==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 27-OCT-06 2NPM . COMPND 2 MOLECULE: 14-3-3 DOMAIN CONTAINING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CRYPTOSPORIDIUM PARVUM; . AUTHOR A.DONG,J.LEW,G.WASNEY,H.REN,L.LIN,A.HASSANALI,W.QIU,Y.ZHAO,D . 484 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23433.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 399 82.4 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 . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 347 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.1 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 0 0 0 0 0 0 0 1 1 0 5 0 2 1 0 2 2 0 0 0 0 0 0 0 4 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 21 A M >> 0 0 123 0, 0.0 4,-1.4 0, 0.0 3,-0.7 0.000 360.0 360.0 360.0 4.9 -1.6 7.2 14.6 2 22 A S H 3> + 0 0 108 1,-0.3 4,-1.5 2,-0.2 5,-0.1 0.851 360.0 55.4 -62.4 -34.8 0.3 4.5 16.6 3 23 A D H 3> S+ 0 0 110 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.715 104.4 56.1 -68.0 -21.4 3.5 6.2 15.3 4 24 A S H <> S+ 0 0 59 -3,-0.7 4,-1.6 2,-0.2 -2,-0.2 0.823 101.9 52.7 -82.0 -35.9 2.1 9.4 16.9 5 25 A V H X S+ 0 0 70 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.913 113.7 44.8 -62.4 -43.8 1.7 8.0 20.4 6 26 A N H X S+ 0 0 59 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.908 109.0 54.8 -66.9 -45.0 5.3 6.8 20.4 7 27 A A H X S+ 0 0 50 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.875 111.7 46.5 -59.6 -36.8 6.7 10.1 18.9 8 28 A R H X S+ 0 0 9 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.948 111.6 48.5 -69.9 -48.7 5.1 11.9 21.7 9 29 A E H X S+ 0 0 67 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.847 113.1 51.7 -57.5 -34.7 6.3 9.5 24.5 10 30 A S H X S+ 0 0 38 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.906 108.0 47.7 -70.6 -45.8 9.8 9.8 22.9 11 31 A N H X S+ 0 0 32 -4,-2.0 4,-3.3 2,-0.2 -2,-0.2 0.881 111.2 52.7 -64.3 -36.1 9.9 13.6 22.9 12 32 A V H X S+ 0 0 12 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.930 109.3 49.4 -62.7 -47.0 8.7 13.7 26.5 13 33 A Y H X S+ 0 0 55 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.918 114.6 44.6 -55.7 -46.7 11.5 11.3 27.4 14 34 A M H X S+ 0 0 8 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.882 109.5 55.1 -69.8 -39.6 14.0 13.5 25.6 15 35 A A H X S+ 0 0 0 -4,-3.3 4,-1.6 1,-0.2 -2,-0.2 0.946 111.1 46.4 -54.1 -45.3 12.6 16.7 27.2 16 36 A K H X S+ 0 0 73 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.865 113.1 48.6 -66.9 -35.5 13.2 15.0 30.6 17 37 A L H X S+ 0 0 1 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.883 108.7 52.3 -69.7 -42.1 16.7 13.9 29.7 18 38 A A H <>S+ 0 0 0 -4,-2.8 5,-2.8 2,-0.2 4,-0.3 0.830 108.7 52.9 -61.2 -34.3 17.6 17.4 28.4 19 39 A E H ><5S+ 0 0 63 -4,-1.6 3,-1.5 -5,-0.2 -2,-0.2 0.964 109.0 46.6 -67.9 -51.7 16.4 18.8 31.7 20 40 A Q H 3<5S+ 0 0 102 