==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-FEB-12 4DWT . COMPND 2 MOLECULE: DEHALOPEROXIDASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: AMPHITRITE ORNATA; . AUTHOR V.S.DE SERRANO,J.ZHAO,S.FRANZEN . 274 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14609.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 206 75.2 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 . 4 1.5 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 . 2 0.7 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 . 5 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 157 57.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 1 0 1 2 1 0 0 0 0 2 0 4 0 0 2 0 0 0 0 0 0 0 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 . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 G > 0 0 62 0, 0.0 4,-2.4 0, 0.0 115,-0.3 0.000 360.0 360.0 360.0-163.0 15.1 21.5 13.4 2 2 A F H > + 0 0 27 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.877 360.0 52.6 -59.4 -42.5 13.6 18.3 11.9 3 3 A K H > S+ 0 0 122 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.864 110.1 47.5 -65.2 -39.2 17.0 17.4 10.2 4 4 A Q H > S+ 0 0 108 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.907 107.1 58.3 -64.6 -43.7 18.9 17.8 13.5 5 5 A D H X S+ 0 0 2 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.861 101.8 54.1 -54.6 -39.2 16.3 15.6 15.2 6 6 A I H X S+ 0 0 0 -4,-1.6 4,-3.2 1,-0.2 -1,-0.2 0.945 111.1 45.8 -61.1 -46.6 17.0 12.8 12.8 7 7 A A H X S+ 0 0 49 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.868 111.3 52.4 -62.1 -39.9 20.7 13.0 13.7 8 8 A T H X S+ 0 0 18 -4,-2.7 4,-1.0 2,-0.2 -2,-0.2 0.956 115.4 41.2 -58.7 -51.6 19.8 13.2 17.5 9 9 A I H >< S+ 0 0 1 -4,-2.7 3,-0.6 1,-0.2 7,-0.3 0.915 114.8 50.5 -65.4 -46.6 17.7 10.1 17.2 10 10 A R H >< S+ 0 0 79 -4,-3.2 3,-1.1 1,-0.2 -1,-0.2 0.867 101.6 64.4 -57.5 -39.1 20.2 8.3 14.9 11 11 A G H 3< S+ 0 0 70 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.817 121.9 17.2 -56.4 -41.4 23.1 9.0 17.3 12 12 A D T + 0 0 19 -3,-1.1 4,-3.0 1,-0.2 5,-0.3 0.885 66.8 54.8 -63.7 -49.0 19.0 4.8 18.1 14 14 A R H > S+ 0 0 93 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.909 114.9 43.3 -54.2 -40.5 18.7 1.7 20.4 15 15 A T H > S+ 0 0 59 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.950 117.0 42.0 -75.1 -50.3 17.8 4.1 23.3 16 16 A Y H X S+ 0 0 34 -4,-2.4 4,-2.8 -7,-0.3 5,-0.4 0.887 114.0 53.4 -60.6 -40.3 15.4 6.5 21.5 17 17 A A H X S+ 0 0 0 -4,-3.0 4,-2.1 -5,-0.2 -2,-0.2 0.931 114.5 41.0 -63.5 -44.2 13.7 3.6 19.6 18 18 A Q H X S+ 0 0 20 -4,-1.7 4,-2.1 -5,-0.3 -1,-0.2 0.882 116.3 49.6 -68.7 -41.5 13.0 1.7 22.8 19 19 A D H X S+ 0 0 53 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.928 115.4 41.7 -66.7 -44.2 12.0 4.8 24.8 20 20 A I H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.933 114.2 51.8 -70.9 -45.5 9.5 6.2 22.1 21 21 A F H X S+ 0 0 8 -4,-2.1 4,-2.4 -5,-0.4 -2,-0.2 0.905 111.8 46.8 -55.8 -43.1 8.0 2.7 21.4 22 22 A L H X S+ 0 0 8 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.863 109.0 53.8 -69.8 -34.1 7.4 2.1 25.1 23 23 A A H X S+ 0 0 29 -4,-1.7 4,-2.1 -5,-0.2 5,-0.2 0.907 109.4 51.6 -64.8 -38.7 5.9 5.6 25.5 24 24 A F H X S+ 0 0 11 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.963 112.3 42.2 -57.3 -57.0 3.6 4.5 22.6 25 25 A L H < S+ 0 0 1 -4,-2.4 7,-0.3 1,-0.2 -2,-0.2 0.852 115.6 50.7 -64.0 -33.6 2.5 1.2 24.2 26 26 A N H < S+ 0 0 91 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.860 113.5 43.5 -74.7 -35.8 2.1 2.9 27.6 27 27 A K H < S+ 0 0 80 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.874 130.0 28.7 -71.9 -38.7 -0.0 5.7 26.3 28 28 A Y S >< S+ 0 0 50 -4,-2.7 3,-1.9 -5,-0.2 4,-0.3 -0.656 71.4 171.0-123.4 75.9 -2.0 3.3 24.2 29 29 A P G > S+ 0 0 92 0, 0.0 3,-1.1 0, 0.0 4,-0.3 0.702 