.7 110.3 9.7 30.7 52.3 365 135 B G T 4 S- 0 0 66 -3,-0.2 -1,-0.2 4,-0.1 3,-0.2 0.081 119.9 -98.4 142.9 8.8 9.6 33.2 49.5 366 136 B D T 4 S+ 0 0 122 -4,-0.3 -2,-0.2 1,-0.2 -3,-0.1 0.873 108.7 17.8 49.8 52.3 10.5 30.3 47.2 367 137 B D S < S+ 0 0 75 -4,-1.6 -4,-0.3 1,-0.2 2,-0.2 -0.126 122.8 7.3 160.5 -57.4 14.2 31.1 47.1 368 138 B K + 0 0 43 -3,-0.2 2,-0.2 -5,-0.2 -1,-0.2 -0.881 51.5 160.7-141.6 174.7 15.4 33.4 49.9 369 139 B K > - 0 0 108 -2,-0.2 2,-3.0 -3,-0.1 3,-2.8 -0.829 60.9 -56.5 178.0 157.1 14.4 35.2 53.1 370 140 B G T 3 S+ 0 0 58 1,-0.3 4,-0.4 -2,-0.2 -10,-0.0 0.409 117.4 76.5 -27.3 8.1 15.8 37.0 56.4 371 141 B I T 3> S+ 0 0 27 -2,-3.0 4,-2.4 2,-0.2 -1,-0.3 0.674 79.6 77.7 -93.6 -13.2 17.7 33.7 57.3 372 142 B V H <> S+ 0 0 13 -3,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.869 89.5 51.3 -61.1 -41.0 20.0 35.0 54.6 373 143 B D H > S+ 0 0 91 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.829 106.5 52.7 -69.6 -37.2 21.5 37.6 57.0 374 144 B Q H > S+ 0 0 78 -4,-0.4 4,-2.3 2,-0.2 5,-0.3 0.952 111.8 47.6 -63.1 -42.0 22.2 35.0 59.7 375 145 B S H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.980 113.9 46.3 -60.4 -55.6 24.1 33.0 57.1 376 146 B Q H X S+ 0 0 50 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.887 112.5 49.1 -54.9 -40.8 26.1 36.0 55.8 377 147 B Q H X S+ 0 0 121 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.861 110.1 49.9 -75.4 -35.3 27.0 37.3 59.3 378 148 B A H X S+ 0 0 4 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.916 114.6 46.0 -64.5 -44.6 28.2 33.9 60.5 379 149 B Y H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.915 110.9 52.6 -61.2 -44.7 30.4 33.6 57.4 380 150 B Q H X S+ 0 0 65 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.926 110.3 46.8 -60.1 -46.2 31.7 37.2 57.6 381 151 B E H X S+ 0 0 86 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.937 114.0 47.9 -65.7 -39.8 32.9 36.7 61.2 382 152 B A H X S+ 0 0 0 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.913 110.9 53.5 -57.6 -47.6 34.5 33.4 60.3 383 153 B F H X S+ 0 0 29 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.951 109.2 46.2 -56.4 -48.8 36.1 35.2 57.3 384 154 B E H X S+ 0 0 111 -4,-2.7 4,-1.3 2,-0.2 5,-0.2 0.964 115.6 46.0 -62.2 -46.5 37.7 38.0 59.4 385 155 B I H >X S+ 0 0 35 -4,-2.3 4,-3.4 1,-0.2 3,-0.8 0.956 112.0 49.9 -60.7 -50.4 39.0 35.6 62.0 386 156 B S H 3X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.3 -1,-0.2 0.910 109.4 52.6 -57.8 -41.3 40.5 33.1 59.5 387 157 B K H 3< S+ 0 0 90 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.767 117.3 38.2 -65.0 -29.5 42.2 36.0 57.6 388 158 B K H << S+ 0 0 161 -4,-1.3 -2,-0.2 -3,-0.8 -1,-0.2 0.813 127.1 32.3 -88.5 -37.9 43.8 37.2 60.9 389 159 B E H < S+ 0 0 104 -4,-3.4 2,-0.3 -5,-0.2 -3,-0.2 0.600 110.0 58.1 -99.8 -14.6 44.6 33.8 62.5 390 160 B M S < S- 0 0 18 -4,-2.6 -1,-0.0 -5,-0.3 0, 0.0 -0.890 75.1-112.8-125.6 154.6 45.3 31.4 59.7 391 161 B Q > - 0 0 104 -2,-0.3 3,-2.2 1,-0.1 6,-0.2 -0.500 