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.843 114.7 49.0 -54.4 -38.3 18.6 16.4 33.7 21 41 A A T 3<5S- 0 0 1 -4,-2.4 -1,-0.3 2,-0.1 -2,-0.2 0.500 110.9-128.6 -76.8 -9.8 21.5 17.4 31.3 22 42 A E T < 5 + 0 0 120 -3,-1.5 2,-0.7 -4,-0.3 -3,-0.2 0.845 65.5 135.3 61.4 36.8 20.6 21.1 31.9 23 43 A R >< + 0 0 29 -5,-2.8 4,-1.4 1,-0.1 -1,-0.2 -0.867 24.0 169.1-113.2 87.2 20.4 21.8 28.2 24 44 A Y H > + 0 0 58 -2,-0.7 4,-2.9 2,-0.2 34,-0.2 0.777 66.4 61.8 -79.8 -33.7 17.2 23.8 28.2 25 45 A D H > S+ 0 0 82 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.951 112.1 41.7 -54.8 -49.3 17.1 25.3 24.7 26 46 A E H > S+ 0 0 36 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.835 111.3 56.2 -68.1 -34.2 17.0 21.6 23.5 27 47 A M H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.943 107.8 49.3 -57.9 -45.8 14.5 20.8 26.2 28 48 A A H X S+ 0 0 5 -4,-2.9 4,-2.1 26,-0.3 -2,-0.2 0.937 109.4 51.4 -58.4 -50.6 12.2 23.6 24.9 29 49 A K H X S+ 0 0 46 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.799 107.9 51.9 -56.1 -39.8 12.5 22.3 21.3 30 50 A Y H X S+ 0 0 50 -4,-1.9 4,-0.8 2,-0.2 -1,-0.2 0.911 113.7 43.8 -63.8 -44.1 11.5 18.7 22.3 31 51 A M H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.781 109.8 56.8 -71.5 -29.7 8.4 20.1 24.1 32 52 A K H X S+ 0 0 41 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.888 104.5 51.8 -66.9 -39.6 7.7 22.4 21.1 33 53 A D H X S+ 0 0 78 -4,-1.8 4,-0.6 1,-0.2 -1,-0.2 0.741 107.1 54.5 -69.9 -23.2 7.6 19.4 18.8 34 54 A V H < S+ 0 0 2 -4,-0.8 -1,-0.2 2,-0.1 -2,-0.2 0.889 113.1 42.7 -70.5 -42.3 5.1 17.8 21.2 35 55 A V H < S+ 0 0 4 -4,-1.7 3,-0.5 1,-0.2 -2,-0.2 0.990 112.1 50.0 -68.1 -60.6 2.9 20.9 20.9 36 56 A E H < S+ 0 0 96 -4,-3.0 2,-0.3 1,-0.3 -1,-0.2 0.674 111.2 53.0 -56.7 -19.4 3.2 21.5 17.1 37 57 A A S < S+ 0 0 77 -4,-0.6 2,-0.3 -5,-0.2 -1,-0.3 -0.519 88.2 110.2-116.3 64.2 2.3 17.8 16.5 38 58 A R - 0 0 107 -3,-0.5 2,-0.4 -2,-0.3 -3,-0.0 -0.917 60.9-115.8-137.3 159.3 -1.0 17.2 18.5 39 59 A Q 0 0 81 -2,-0.3 -2,-0.0 3,-0.1 0, 0.0 -0.818 360.0 360.0 -97.7 134.9 -4.8 16.6 18.1 40 60 A E 0 0 120 -2,-0.4 78,-0.0 78,-0.0 77,-0.0 -0.370 360.0 360.0 -71.9 360.0 -7.4 19.1 19.4 41 ! 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 42 63 A E 0 0 89 0, 0.0 -3,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 126.5 -4.6 18.9 25.0 43 64 A L - 0 0 18 1,-0.1 2,-0.1 71,-0.1 -5,-0.0 -0.352 360.0-113.0 -63.7 153.4 -1.2 18.3 26.6 44 65 A T > - 0 0 72 1,-0.1 4,-2.6 -2,-0.0 5,-0.2 -0.303 30.0 -98.8 -81.0 176.1 -1.3 16.5 29.9 45 66 A V H > S+ 0 0 88 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.922 124.1 52.9 -59.1 -44.6 -0.4 18.1 33.2 46 67 A E H > S+ 0 0 100 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.902 113.6 40.9 -58.0 -44.5 3.1 16.6 33.0 47 68 A E H > S+ 0 0 12 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.927 111.0 55.4 -73.4 -47.8 3.8 17.9 29.5 48 69 A R H X S+ 