73.3 67.1 -59.7 -28.4 -2.0 -0.0 26.0 30 30 A D G > S+ 0 0 104 1,-0.2 3,-1.4 2,-0.2 4,-0.1 0.789 89.0 69.4 -61.4 -28.8 -4.5 -1.6 23.7 31 31 A E G X S+ 0 0 6 -3,-1.9 3,-1.9 1,-0.3 4,-0.3 0.733 78.3 77.2 -65.2 -27.1 -1.9 -1.4 20.9 32 32 A R G X S+ 0 0 39 -3,-1.1 3,-2.3 -4,-0.3 6,-0.3 0.775 74.8 78.4 -52.4 -30.7 0.3 -4.1 22.6 33 33 A R G < S+ 0 0 123 -3,-1.4 3,-0.3 1,-0.3 -1,-0.3 0.731 87.0 60.4 -50.8 -25.3 -2.2 -6.7 21.2 34 34 A Y G < S+ 0 0 73 -3,-1.9 2,-0.5 1,-0.2 -1,-0.3 0.684 101.9 52.8 -77.3 -20.3 -0.4 -6.3 17.9 35 35 A F S X S- 0 0 66 -3,-2.3 3,-2.1 -4,-0.3 4,-0.4 -0.738 73.1-179.6-116.5 75.7 3.0 -7.3 19.4 36 36 A K G > S+ 0 0 158 -2,-0.5 3,-0.6 -3,-0.3 -1,-0.1 0.695 75.2 55.2 -55.0 -28.6 1.9 -10.7 21.0 37 37 A N G 3 S+ 0 0 112 1,-0.2 -1,-0.3 -3,-0.1 -4,-0.1 0.564 100.5 58.0 -88.8 -10.7 5.3 -11.5 22.4 38 38 A Y G X S+ 0 0 18 -3,-2.1 3,-1.0 -6,-0.3 -1,-0.2 0.421 79.4 117.9 -89.8 -6.9 5.6 -8.3 24.4 39 39 A V T < S+ 0 0 79 -3,-0.6 -3,-0.0 -4,-0.4 -6,-0.0 -0.379 78.4 13.8 -64.6 139.0 2.4 -9.0 26.3 40 40 A G T 3 S+ 0 0 74 1,-0.2 2,-0.4 -2,-0.0 -1,-0.2 0.764 98.3 118.7 64.2 36.1 2.9 -9.4 30.1 41 41 A K < - 0 0 76 -3,-1.0 -1,-0.2 3,-0.0 2,-0.1 -0.985 58.8-127.0-131.7 137.6 6.4 -8.0 30.3 42 42 A S >> - 0 0 61 -2,-0.4 4,-1.9 1,-0.1 3,-0.8 -0.361 37.3-100.9 -72.7 160.9 7.8 -4.9 32.2 43 43 A D H 3> S+ 0 0 63 1,-0.3 4,-1.2 2,-0.2 -1,-0.1 0.868 126.6 48.4 -44.2 -42.8 9.8 -2.2 30.4 44 44 A Q H 3> S+ 0 0 134 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.771 107.2 54.7 -75.3 -28.1 13.0 -3.8 31.9 45 45 A E H <4 S+ 0 0 108 -3,-0.8 3,-0.4 2,-0.2 4,-0.4 0.821 104.3 54.9 -73.0 -33.5 12.0 -7.4 30.8 46 46 A L H >< S+ 0 0 0 -4,-1.9 3,-1.2 1,-0.2 7,-0.3 0.871 101.9 57.6 -69.0 -37.2 11.5 -6.3 27.2 47 47 A K H 3< S+ 0 0 78 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.727 99.2 58.7 -65.4 -23.0 15.0 -4.9 27.0 48 48 A S T 3< S+ 0 0 104 -4,-0.6 2,-0.4 -3,-0.4 -1,-0.2 0.641 90.4 90.9 -80.3 -13.4 16.5 -8.3 28.0 49 49 A M S X> S- 0 0 51 -3,-1.2 4,-1.4 -4,-0.4 3,-0.6 -0.720 72.4-143.6 -89.5 131.8 14.8 -9.9 24.9 50 50 A A H 3> S+ 0 0 75 -2,-0.4 4,-2.0 1,-0.2 5,-0.1 0.855 97.0 47.4 -65.0 -43.8 16.8 -9.9 21.6 51 51 A K H 3> S+ 0 0 143 3,-0.2 4,-2.7 2,-0.2 5,-0.3 0.697 105.9 61.5 -74.4 -17.8 14.0 -9.3 19.1 52 52 A F H <> S+ 0 0 0 -3,-0.6 4,-1.8 -6,-0.3 5,-0.2 0.972 112.1 34.5 -69.5 -58.0 12.7 -6.3 21.2 53 53 A G H X S+ 0 0 4 -4,-1.4 4,-2.0 -7,-0.3 5,-0.2 0.952 125.4 45.6 -59.0 -46.0 15.8 -4.2 21.0 54 54 A D H X S+ 0 0 63 -4,-2.0 4,-1.8 -5,-0.2 -2,-0.2 0.918 115.8 41.4 -65.4 -51.7 16.5 -5.5 17.5 55 55 A H H X S+ 0 0 91 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.848 115.9 51.2 -69.6 -29.7 13.0 -5.2 15.9 56 56 A T H X S+ 0 0 2 -4,-1.8 4,-2.2 -5,-0.3 -2,-0.2 0.871 108.4 49.9 -77.7 -36.1 12.4 -1.8 17.6 57 57 A E H X S+ 0 0 58 -4,-2.0 4,-2.9 -5,-0.2 -1,-0.2 0.918 111.6 50.2 -59.8 -44.2 15.6 -0.3 16.3 58 58 A K H X S+ 0 0 141 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.882 106.8 54.8 -64.7 -41.2 14.7 -1.5 12.8 59 59 A V H X S+ 0 0 66 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.973 115.4 38.7 -49.5 -56.3 11.3 0.1 13.2 60 60 A F H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.791 108.4 61.6 -74.9 -26.3 12.9 3.4 13.9 61 61 A N H X S+ 0 0 76 -4,-2.9 4,-1.8 2,-0.2 -1,-0.2 0.960 109.4 43.8 -56.7 -49.1 15.7 3.0 11.4 62 62 A L H X S+ 0 0 44 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.910 110.6 54.3 -62.6 -46.1 13.1 2.8 8.7 63 63 A M H X S+ 0 0 19 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.896 109.1 48.7 -53.8 -43.6 11.2 5.8 10.2 64 64 A M H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.841 109.4 52.5 -66.1 -36.6 14.4 7.9 10.1 65 65 A E H X S+ 0 0 62 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.910 111.2 46.3 -60.4 -48.4 15.0 