38.1-111.7 -73.4 149.6 47.7 30.9 56.7 392 162 B P T 3 S+ 0 0 17 0, 0.0 37,-0.2 0, 0.0 -1,-0.1 0.617 115.8 53.7 -58.9 -20.3 46.1 31.2 53.3 393 163 B T T 3 S+ 0 0 4 35,-0.1 44,-0.2 36,-0.1 55,-0.1 0.388 77.3 122.7 -94.7 -1.1 46.7 27.4 52.5 394 164 B H <> - 0 0 34 -3,-2.2 4,-2.8 1,-0.1 5,-0.3 -0.473 64.1-136.5 -62.2 128.2 44.9 26.3 55.7 395 165 B P H > S+ 0 0 16 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.783 101.6 51.9 -61.7 -32.3 42.1 24.0 54.7 396 166 B I H > S+ 0 0 24 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.904 113.1 44.7 -72.5 -41.7 39.6 25.5 57.1 397 167 B R H > S+ 0 0 30 -3,-0.2 4,-1.9 -6,-0.2 5,-0.2 0.906 116.3 46.2 -65.5 -41.8 40.3 29.0 55.8 398 168 B L H X S+ 0 0 1 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.885 112.2 51.8 -64.2 -39.8 40.2 27.8 52.1 399 169 B G H X S+ 0 0 1 -4,-2.0 4,-2.6 -5,-0.3 78,-0.3 0.846 108.7 49.5 -67.8 -38.4 37.0 25.8 52.8 400 170 B L H X S+ 0 0 0 -4,-1.8 4,-3.0 2,-0.2 5,-0.2 0.914 110.5 50.3 -67.8 -39.4 35.2 28.8 54.3 401 171 B A H X S+ 0 0 3 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.938 110.8 50.8 -62.3 -47.8 36.2 31.1 51.3 402 172 B L H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.966 115.8 40.4 -51.3 -57.7 34.9 28.4 49.0 403 173 B N H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.834 113.2 52.7 -66.5 -35.4 31.6 28.2 50.8 404 174 B F H X S+ 0 0 1 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.909 109.4 50.6 -65.2 -38.7 31.2 31.9 51.4 405 175 B S H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.887 108.0 52.2 -66.8 -37.4 31.7 32.5 47.7 406 176 B V H X>S+ 0 0 4 -4,-1.9 4,-3.1 1,-0.2 5,-0.7 0.906 107.3 55.1 -63.9 -38.1 29.0 29.9 46.9 407 177 B F H X>S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 5,-1.8 0.952 108.9 45.4 -57.7 -49.5 26.9 31.9 49.3 408 178 B Y H <5S+ 0 0 20 -4,-2.1 6,-2.5 3,-0.2 4,-0.4 0.962 118.1 43.9 -60.7 -45.2 27.4 35.1 47.3 409 179 B Y H <5S+ 0 0 74 -4,-2.6 -2,-0.2 4,-0.2 -1,-0.2 0.923 126.6 24.3 -65.2 -53.3 26.8 33.3 44.0 410 180 B E H <5S+ 0 0 82 -4,-3.1 -3,-0.2 -5,-0.2 -1,-0.2 0.786 131.3 31.7 -87.5 -38.6 23.7 31.2 44.8 411 181 B I T < + 0 0 36 -6,-2.5 4,-2.4 1,-0.1 3,-0.2 -0.630 23.2 169.1-130.6 77.2 26.1 38.1 43.0 415 185 B P H > S+ 0 0 56 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.826 75.1 56.1 -60.8 -36.0 28.6 36.3 40.7 416 186 B E H > S+ 0 0 169 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.933 112.0 41.7 -65.2 -47.0 31.1 39.1 40.5 417 187 B K H > S+ 0 0 124 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.874 114.3 53.9 -63.7 -39.7 31.6 39.2 44.3 418 188 B A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.940 111.7 44.5 -59.7 -46.2 31.5 35.4 44.4 419 189 B C H X S+ 0 0 24 -4,-2.9 4,-2.9 1,-0.2 5,-0.3 0.886 111.1 53.5 -65.7 -38.8 34.3 35.2 41.8 420 190 B S H X S+ 0 0 69 -4,-2.3 4,-2.3 -5,-0.3 5,-0.2 0.937 111.4 44.7 -65.0 -45.4 36.4 37.9 43.5 421 191 B L H X S+ 0 0 27 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.959 