0 0 19 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.930 111.4 47.0 -48.4 -47.6 2.3 21.3 30.1 49 70 A N H X S+ 0 0 72 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.870 110.5 50.2 -67.6 -39.1 4.7 21.6 33.1 50 71 A L H X S+ 0 0 12 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.896 109.6 53.0 -62.7 -40.3 7.7 20.4 31.1 51 72 A L H X S+ 0 0 0 -4,-3.4 4,-2.4 1,-0.2 5,-0.3 0.955 111.7 44.7 -60.5 -46.5 6.9 23.0 28.5 52 73 A S H X S+ 0 0 26 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.889 112.9 49.4 -65.2 -45.4 6.8 25.8 31.0 53 74 A V H X S+ 0 0 50 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.932 111.4 51.9 -57.1 -47.6 10.0 24.7 32.8 54 75 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -26,-0.3 0.955 115.9 37.0 -55.4 -58.9 11.8 24.5 29.5 55 76 A Y H X S+ 0 0 3 -4,-2.4 4,-2.8 1,-0.2 5,-0.4 0.918 113.8 58.1 -63.1 -40.9 10.8 28.0 28.2 56 77 A K H X S+ 0 0 42 -4,-2.8 4,-2.0 -5,-0.3 -1,-0.2 0.897 113.0 38.3 -56.0 -46.4 11.2 29.5 31.7 57 78 A N H X S+ 0 0 63 -4,-2.5 4,-2.0 2,-0.2 5,-0.3 0.902 113.2 55.8 -73.3 -42.3 14.8 28.3 32.0 58 79 A A H X S+ 0 0 2 -4,-2.6 4,-0.9 -5,-0.3 -2,-0.2 0.943 119.6 32.9 -49.2 -52.6 15.7 29.1 28.3 59 80 A V H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.842 110.8 67.6 -75.8 -33.3 14.5 32.6 28.8 60 81 A G H X S+ 0 0 24 -4,-2.0 4,-2.4 -5,-0.4 -2,-0.2 0.876 99.9 47.3 -58.2 -41.5 15.6 32.8 32.5 61 82 A S H X S+ 0 0 69 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.916 113.3 48.3 -73.8 -36.7 19.4 32.6 31.7 62 83 A R H X S+ 0 0 30 -4,-0.9 4,-2.7 -5,-0.3 -2,-0.2 0.899 111.2 51.8 -66.3 -35.4 19.1 35.3 29.0 63 84 A R H X S+ 0 0 13 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.955 109.2 49.9 -64.3 -42.6 17.0 37.5 31.5 64 85 A S H X S+ 0 0 47 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.910 112.1 47.3 -64.6 -39.6 19.7 37.1 34.1 65 86 A S H X S+ 0 0 6 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.922 107.6 56.3 -65.3 -47.1 22.4 38.1 31.6 66 87 A W H X S+ 0 0 51 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.900 107.3 50.2 -47.7 -44.6 20.5 41.1 30.3 67 88 A R H X S+ 0 0 127 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.925 111.9 45.5 -67.3 -46.1 20.3 42.5 33.9 68 89 A I H X S+ 0 0 50 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.917 114.5 48.5 -61.8 -47.3 24.0 42.1 34.5 69 90 A I H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 -2,-0.2 0.951 111.2 50.1 -62.7 -46.9 24.9 43.6 31.2 70 91 A S H X S+ 0 0 6 -4,-2.9 4,-1.9 -5,-0.3 -1,-0.2 0.875 108.2 54.3 -58.5 -34.7 22.5 46.6 31.7 71 92 A S H X S+ 0 0 72 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.949 110.9 43.7 -65.9 -44.4 24.0 47.2 35.1 72 93 A V H X S+ 0 0 21 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.887 108.8 58.7 -64.6 -41.2 27.5 47.4 33.7 73 94 A E H X S+ 0 0 39 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.897 