6.9 6.5 66 66 A V H X S+ 0 0 3 -4,-2.5 4,-0.9 1,-0.2 10,-0.3 0.909 114.2 49.4 -62.5 -44.0 11.4 8.0 5.6 67 67 A A H >< S+ 0 0 2 -4,-2.5 3,-0.6 -5,-0.2 -2,-0.2 0.906 110.6 49.4 -61.4 -43.0 12.0 11.2 7.5 68 68 A D H 3< S+ 0 0 61 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.851 110.5 50.3 -66.6 -33.0 15.3 11.8 5.8 69 69 A R H 3< S+ 0 0 103 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.599 93.0 100.8 -82.8 -12.6 13.8 11.3 2.4 70 70 A A << - 0 0 17 -4,-0.9 2,-0.5 -3,-0.6 3,-0.1 -0.308 65.7-141.0 -67.1 152.1 10.9 13.7 3.1 71 71 A T B > S-A 74 0A 54 3,-2.1 3,-1.9 1,-0.2 141,-0.1 -0.988 84.6 -14.4-114.3 125.2 10.9 17.3 1.8 72 72 A D T 3 S- 0 0 52 -2,-0.5 -1,-0.2 1,-0.3 140,-0.1 0.904 131.2 -53.9 50.0 44.0 9.4 19.9 4.3 73 73 A C T 3 S+ 0 0 5 -6,-0.2 -1,-0.3 1,-0.2 53,-0.2 0.570 110.1 126.4 67.4 14.4 8.0 16.9 6.3 74 74 A V B < -A 71 0A 26 -3,-1.9 -3,-2.1 136,-0.1 -1,-0.2 -0.907 52.8-143.3-104.1 114.1 6.2 15.4 3.3 75 75 A P - 0 0 11 0, 0.0 2,-0.1 0, 0.0 -5,-0.1 -0.361 24.2 -93.1 -78.3 157.5 7.2 11.8 2.8 76 76 A L > - 0 0 77 -10,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.424 24.8-131.1 -66.4 140.6 7.7 10.1 -0.5 77 77 A A H > S+ 0 0 79 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.882 110.1 57.8 -55.2 -41.0 4.7 8.2 -1.8 78 78 A S H > S+ 0 0 75 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.834 105.5 49.6 -60.5 -35.8 6.9 5.2 -2.5 79 79 A D H > S+ 0 0 10 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.866 109.1 50.8 -70.7 -41.3 7.9 5.1 1.3 80 80 A A H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.874 108.7 54.4 -59.4 -35.9 4.3 5.3 2.3 81 81 A N H X S+ 0 0 64 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.901 104.5 53.0 -66.3 -42.3 3.7 2.4 -0.1 82 82 A T H < S+ 0 0 53 -4,-1.6 4,-0.3 1,-0.2 -1,-0.2 0.923 108.2 50.0 -58.2 -48.9 6.4 0.3 1.6 83 83 A L H >< S+ 0 0 17 -4,-1.8 3,-0.5 1,-0.2 -1,-0.2 0.879 115.0 44.8 -60.9 -39.2 4.8 0.8 5.0 84 84 A V H 3< S+ 0 0 30 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.932 109.6 51.6 -65.1 -51.2 1.4 -0.3 3.7 85 85 A Q T 3< S+ 0 0 131 -4,-2.5 2,-0.4 -5,-0.1 -1,-0.2 0.242 84.0 118.3 -83.2 14.8 2.3 -3.3 1.6 86 86 A M X - 0 0 53 -3,-0.5 3,-2.0 -4,-0.3 4,-0.4 -0.688 68.3-132.6 -87.5 127.8 4.3 -5.1 4.4 87 87 A K G > S+ 0 0 186 -2,-0.4 3,-1.1 1,-0.3 4,-0.2 0.840 108.7 54.0 -37.8 -43.7 3.3 -8.5 5.9 88 88 A Q G 3 S+ 0 0 141 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.715 109.8 45.4 -72.0 -23.1 3.7 -7.0 9.4 89 89 A H G X S+ 0 0 47 -3,-2.0 3,-1.4 1,-0.2 -1,-0.2 0.229 78.2 110.7-103.9 13.2 1.3 -4.1 8.8 90 90 A S T < S+ 0 0 94 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.1 0.813 79.6 44.8 -59.7 -37.7 -1.5 -6.0 7.1 91 91 A S T 3 S+ 0 0 100 -3,-0.2 -1,-0.3 -4,-0.2 2,-0.1 0.446 95.5 110.7 -86.9 1.3 -4.0 -5.6 9.9 92 92 A L < - 0 0 35 -3,-1.4 45,-0.3 -8,-0.1 2,-0.3 -0.380 46.7-163.7 -87.1 153.7 -3.3 -1.9 10.5 93 93 A T >> - 0 0 68 44,-0.1 3,-1.7 43,-0.1 4,-0.7 -0.861 42.1-100.0-121.7 163.0 -5.4 1.2 9.8 94 94 A T H 3> S+ 0 0 21 -2,-0.3 4,-2.1 1,-0.3 3,-0.2 0.723 117.1 70.1 -57.0 -24.6 -4.0 4.8 9.7 95 95 A G H 3> S+ 0 0 23 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.834 91.6 58.7 -62.0 -35.4 -5.3 5.4 13.3 96 96 A N H <> S+ 0 0 16 -3,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.900 110.1 43.6 -57.2 -40.8 -2.6 3.0 14.6 97 97 A F H X S+ 0 0 17 -4,-0.7 4,-1.9 -3,-0.2 -2,-0.2 0.844 108.8 56.3 -74.3 -35.5 -0.0 5.4 13.0 98 98 A E H X S+ 0 0 97 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.901 107.7 50.4 -61.3 -42.2 -1.8 8.5 14.2 99 99 A K H X S+ 0 0 76 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.897 106.6 54.1 -63.6 -44.3 -1.4 7.1 17.8 100 100 A L H X S+ 0 0 24 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.930 111.3 45.5 -54.0 -47.5 2.3 6.4 17.3 101 