117.1 45.1 -62.0 -46.1 36.3 36.1 46.8 422 192 B A H X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.920 113.9 49.9 -63.4 -44.2 37.1 32.7 45.3 423 193 B K H X S+ 0 0 111 -4,-2.9 4,-2.9 -5,-0.2 -1,-0.2 0.905 110.0 49.7 -63.1 -42.3 39.8 34.2 43.0 424 194 B T H X S+ 0 0 52 -4,-2.3 4,-2.6 -5,-0.3 5,-0.3 0.954 112.0 47.9 -64.1 -44.6 41.6 36.0 45.9 425 195 B A H X S+ 0 0 19 -4,-2.2 4,-1.9 -5,-0.2 5,-0.2 0.924 115.3 45.8 -60.4 -45.9 41.6 32.9 48.1 426 196 B F H X S+ 0 0 28 -4,-2.4 4,-2.5 -5,-0.2 5,-0.2 0.980 114.1 47.0 -63.0 -52.8 43.0 30.8 45.2 427 197 B D H X S+ 0 0 63 -4,-2.9 4,-0.9 1,-0.2 -2,-0.2 0.829 113.2 49.4 -59.7 -35.6 45.6 33.4 44.2 428 198 B E H < S+ 0 0 82 -4,-2.6 4,-0.3 -5,-0.2 -1,-0.2 0.855 112.8 46.0 -76.5 -29.7 46.8 33.8 47.8 429 199 B A H >< S+ 0 0 0 -4,-1.9 3,-1.7 -5,-0.3 -2,-0.2 0.926 110.3 53.4 -75.5 -38.5 47.1 30.1 48.5 430 200 B I H >< S+ 0 0 74 -4,-2.5 3,-0.7 1,-0.3 -1,-0.2 0.753 102.5 58.5 -68.6 -23.4 49.0 29.5 45.3 431 201 B A T 3< S+ 0 0 82 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.594 110.9 44.7 -76.1 -19.6 51.5 32.1 46.1 432 202 B E T X + 0 0 76 -3,-1.7 3,-1.7 -4,-0.3 -1,-0.2 -0.196 61.8 138.4-123.5 48.0 52.3 30.2 49.3 433 203 B L G X + 0 0 89 -3,-0.7 3,-1.8 1,-0.3 -1,-0.1 0.843 69.7 71.3 -59.7 -32.2 52.5 26.6 48.0 434 204 B D G 3 S+ 0 0 159 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.786 89.0 58.3 -41.3 -48.4 55.5 26.4 50.4 435 205 B T G < S+ 0 0 37 -3,-1.7 -1,-0.3 -6,-0.2 -2,-0.2 0.422 74.2 122.0 -74.4 -3.0 53.3 26.5 53.5 436 206 B L < - 0 0 33 -3,-1.8 2,-0.3 -4,-0.2 -42,-0.1 -0.474 55.3-145.6 -62.0 135.7 51.4 23.3 52.4 437 207 B S > - 0 0 47 -44,-0.2 4,-2.3 -2,-0.1 7,-0.1 -0.740 20.2-117.5-103.4 158.9 51.8 20.8 55.3 438 208 B E T 4 S+ 0 0 199 -2,-0.3 4,-0.4 1,-0.2 -1,-0.1 0.912 116.9 45.8 -59.6 -40.2 52.2 17.0 55.2 439 209 B E T 4 S+ 0 0 177 1,-0.2 4,-0.3 2,-0.1 -1,-0.2 0.850 123.5 31.1 -67.4 -43.2 48.9 16.7 57.2 440 210 B S T > S+ 0 0 30 1,-0.1 4,-2.9 2,-0.1 5,-0.4 0.489 88.2 102.0 -98.2 -5.1 46.8 19.3 55.2 441 211 B Y H X S+ 0 0 119 -4,-2.3 4,-2.6 1,-0.2 5,-0.3 0.913 86.0 43.4 -43.9 -60.3 48.4 18.9 51.8 442 212 B K H > S+ 0 0 173 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.905 116.6 44.6 -56.5 -49.9 45.5 16.8 50.4 443 213 B D H > S+ 0 0 72 -4,-0.3 4,-2.3 2,-0.2 5,-0.2 0.942 115.5 47.6 -60.6 -48.8 42.7 18.8 51.8 444 214 B S H X S+ 0 0 1 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.937 112.4 49.2 -58.4 -49.6 44.2 22.2 50.8 445 215 B T H X S+ 0 0 51 -4,-2.6 4,-2.0 -5,-0.4 -1,-0.2 0.876 110.6 49.9 -59.8 -43.5 44.9 21.0 47.3 446 216 B L H X S+ 0 0 80 -4,-2.0 4,-1.7 -5,-0.3 -1,-0.2 0.922 112.2 47.1 -59.5 -49.6 41.4 19.6 46.8 447 217 B I H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.926 108.2 55.9 -62.7 -40.2 39.8 22.8 48.0 448 218 B M H X S+ 0 0 12 -4,-2.7 4,-2.1 1,-0.3 -1,-0.2 0.951 109.2 47.5 -58.5 -43.3 42.1 25.0 45.8 449 219 B Q H X S+ 0 0 96 -4,-2.0 4,-2.3 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