110.4 43.8 -52.3 -42.8 26.3 49.6 30.8 74 95 A Q H X S+ 0 0 125 -4,-1.9 4,-3.4 2,-0.2 5,-0.2 0.930 108.0 54.4 -76.0 -45.1 25.0 52.1 33.4 75 96 A K H < S+ 0 0 63 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.921 113.0 48.1 -51.4 -45.2 28.1 52.1 35.7 76 97 A E H ><>S+ 0 0 39 -4,-2.5 3,-2.3 2,-0.2 5,-1.7 0.969 109.8 48.4 -56.5 -60.4 30.0 52.9 32.5 77 98 A H H ><5S+ 0 0 148 -4,-2.4 3,-1.9 1,-0.3 -2,-0.2 0.928 111.8 52.3 -46.6 -47.5 27.6 55.7 31.4 78 99 A S T 3<5S+ 0 0 87 -4,-3.4 -1,-0.3 1,-0.3 -2,-0.2 0.628 108.7 51.0 -64.2 -14.5 27.9 57.1 35.0 79 100 A R T < 5S- 0 0 69 -3,-2.3 -1,-0.3 -4,-0.4 -2,-0.2 0.285 112.1-117.9-106.5 9.5 31.7 57.0 34.6 80 101 A N T < 5S+ 0 0 157 -3,-1.9 2,-1.3 -4,-0.3 -3,-0.2 0.686 70.4 139.6 55.4 22.7 31.7 58.9 31.3 81 102 A A >< + 0 0 33 -5,-1.7 4,-2.1 1,-0.2 -1,-0.2 -0.684 21.2 167.8 -92.7 79.6 33.3 55.9 29.7 82 103 A E H > + 0 0 69 -2,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.835 66.6 55.0 -68.5 -38.8 31.2 56.2 26.5 83 104 A D H > S+ 0 0 138 2,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.957 111.0 45.2 -57.3 -55.8 33.1 53.7 24.3 84 105 A A H > S+ 0 0 14 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.912 111.2 53.3 -57.4 -50.6 32.7 50.9 26.9 85 106 A S H X S+ 0 0 13 -4,-2.1 4,-3.5 1,-0.2 -1,-0.2 0.916 106.2 52.6 -48.0 -49.0 29.0 51.7 27.4 86 107 A K H X S+ 0 0 67 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.903 110.6 48.4 -63.1 -38.6 28.3 51.5 23.7 87 108 A M H X S+ 0 0 62 -4,-1.8 4,-2.9 2,-0.3 -1,-0.2 0.925 111.3 48.2 -61.8 -52.2 29.9 48.0 23.6 88 109 A C H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.935 111.2 54.6 -49.1 -49.2 27.9 46.9 26.6 89 110 A G H X S+ 0 0 8 -4,-3.5 4,-1.7 2,-0.2 -2,-0.3 0.915 108.0 46.4 -50.1 -52.2 25.0 48.4 24.7 90 111 A K H X S+ 0 0 67 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.925 112.1 51.7 -62.4 -39.3 25.7 46.3 21.6 91 112 A Y H X S+ 0 0 5 -4,-2.9 4,-1.3 1,-0.2 -2,-0.2 0.906 106.9 53.4 -64.9 -38.6 26.1 43.2 23.8 92 113 A R H X S+ 0 0 54 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.840 105.2 55.2 -61.8 -36.0 22.7 43.8 25.5 93 114 A S H X S+ 0 0 59 -4,-1.7 4,-2.8 1,-0.2 -1,-0.2 0.901 101.5 57.4 -64.6 -39.6 21.1 44.0 22.1 94 115 A K H X S+ 0 0 103 -4,-1.6 4,-1.2 1,-0.2 -1,-0.2 0.886 109.8 44.2 -59.2 -40.3 22.4 40.6 21.1 95 116 A V H X S+ 0 0 0 -4,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.865 109.8 56.6 -74.2 -36.1 20.7 39.0 24.2 96 117 A E H X S+ 0 0 33 -4,-2.0 4,-3.0 1,-0.2 -2,-0.2 0.927 103.0 54.2 -60.2 -43.4 17.6 41.0 23.5 97 118 A A H X S+ 0 0 56 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.856 109.6 48.2 -59.8 -34.9 17.4 39.5 20.0 98 119 A E H X S+ 0 0 54 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.927 111.5 49.6 -69.7 -48.3 17.6 36.0 21.7 99 120 A L H X S+ 0 0 2 -4,-2.6 4,-2.9 2,-0.2 5,-0.4 0.929 108.8 52.7 -50.8 -53.7 14.8 36.9 24.2 