101 A F H X S+ 0 0 7 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.859 109.1 54.0 -72.8 -32.8 3.0 10.0 16.3 102 102 A V H X S+ 0 0 61 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.952 113.4 44.3 -59.9 -50.8 0.8 11.5 19.1 103 103 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.837 113.7 51.0 -60.2 -35.6 3.0 9.4 21.6 104 104 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.906 111.7 45.2 -72.7 -44.0 6.2 10.4 19.8 105 105 A V H X S+ 0 0 3 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.897 113.4 51.3 -63.0 -43.0 5.5 14.1 19.8 106 106 A E H X S+ 0 0 94 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.926 109.9 49.5 -60.7 -46.8 4.4 13.9 23.5 107 107 A Y H X S+ 0 0 48 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.932 111.0 50.3 -55.9 -48.3 7.7 12.1 24.3 108 108 A M H >< S+ 0 0 5 -4,-2.4 3,-0.6 1,-0.2 7,-0.3 0.904 109.7 49.1 -59.2 -45.5 9.7 14.8 22.5 109 109 A R H 3< S+ 0 0 146 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.853 112.7 49.0 -62.9 -35.5 7.9 17.7 24.3 110 110 A A H 3< S+ 0 0 85 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.658 95.6 98.4 -78.2 -16.4 8.5 16.0 27.7 111 111 A S S << S- 0 0 39 -4,-1.1 4,-0.1 -3,-0.6 -3,-0.0 0.010 74.4-130.3 -71.4 172.5 12.3 15.3 27.1 112 112 A G S S+ 0 0 88 2,-0.1 2,-0.1 0, 0.0 -1,-0.1 0.728 90.3 83.5 -88.1 -30.7 15.4 17.1 28.2 113 113 A Q S S- 0 0 86 1,-0.1 2,-0.6 -105,-0.0 -2,-0.1 -0.476 90.3-115.0 -68.0 144.8 16.7 17.0 24.6 114 114 A S + 0 0 96 -2,-0.1 2,-0.3 2,-0.0 -5,-0.1 -0.788 40.4 178.2 -92.7 117.7 15.4 19.8 22.3 115 115 A F - 0 0 30 -2,-0.6 2,-1.5 -7,-0.3 3,-0.2 -0.800 40.3-122.4-120.8 151.4 13.2 18.6 19.4 116 116 A D >> + 0 0 60 -115,-0.3 4,-1.4 -2,-0.3 3,-0.8 -0.584 44.7 169.1 -87.9 72.5 11.3 20.2 16.6 117 117 A S H 3> + 0 0 22 -2,-1.5 4,-2.0 1,-0.3 -1,-0.2 0.834 67.4 56.8 -64.4 -36.9 8.1 18.6 17.8 118 118 A Q H 3> S+ 0 0 98 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.836 106.3 53.6 -61.7 -32.6 5.6 20.6 15.7 119 119 A S H <> S+ 0 0 7 -3,-0.8 4,-2.9 2,-0.2 -1,-0.2 0.888 107.2 49.7 -66.1 -39.2 7.6 19.3 12.7 120 120 A W H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.841 110.5 51.1 -68.7 -31.7 7.1 15.7 13.9 121 121 A D H X S+ 0 0 37 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.959 111.2 47.2 -62.3 -55.5 3.4 16.4 14.3 122 122 A R H X S+ 0 0 92 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.930 111.9 51.0 -50.6 -49.9 3.3 17.7 10.7 123 123 A F H X S+ 0 0 0 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.901 109.2 51.0 -56.9 -46.3 5.3 14.7 9.5 124 124 A G H X S+ 0 0 5 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.886 111.4 47.3 -56.9 -45.8 2.8 12.3 11.2 125 125 A K H X S+ 0 0 131 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.948 114.5 46.4 -61.7 -50.0 -0.2 14.1 9.6 126 126 A N H X S+ 0 0 18 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.886 112.5 49.9 -61.0 -40.2 1.5 14.0 6.2 127 127 A L H X S+ 0 0 6 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.874 108.4 52.8 -67.4 -40.6 2.5 10.3 6.5 128 128 A V H X S+ 0 0 16 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.914 110.0 49.2 -58.9 -42.4 -1.1 9.4 7.6 129 129 A S H X S+ 0 0 70 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.914 111.6 48.3 -63.2 -42.7 -2.4 11.1 4.4 130 130 A A H X S+ 0 0 20 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.841 109.5 53.2 -67.7 -34.0 0.2 9.3 2.3 131 131 A L H <>S+ 0 0 0 -4,-2.2 5,-2.4 2,-0.2 4,-0.2 0.914 108.4 49.3 -67.2 -41.9 -0.8 6.0 3.9 132 132 A S H ><5S+ 0 0 66 -4,-2.2 3,-1.8 3,-0.2 -2,-0.2 0.950 111.1 49.6 -61.1 -50.6 -4.5 6.5 3.1 133 133 A S H 3<5S+ 0 0 111 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.902 106.1 56.7 -52.0 -46.6 -3.7 7.3 -0.5 134 134 A A T 3<5S- 0 0 33 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.468 132.2 -91.6 -70.0 -2.8 -1.5 4.2 -0.8 135 135 A G T < 5S+ 0 0 55 -3,-1.8 2,-0.5 1,-0.4 -3,-0.2 0.466 80.9 136.1 111.5 -1.8 -4.6 2.2 0.3 136 136 A M < 0 0 10 -5,-2.4 -1,-0.4 -6,-0.1 -43,-0.1 -0.707 360.0 360.0 -72.5 126.0 -4.4 1.9 4.1 137 137 A K 0 0 201 -2,-0.5 -44,-0.1 -45,-0.3 -1,-0.1 0.547 360.0 360.0 -78.0 360.0 -8.0 2.6 5.3 138 !* 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 0.0 139 1 B G > 0 0 58 0, 0.0 4,-2.7 0, 0.0 115,-0.2 0.000 360.0 360.0 360.0-164.3 -1.2 32.0 3.7 140 2 B F H > + 0 0 22 2,-0.2 4,-1.6 1,-0.2 114,-0.1 0.898 360.0 49.0 -55.7 -50.4 -0.0 30.0 0.7 141 3 B K H > S+ 0 0 123 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.896 114.0 47.6 -60.5 -42.3 -3.4 28.2 0.1 142 4 B Q H > S+ 0 0 116 1,-0.2 4,-2.6 2,-0.2 3,-0.3 0.928 105.2 58.2 -62.9 -46.2 -5.2 31.6 0.3 143 5 B D H X S+ 0 0 4 -4,-2.7 4,-2.9 1,-0.3 5,-0.2 0.815 100.9 58.5 -55.1 -37.3 -2.7 33.3 -2.1 144 6 B I H X S+ 0 0 2 -4,-1.6 4,-2.7 2,-0.2 -1,-0.3 0.955 109.0 43.2 -53.7 -54.1 -3.7 30.6 -4.7 145 7 B A H X S+ 0 0 52 -4,-1.2 4,-1.3 -3,-0.3 -2,-0.2 0.879 112.7 54.3 -60.9 -41.0 -7.3 31.8 -4.4 146 8 B T H < S+ 0 0 43 -4,-2.6 4,-0.4 2,-0.2 3,-0.4 0.940 111.8 43.1 -56.9 -52.6 -6.2 35.5 -4.5 147 9 B I H >< S+ 0 0 0 -4,-2.9 3,-1.7 1,-0.2 7,-0.3 0.941 112.7 52.9 -60.2 -46.1 -4.3 35.0 -7.7 148 10 B R H >< S+ 0 0 99 -4,-2.7 3,-0.7 1,-0.3 -1,-0.2 0.719 99.5 65.0 -62.9 -24.1 -7.1 32.9 -9.3 149 11 B G T 3< S+ 0 0 65 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.643 124.6 13.2 -72.2 -15.9 -9.6 35.7 -8.5 150 12 B D T <> S+ 0 0 90 -3,-1.7 4,-2.3 -4,-0.4 -1,-0.2 -0.281 85.0 158.1-153.3 54.1 -7.8 38.0 -10.9 151 13 B L H <> + 0 0 20 -3,-0.7 4,-3.4 1,-0.2 5,-0.2 0.857 66.5 47.5 -61.5 -51.5 -5.5 35.6 -12.8 152 14 B R H > S+ 0 0 99 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.900 113.9 49.3 -61.7 -39.1 -4.7 37.4 -16.0 153 15 B T H > S+ 0 0 71 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.960 117.3 39.9 -64.3 -50.5 -3.8 40.6 -14.2 154 16 B Y H X S+ 0 0 25 -4,-2.3 4,-2.6 -7,-0.3 5,-0.3 0.866 115.7 54.0 -63.8 -35.2 -1.6 38.9 -11.7 155 17 B A H X S+ 0 0 0 -4,-3.4 4,-2.4 -5,-0.2 5,-0.2 0.972 113.4 40.0 -65.6 -52.1 -0.2 36.6 -14.5 156 18 B Q H X S+ 0 0 25 -4,-2.9 4,-2.8 -5,-0.2 5,-0.2 0.934 117.9 48.6 -59.9 -48.5 0.8 39.5 -16.8 157 19 B D H X S+ 0 0 47 -4,-2.5 4,-2.0 -5,-0.3 -2,-0.2 0.899 115.3 43.0 -62.3 -43.4 2.1 41.6 -13.9 158 20 B I H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.892 115.5 48.8 -69.0 -39.6 4.2 38.8 -12.3 159 21 B F H X S+ 0 0 8 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.903 111.3 50.2 -69.8 -38.8 5.5 37.7 -15.7 160 22 B L H X S+ 0 0 4 -4,-2.8 4,-2.3 -5,-0.2 5,-0.3 0.894 107.3 54.5 -61.2 -42.0 6.4 41.3 -16.6 161 23 B A H X S+ 0 0 30 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.929 110.2 47.8 -55.5 -43.9 8.2 41.6 -13.3 162 24 B F H X S+ 0 0 8 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.916 113.1 45.7 -64.0 -46.2 10.2 38.5 -14.3 163 25 B L H < S+ 0 0 3 -4,-2.4 7,-0.2 1,-0.2 -1,-0.2 0.781 115.6 47.1 -71.8 -27.8 11.1 39.7 -17.8 164 26 B N H < S+ 0 0 98 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.805 113.9 47.0 -79.9 -32.4 12.1 43.2 -16.5 165 27 B K H < S+ 0 0 87 -4,-2.1 -2,-0.2 -5,-0.3 -3,-0.2 0.876 130.8 22.9 -71.4 -39.7 14.2 41.8 -13.7 166 28 B Y >< + 0 0 48 -4,-2.3 3,-2.2 -5,-0.2 4,-0.3 -0.650 69.6 172.0-127.8 74.2 15.9 39.3 -16.1 167 29 B P G > S+ 0 0 61 0, 0.0 3,-1.4 0, 0.0 4,-0.2 0.717 74.0 69.0 -62.4 -21.4 15.5 40.8 -19.7 168 30 B D G > S+ 0 0 75 1,-0.3 3,-1.0 2,-0.1 4,-0.1 0.694 86.1 71.2 -64.1 -22.0 17.9 38.1 -21.1 169 31 B E G X S+ 0 0 4 -3,-2.2 3,-1.5 1,-0.2 4,-0.3 0.662 77.0 77.9 -68.4 -22.1 15.1 35.6 -20.4 170 32 B R G X S+ 0 0 63 -3,-1.4 3,-2.3 -4,-0.3 6,-0.3 0.792 76.6 76.7 -57.2 -28.6 12.9 37.0 -23.2 171 33 B R G < S+ 0 0 159 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.1 0.638 84.0 62.1 -63.4 -19.2 15.1 35.1 -25.7 172 34 B Y G < S+ 0 0 77 -3,-1.5 -1,-0.3 -4,-0.1 2,-0.2 0.692 104.5 60.7 -73.2 -19.6 13.3 31.8 -24.8 173 35 B F S < S- 0 0 82 -3,-2.3 2,-0.4 -4,-0.3 3,-0.2 -0.557 86.5-118.8-105.8 167.5 10.1 33.5 -26.2 174 36 B K S S+ 0 0 134 -2,-0.2 -3,-0.1 1,-0.2 -2,-0.1 -0.926 85.4 0.6-110.2 135.9 9.3 34.8 -29.6 175 37 B N S S+ 0 0 104 -2,-0.4 -1,-0.2 1,-0.1 -4,-0.1 0.751 94.4 108.7 66.0 26.8 8.5 38.5 -30.4 176 38 B Y > + 0 0 8 -6,-0.3 3,-0.8 -3,-0.2 8,-0.1 0.722 53.5 91.1 -97.2 -26.0 8.8 39.7 -26.8 177 39 B V T 3 S+ 0 0 88 1,-0.2 3,-0.1 -7,-0.2 -3,-0.0 -0.237 82.8 29.0 -68.9 154.5 12.0 41.7 -27.2 178 40 B G T 3 S+ 0 0 70 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.605 97.9 110.8 74.1 13.6 12.0 45.5 -28.1 179 41 B K < - 0 0 70 -3,-0.8 -1,-0.2 4,-0.0 2,-0.1 -0.938 58.5-137.0-127.0 143.0 8.6 46.0 -26.5 180 42 B S > - 0 0 61 -2,-0.4 4,-2.6 -3,-0.1 5,-0.2 -0.384 39.7 -94.7 -80.8 172.8 7.4 48.0 -23.3 181 43 B D H > S+ 0 0 60 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.919 125.4 49.9 -50.1 -57.8 4.9 46.7 -20.8 182 44 B Q H > S+ 0 0 138 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.849 113.2 51.7 -58.1 -33.4 1.8 48.3 -22.4 183 45 B E H >> S+ 0 0 101 2,-0.2 3,-2.2 1,-0.2 4,-1.1 0.991 104.7 50.2 -62.0 -66.3 3.0 46.8 -25.6 184 46 B L H >< S+ 0 0 5 -4,-2.6 3,-0.8 1,-0.3 7,-0.3 0.875 110.7 56.7 -41.5 -38.5 3.4 43.2 -24.4 185 47 B K H 3< S+ 0 0 69 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.700 102.2 49.7 -73.7 -23.1 -0.1 43.6 -23.1 186 48 B S H << S+ 0 0 114 -3,-2.2 2,-0.3 -4,-0.7 -1,-0.2 0.497 89.0 99.7 -95.4 -2.1 -1.8 44.6 -26.4 187 49 B M S S+ 0 0 80 -2,-0.3 4,-1.4 1,-0.2 -1,-0.1 0.909 96.3 49.2 -69.7 -44.0 -2.8 38.8 -28.3 189 51 B K H > S+ 0 0 81 2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.762 101.8 63.4 -70.3 -29.8 -0.5 35.9 -27.5 190 52 B F H > S+ 0 0 0 -6,-0.3 4,-2.2 2,-0.2 5,-0.2 0.969 107.6 39.3 -63.7 -57.7 1.1 37.5 -24.4 191 53 B G H X S+ 0 0 2 -4,-0.9 4,-1.8 -7,-0.3 -1,-0.2 0.904 120.8 46.1 -54.0 -46.6 -2.1 37.7 -22.3 192 54 B D H X S+ 0 0 68 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.938 116.5 41.0 -67.8 -51.5 -3.3 34.3 -23.5 193 55 B H H X S+ 0 0 67 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.892 115.3 51.3 -63.4 -43.7 -0.0 32.3 -23.1 194 56 B T H X S+ 0 0 2 -4,-2.2 4,-2.0 -5,-0.4 -1,-0.2 0.825 108.1 51.3 -69.4 -35.2 0.9 33.9 -19.8 195 57 B E H X S+ 0 0 53 -4,-1.8 4,-2.9 -5,-0.2 -1,-0.2 0.902 108.5 52.2 -65.2 -43.2 -2.5 33.2 -18.3 196 58 B K H X S+ 0 0 143 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.884 107.2 54.3 -58.2 -38.4 -2.1 29.5 -19.3 197 59 B V H X S+ 0 0 60 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.965 114.1 39.1 -59.8 -52.3 1.3 29.5 -17.6 198 60 B F H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.803 107.8 63.2 -73.2 -28.3 -0.2 30.8 -14.3 199 61 B N H X S+ 0 0 56 -4,-2.9 4,-1.3 2,-0.2 -1,-0.2 0.960 112.9 37.5 -52.7 -51.6 -3.3 28.6 -14.7 200 62 B L H X S+ 0 0 52 -4,-2.1 4,-2.2 2,-0.2 3,-0.2 0.903 112.8 56.4 -71.1 -40.9 -1.0 25.6 -14.5 201 63 B M H X S+ 0 0 16 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.904 107.6 50.5 -57.0 -39.1 1.3 27.2 -11.9 202 64 B M H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.838 109.5 49.7 -70.1 -30.6 -1.7 27.6 -9.6 203 65 B E H X S+ 0 0 87 -4,-1.3 4,-2.2 -3,-0.2 -1,-0.2 0.860 110.3 50.0 -74.0 -36.0 -2.8 24.0 -10.0 204 66 B V H X S+ 0 0 3 -4,-2.2 4,-0.6 2,-0.2 10,-0.3 0.934 114.3 45.6 -63.9 -45.4 0.8 22.8 -9.2 205 67 B A H >< S+ 0 0 1 -4,-2.4 3,-0.8 -5,-0.2 6,-0.2 0.903 114.6 48.0 -59.7 -42.5 0.7 25.0 -6.1 206 68 B D H 3< S+ 0 0 60 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.829 