100 121 A T H X S+ 0 0 47 -4,-3.0 4,-2.5 1,-0.2 5,-0.2 0.951 111.1 46.7 -51.4 -51.2 12.6 38.2 21.4 101 122 A D H X S+ 0 0 113 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.868 114.7 46.1 -60.1 -39.9 12.9 34.9 19.4 102 123 A I H X S+ 0 0 22 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.915 114.4 45.7 -73.0 -46.3 12.3 32.7 22.5 103 124 A C H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.888 114.5 49.3 -60.8 -40.7 9.3 34.6 23.8 104 125 A N H X S+ 0 0 70 -4,-2.5 4,-2.1 -5,-0.4 -2,-0.2 0.882 107.0 56.5 -70.9 -35.9 7.8 34.8 20.3 105 126 A D H X S+ 0 0 46 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.955 113.6 37.9 -52.8 -56.3 8.3 31.1 19.8 106 127 A I H X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.825 114.8 54.7 -72.3 -30.2 6.3 30.2 22.9 107 128 A L H X S+ 0 0 6 -4,-2.3 4,-3.0 2,-0.2 -1,-0.2 0.839 105.4 53.1 -71.2 -32.9 3.7 32.9 22.3 108 129 A T H X S+ 0 0 85 -4,-2.1 4,-3.0 2,-0.2 5,-0.5 0.955 110.3 47.6 -65.5 -48.1 3.0 31.7 18.8 109 130 A M H X>S+ 0 0 1 -4,-1.7 5,-2.6 1,-0.2 4,-1.8 0.873 114.2 48.1 -57.2 -39.5 2.4 28.2 20.3 110 131 A L H <>S+ 0 0 0 -4,-1.9 5,-2.6 3,-0.2 -2,-0.2 0.969 116.4 41.6 -67.0 -48.9 0.2 29.7 22.9 111 132 A D H <5S+ 0 0 81 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.887 127.5 28.2 -66.9 -46.5 -1.8 31.8 20.4 112 133 A K H <5S+ 0 0 69 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.784 136.8 14.3 -89.8 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4,-2.5 2,-0.2 5,-0.3 0.912 109.6 50.9 -56.9 -46.8 33.3 18.4 23.3 344 121 B T H X S+ 0 0 48 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.937 111.8 47.5 -57.5 -49.6 35.5 17.3 20.4 345 122 B D H X S+ 0 0 115 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.932 114.4 44.6 -55.1 -53.0 35.1 20.8 18.7 346 123 B I H X S+ 0 0 22 -4,-2.6 4,-1.9 1,-0.2 5,-0.2 0.927 115.7 46.9 -66.0 -42.7 35.8 22.8 21.8 347 124 B C H X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.891 112.2 49.7 -63.3 -39.9 38.8 20.7 22.8 348 125 B N H X S+ 0 0 76 -4,-2.5 4,-2.4 -5,-0.3 -1,-0.2 0.896 107.9 56.1 -67.7 -35.4 40.3 20.7 19.3 349 126 B D H X S+ 0 0 43 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.944 112.3 38.7 -59.3 -54.9 39.9 24.5 19.2 350 127 B I H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.912 114.7 54.3 -68.1 -38.4 41.9 25.2 22.3 351 128 B L H X S+ 0 0 8 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.880 106.2 52.0 -64.0 -39.4 44.5 22.5 21.6 352 129 B T H X S+ 0 0 84 -4,-2.4 4,-3.0 2,-0.2 5,-0.5 0.920 109.4 50.9 -56.0 -46.4 45.2 24.0 18.1 353 130 B M H X>S+ 0 0 0 -4,-1.8 5,-2.6 1,-0.2 4,-1.9 0.877 112.7 46.2 -63.3 -37.7 45.7 27.4 19.8 354 131 B L H <>S+ 0 0 0 -4,-2.2 5,-2.3 3,-0.2 -2,-0.2 0.901 116.6 43.4 -66.8 -46.8 48.2 25.7 22.2 355 132 B D H <5S+ 0 0 83 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.943 127.3 29.3 -64.7 -47.6 50.1 23.8 19.5 356 133 B K H <5S+ 0 0 63 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.827 138.3 8.3 -85.1 -36.9 50.2 26.7 16.9 357 134 B H T X5S+ 0 0 67 -4,-1.9 4,-0.9 -5,-0.5 -3,-0.2 0.816 121.6 42.5-116.8 -46.7 50.3 29.8 19.1 358 135 B L H >4 S- 0 0 45 1,-0.1 4,-2.2 4,-0.0 5,-0.2 -0.184 82.0-115.1 -68.1 154.4 59.2 31.9 31.5 365 142 B P H > S+ 0 0 54 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.909 116.6 58.9 -49.3 -46.0 59.0 28.7 33.5 366 143 B D H > S+ 0 0 59 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.924 108.5 41.3 -42.0 -61.6 55.6 29.9 34.6 367 144 B S H > S+ 0 0 11 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.910 113.0 52.0 -64.5 -46.3 54.1 30.1 31.1 368 145 B K H X S+ 0 0 80 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.935 113.9 43.3 -59.1 -49.0 55.6 26.9 29.7 369 146 B V H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.936 113.9 53.8 -59.4 -43.3 54.3 24.9 32.7 370 147 B F H X S+ 0 0 29 -4,-2.5 4,-1.8 -5,-0.3 -2,-0.2 0.948 115.2 36.9 -59.5 -49.4 51.0 26.7 32.4 371 148 B Y H X S+ 0 0 6 -4,-3.2 4,-2.1 2,-0.2 -1,-0.2 0.857 113.7 55.0 -76.6 -33.4 50.4 25.9 28.7 372 149 B F H X S+ 0 0 40 -4,-2.6 4,-1.9 -5,-0.3 -1,-0.2 0.877 109.6 50.0 -63.0 -37.1 51.9 22.4 28.8 373 150 B K H X S+ 0 0 22 -4,-2.3 4,-2.8 -5,-0.3 -2,-0.2 0.906 106.9 54.2 -65.5 -44.7 49.4 21.6 31.6 374 151 B M H X S+ 0 0 4 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.950 107.7 49.9 -55.4 -51.9 46.5 23.0 29.5 375 152 B K H X S+ 0 0 31 -4,-2.1 4,-2.5 1,-0.2 5,-0.3 0.937 111.0 49.2 -52.4 -49.5 47.3 20.8 26.6 376 153 B G H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.935 111.3 51.7 -57.7 -43.5 47.4 17.7 28.9 377 154 B D H X S+ 0 0 8 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.909 110.7 45.4 -57.9 -46.7 44.1 18.8 30.4 378 155 B Y H X S+ 0 0 2 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.924 112.6 49.7 -75.1 -37.3 42.3 19.1 27.0 379 156 B H H X S+ 0 0 14 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.880 110.9 53.4 -56.6 -41.1 43.7 15.8 25.7 380 157 B R H X S+ 0 0 1 -4,-2.3 4,-1.4 -5,-0.3 -2,-0.2 0.931 105.5 52.0 -59.8 -46.2 42.5 14.3 29.0 381 158 B Y H >X S+ 0 0 2 -4,-2.6 4,-0.8 1,-0.2 3,-0.7 0.934 110.9 47.5 -59.4 -41.8 39.0 15.7 28.4 382 159 B I H >X S+ 0 0 17 -4,-2.2 4,-1.7 1,-0.2 3,-0.7 0.929 109.5 55.1 -62.7 -41.0 38.9 14.1 25.0 383 160 B S H 3< S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.694 93.8 71.0 -59.8 -25.5 40.2 10.9 26.7 384 161 B E H << S+ 0 0 43 -4,-1.4 -1,-0.2 -3,-0.7 -2,-0.2 0.911 115.6 18.8 -64.0 -41.0 37.3 10.9 29.1 385 162 B F H << S+ 0 0 18 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.578 102.4 105.6-104.4 -14.5 34.7 10.0 26.4 386 163 B S < - 0 0 20 -4,-1.7 2,-0.2 -5,-0.2 -3,-0.0 -0.221 50.4-156.9 -68.8 164.7 36.8 8.5 23.6 387 164 B T >> - 0 0 113 4,-0.0 4,-1.8 0, 0.0 3,-1.2 -0.785 48.7 -10.6-134.7 163.6 37.1 4.8 22.8 388 165 B G H 