110.2 51.8 -70.6 -31.4 -2.8 23.8 -5.3 207 69 B R H 3< S+ 0 0 94 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.506 94.6 99.5 -83.0 -10.0 -1.7 20.1 -5.8 208 70 B A << - 0 0 12 -3,-0.8 2,-0.4 -4,-0.6 3,-0.1 -0.333 64.8-141.6 -75.0 156.5 1.2 20.7 -3.4 209 71 B T B > S-B 212 0B 60 3,-2.1 3,-2.5 1,-0.1 -135,-0.1 -0.995 85.9 -14.6-117.2 128.1 1.4 19.7 0.3 210 72 B D T 3 S- 0 0 51 -2,-0.4 -1,-0.1 1,-0.3 -136,-0.1 0.861 130.8 -54.2 45.6 44.9 3.3 22.1 2.5 211 73 B C T 3 S+ 0 0 4 -6,-0.2 -1,-0.3 1,-0.2 53,-0.2 0.639 109.4 128.1 64.7 18.0 4.6 23.8 -0.6 212 74 B V B < -B 209 0B 23 -3,-2.5 -3,-2.1 -140,-0.1 -1,-0.2 -0.926 52.5-142.7-102.3 113.0 6.1 20.5 -1.9 213 75 B P - 0 0 10 0, 0.0 -5,-0.1 0, 0.0 2,-0.1 -0.392 24.4 -93.7 -75.2 154.2 4.8 19.9 -5.5 214 76 B L > - 0 0 71 -10,-0.3 4,-1.7 1,-0.1 3,-0.3 -0.399 24.3-132.4 -59.0 136.5 3.9 16.6 -6.9 215 77 B A H > S+ 0 0 73 1,-0.2 4,-2.5 2,-0.2 -1,-0.1 0.832 109.7 58.4 -58.8 -33.0 6.7 14.8 -8.7 216 78 B S H > S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.856 103.9 51.5 -67.1 -33.6 4.1 14.1 -11.5 217 79 B D H > S+ 0 0 10 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.870 110.2 48.1 -67.6 -39.2 3.6 17.9 -11.9 218 80 B A H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.920 109.1 53.9 -65.9 -44.7 7.4 18.4 -12.1 219 81 B N H X S+ 0 0 60 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.921 106.5 52.3 -55.3 -44.2 7.7 15.7 -14.7 220 82 B T H X S+ 0 0 70 -4,-1.9 4,-0.7 1,-0.2 -1,-0.2 0.918 109.4 49.2 -57.3 -45.5 5.0 17.4 -16.8 221 83 B L H < S+ 0 0 17 -4,-1.7 3,-0.2 1,-0.2 -1,-0.2 0.835 113.6 45.9 -64.3 -37.1 6.9 20.7 -16.7 222 84 B V H < S+ 0 0 32 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.861 113.2 48.8 -72.5 -38.0 10.2 19.0 -17.8 223 85 B Q H < S+ 0 0 143 -4,-2.5 2,-0.3 -5,-0.2 -2,-0.2 0.444 81.1 114.5 -86.9 -1.7 8.6 16.9 -20.6 224 86 B M >< - 0 0 48 -4,-0.7 3,-2.0 -3,-0.2 4,-0.1 -0.592 66.7-138.9 -69.1 127.4 6.7 19.9 -22.2 225 87 B K G > S+ 0 0 168 -2,-0.3 3,-2.2 1,-0.3 4,-0.2 0.890 104.1 60.4 -50.2 -46.1 8.2 20.5 -25.7 226 88 B Q G 3 S+ 0 0 134 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.617 104.7 50.5 -61.3 -14.7 8.0 24.3 -25.0 227 89 B H G X S+ 0 0 42 -3,-2.0 3,-1.6 1,-0.1 -1,-0.3 0.264 75.6 108.3-105.6 14.3 10.3 23.7 -22.0 228 90 B S T < S+ 0 0 100 -3,-2.2 -1,-0.1 1,-0.3 -2,-0.1 0.738 76.9 52.0 -67.0 -22.8 13.0 21.8 -23.9 229 91 B S T 3 S+ 0 0 88 -3,-0.2 -1,-0.3 -4,-0.2 2,-0.1 0.507 94.3 104.1 -88.2 -2.8 15.6 24.6 -23.8 230 92 B L < - 0 0 30 -3,-1.6 45,-0.3 -8,-0.1 2,-0.3 -0.399 46.5-167.7 -92.4 154.5 15.3 25.2 -20.1 231 93 B T >> - 0 0 64 44,-0.2 3,-1.4 -2,-0.1 4,-0.7 -0.796 45.2 -99.4-118.5 173.8 17.4 24.4 -17.0 232 94 B T H 3> S+ 0 0 22 -2,-0.3 4,-1.9 1,-0.3 3,-0.3 0.739 116.5 72.6 -66.9 -21.3 16.2 24.7 -13.4 233 95 B G H 3> S+ 0 0 22 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.778 90.3 58.4 -63.2 -28.3 18.0 28.1 -13.2 234 96 B N H <> S+ 0 0 15 -3,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.870 106.6 47.9 -67.4 -38.1 15.3 29.6 -15.4 235 97 B F H X S+ 0 0 17 -4,-0.7 4,-2.1 -3,-0.3 -2,-0.2 0.865 107.6 56.7 -71.3 -33.8 12.7 28.5 -12.8 236 98 B E H X S+ 0 0 105 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.950 106.6 48.4 -57.8 -51.1 14.9 30.0 -10.1 237 99 B K H X S+ 0 0 68 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.914 109.8 53.4 -57.9 -41.1 14.8 33.5 -11.8 238 100 B L H X S+ 0 0 19 -4,-1.7 4,-2.6 1,-0.2 -1,-0.2 0.923 111.9 43.3 -61.0 -45.0 11.0 33.3 -12.1 239 101 B F H X S+ 0 0 8 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.851 109.5 55.5 -77.2 -31.2 10.4 32.6 -8.5 240 102 B V H X S+ 0 0 54 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.961 113.7 43.0 -57.7 -48.2 12.9 35.2 -7.3 241 103 B A H X S+ 0 0 2 