3> S- 0 0 52 -2,-0.2 4,-1.5 1,-0.2 -2,-0.0 -0.074 128.8 -4.1 51.8-119.9 39.6 2.4 21.1 389 166 B D H 3> S+ 0 0 143 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.722 129.8 61.1 -85.9 -27.0 42.3 4.3 19.3 390 167 B S H <> S+ 0 0 77 -3,-1.2 4,-2.8 2,-0.2 5,-0.4 0.959 107.5 48.9 -54.9 -50.4 41.1 7.9 19.9 391 168 B K H X S+ 0 0 88 -4,-1.8 4,-3.0 1,-0.2 -2,-0.2 0.929 111.1 47.6 -58.2 -50.0 41.5 7.1 23.6 392 169 B Q H X S+ 0 0 143 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.909 114.6 48.3 -54.6 -46.0 45.0 5.7 23.2 393 170 B S H X S+ 0 0 70 -4,-2.3 4,-2.1 2,-0.2 5,-0.2 0.940 115.6 40.0 -62.4 -55.3 46.0 8.7 21.0 394 171 B S H X S+ 0 0 8 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.912 113.8 56.2 -67.2 -38.0 44.7 11.4 23.3 395 172 B A H X S+ 0 0 9 -4,-3.0 4,-2.2 -5,-0.4 -2,-0.2 0.924 108.9 47.9 -54.8 -43.1 46.0 9.5 26.3 396 173 B E H X S+ 0 0 52 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.876 112.4 47.3 -70.0 -36.1 49.5 9.5 24.8 397 174 B D H X S+ 0 0 67 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.860 112.4 49.5 -74.4 -33.4 49.4 13.3 24.0 398 175 B A H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.2 5,-0.2 0.965 110.9 50.1 -66.0 -46.2 48.1 14.2 27.5 399 176 B L H X S+ 0 0 46 -4,-2.2 4,-2.3 -5,-0.3 -2,-0.2 0.916 112.6 46.5 -55.9 -47.9 50.8 12.0 29.1 400 177 B K H X S+ 0 0 124 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.909 111.4 51.6 -63.1 -45.7 53.5 13.7 27.0 401 178 B A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.861 111.8 46.1 -58.5 -41.2 52.2 17.2 27.7 402 179 B Y H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.872 113.1 50.2 -70.9 -36.8 52.1 16.5 31.5 403 180 B K H X S+ 0 0 123 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.917 111.4 48.4 -61.3 -50.1 55.7 15.0 31.3 404 181 B D H X S+ 0 0 47 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.886 113.9 47.0 -58.0 -40.8 56.9 18.1 29.4 405 182 B A H X S+ 0 0 0 -4,-2.0 4,-2.6 -5,-0.2 -2,-0.2 0.883 110.2 53.3 -70.1 -35.2 55.2 20.2 32.0 406 183 B T H X S+ 0 0 64 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.929 104.7 55.3 -65.2 -43.6 56.7 18.1 34.7 407 184 B V H < S+ 0 0 112 -4,-2.8 3,-0.5 1,-0.2 -1,-0.2 0.928 113.6 39.9 -54.3 -50.2 60.2 18.6 33.3 408 185 B V H >< S+ 0 0 22 -4,-1.7 3,-2.5 1,-0.2 -1,-0.2 0.919 105.5 66.7 -66.9 -41.6 59.8 22.4 33.4 409 186 B A H >< S+ 0 0 4 -4,-2.6 3,-2.8 1,-0.3 -1,-0.2 0.732 79.4 78.4 -55.2 -29.7 58.1 22.5 36.8 410 187 B K T 3< S+ 0 0 70 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.1 0.700 86.9 63.7 -51.8 -17.0 61.2 21.3 38.5 411 188 B D T < S+ 0 0 128 -3,-2.5 2,-0.3 -4,-0.1 -1,-0.3 0.360 92.8 77.6 -88.1 2.0 62.3 25.0 38.1 412 189 B L S < S- 0 0 14 -3,-2.8 0, 0.0 -47,-0.1 0, 0.0 -0.838 95.9 -97.2-110.8 151.9 59.5 26.1 40.4 413 190 B E > - 0 0 132 -2,-0.3 3,-2.4 1,-0.1 6,-0.2 -0.339 36.6-113.0 -65.1 145.6 59.5 25.8 44.2 414 191 B P T 3 S+ 0 0 18 0, 0.0 37,-0.1 0, 0.0 -1,-0.1 0.656 119.0 50.1 -54.3 -16.1 57.6 22.7 45.5 415 192 B T T 3 S+ 0 0 9 35,-0.1 55,-0.1 39,-0.1 -2,-0.1 0.375 77.5 124.2-103.0 0.8 54.9 25.1 46.9 416 193 B H X> - 0 0 51 -3,-2.4 4,-2.0 1,-0.2 3,-1.0 -0.470 64.3-134.9 -63.5 124.4 54.4 27.1 43.7 417 194 B P H 3> S+ 0 0 46 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.840 103.8 53.9 -52.2 -36.4 50.7 26.9 43.0 418 195 B I H 3> S+ 0 0 29 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.843 109.4 48.7 -68.8 -30.1 51.3 26.2 39.3 419 196 B R H <> S+ 0 0 63 -3,-1.0 4,-1.5 -6,-0.2 -1,-0.2 0.880 112.6 47.6 -74.3 -39.8 53.5 23.3 40.2 420 197 B L H X S+ 0 0 1 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.909 108.7 54.0 -65.0 -44.5 51.0 21.9 42.6 421 198 B G H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.886 106.0 53.5 -62.9 -38.8 48.1 22.2 40.2 422 199 B L H X S+ 0 0 5 -4,-1.4 4,-3.7 1,-0.2 5,-0.3 0.936 109.7 47.0 -58.8 -44.7 50.0 20.2 37.6 423 200 B A H X S+ 0 0 13 -4,-1.5 4,-2.7 2,-0.2 5,-0.2 0.880 110.4 54.5 -67.4 -35.9 50.6 17.4 40.1 424 201 B L H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.985 117.9 32.8 -58.4 -61.2 46.9 17.5 41.0 425 202 B N H X S+ 0 0 1 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.890 117.0 56.0 -65.8 -42.3 45.7 17.1 37.4 426 203 B F H X S+ 0 0 11 -4,-3.7 4,-2.1 -5,-0.3 -1,-0.2 0.939 110.0 46.3 -56.9 -42.8 48.6 14.9 36.3 427 204 B S H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.894 111.1 52.0 -69.8 -35.7 47.7 12.5 39.2 428 205 B V H X S+ 0 0 0 -4,-1.8 4,-3.0 -5,-0.2 5,-0.5 0.955 107.2 53.4 -61.0 -48.2 44.1 12.6 38.2 429 206 B F H X>S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 5,-1.5 0.925 109.1 49.1 -46.9 -52.7 45.0 11.7 34.7 430 207 B H H <5S+ 0 0 18 -4,-2.1 6,-2.3 -5,-0.2 5,-0.4 0.899 116.6 41.1 -58.2 -44.9 47.0 8.7 35.9 431 208 B Y H <5S+ 0 0 75 -4,-2.1 4,-0.2 4,-0.2 -2,-0.2 0.958 124.4 31.1 -72.7 -52.9 44.2 7.4 38.0 432 209 B E H <5S+ 0 0 77 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.832 131.3 25.9 -79.1 -33.9 41.1 8.0 35.8 433 210 B I T <5S+ 0 0 19 -4,-2.1 -3,-0.2 -5,-0.5 -2,-0.1 0.907 130.8 32.8 -99.1 -55.2 42.4 7.6 32.3 434 211 B L S + 0 0 89 -6,-2.3 4,-1.7 1,-0.1 -1,-0.2 -0.755 22.8 173.7-120.8 79.3 47.3 3.3 37.2 437 214 B P H > S+ 0 0 58 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.862 73.9 56.1 -59.5 -33.9 46.3 3.9 40.8 438 215 B R H > S+ 0 0 160 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.939 108.4 45.4 -65.7 -45.6 49.8 3.4 42.2 439 216 B A H > S+ 0 0 18 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.833 113.7 51.4 -70.8 -28.4 51.5 6.1 40.1 440 217 B A H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 5,-0.3 0.957 110.4 47.6 -65.1 -53.1 48.6 8.5 40.9 441 218 B I H X S+ 0 0 36 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 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