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.889 112.0 53.7 -66.2 -39.6 10.9 37.7 -9.4 242 104 B L H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.900 110.3 46.6 -57.8 -45.3 7.6 36.4 -8.2 243 105 B V H X S+ 0 0 9 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.881 111.2 50.9 -68.9 -40.1 8.5 36.7 -4.5 244 106 B E H X S+ 0 0 103 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.841 109.6 52.0 -67.4 -33.7 9.9 40.3 -5.0 245 107 B Y H X S+ 0 0 53 -4,-2.1 4,-1.1 -5,-0.2 -2,-0.2 0.911 111.1 47.1 -62.1 -44.8 6.6 41.2 -6.7 246 108 B M H < S+ 0 0 4 -4,-1.9 3,-0.5 1,-0.2 7,-0.3 0.906 109.9 52.1 -67.1 -40.4 4.7 39.8 -3.8 247 109 B R H < S+ 0 0 132 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.746 113.4 44.9 -68.3 -26.3 6.8 41.6 -1.2 248 110 B A H < S+ 0 0 88 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.593 94.9 97.4 -89.6 -15.8 6.3 45.0 -3.0 249 111 B S S < S- 0 0 29 -4,-1.1 4,-0.1 -3,-0.5 -3,-0.0 -0.218 81.8-121.3 -70.5 161.0 2.6 44.6 -3.6 250 112 B G S S+ 0 0 87 2,-0.1 -1,-0.1 0, 0.0 2,-0.1 0.561 84.5 101.9 -79.9 -0.2 -0.1 46.2 -1.3 251 113 B Q S S- 0 0 95 -5,-0.1 2,-1.0 1,-0.1 -2,-0.1 -0.394 82.0-119.8 -83.0 156.0 -1.5 42.6 -0.7 252 114 B S + 0 0 120 -2,-0.1 -1,-0.1 2,-0.1 -109,-0.1 -0.317 52.6 165.4 -87.2 50.0 -1.0 40.4 2.4 253 115 B F - 0 0 23 -2,-1.0 2,-1.0 -7,-0.3 3,-0.2 -0.181 46.8-125.4 -64.5 157.8 0.8 37.5 0.4 254 116 B D > + 0 0 53 -115,-0.2 4,-1.4 1,-0.2 3,-0.5 -0.672 40.5 170.7-101.2 71.6 2.8 34.7 2.1 255 117 B S H > + 0 0 13 -2,-1.0 4,-1.9 1,-0.3 -1,-0.2 0.856 69.1 59.2 -59.6 -38.5 5.8 35.5 -0.0 256 118 B Q H > S+ 0 0 107 2,-0.2 4,-2.8 1,-0.2 -1,-0.3 0.915 101.6 53.3 -51.8 -52.1 8.1 33.2 2.0 257 119 B S H > S+ 0 0 10 -3,-0.5 4,-2.9 1,-0.2 -1,-0.2 0.892 106.8 53.3 -52.2 -41.6 5.9 30.2 1.2 258 120 B W H X S+ 0 0 0 -4,-1.4 4,-2.9 2,-0.2 -1,-0.2 0.874 107.8 51.1 -64.9 -34.1 6.3 31.1 -2.5 259 121 B D H X S+ 0 0 49 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.953 111.3 46.1 -63.5 -52.3 10.0 31.1 -1.9 260 122 B R H X S+ 0 0 87 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.896 114.7 50.1 -53.6 -39.7 9.9 27.6 -0.3 261 123 B F H X S+ 0 0 0 -4,-2.9 4,-2.6 -5,-0.2 -2,-0.2 0.944 109.3 48.9 -70.0 -46.0 7.6 26.5 -3.2 262 124 B G H X S+ 0 0 4 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.887 114.3 47.2 -55.4 -43.6 10.0 27.8 -5.9 263 125 B K H X S+ 0 0 123 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.908 112.7 48.0 -65.4 -45.3 12.9 26.1 -4.2 264 126 B N H X S+ 0 0 21 -4,-2.6 4,-2.2 -53,-0.2 -2,-0.2 0.836 111.4 51.4 -64.2 -35.7 11.0 22.8 -3.8 265 127 B L H X S+ 0 0 6 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.885 108.5 50.4 -68.7 -41.0 9.9 22.9 -7.4 266 128 B V H X S+ 0 0 16 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.942 111.6 48.9 -61.5 -43.8 13.5 23.5 -8.6 267 129 B S H X S+ 0 0 69 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.930 112.9 48.1 -59.4 -44.4 14.5 20.4 -6.5 268 130 B A H X S+ 0 0 12 -4,-2.2 4,-1.1 2,-0.2 -1,-0.2 0.845 108.6 52.9 -65.5 -37.7 11.6 18.4 -8.0 269 131 B L H <>S+ 0 0 0 -4,-2.6 5,-2.7 2,-0.2 -1,-0.2 0.891 109.8 49.6 -65.1 -41.8 12.5 19.5 -11.6 270 132 B S H ><5S+ 0 0 73 -4,-2.3 3,-1.6 3,-0.2 -2,-0.2 0.915 109.9 49.8 -59.8 -45.5 16.1 18.3 -11.0 271 133 B S H 3<5S+ 0 0 97 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.671 107.6 54.9 -70.7 -18.3 14.8 14.9 -9.6 272 134 B A T 3<5S- 0 0 31 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.290 130.1 -98.9 -92.4 3.8 12.6 14.6 -12.7 273 135 B G T < 5 + 0 0 55 -3,-1.6 2,-0.4 1,-0.3 -3,-0.2 0.604 69.9 147.7 96.1 15.6 15.8 15.1 -14.8 274 136 B M < 0 0 12 -5,-2.7 -1,-0.3 1,-0.1 -43,-0.1 -0.696 360.0 360.0 -80.9 134.4 15.9 18.7 -15.9 275 137 B K 0 0 200 -2,-0.4 -44,-0.2 -45,-0.3 -1,-0.1 0.693 360.0 360.0 -65.3 360.0 19.5 20.0 -16.1