==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 19-OCT-11 3U9R . COMPND 2 MOLECULE: METHYLCROTONYL-COA CARBOXYLASE, BETA-SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR C.S.HUANG,L.TONG . 536 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23612.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 393 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 5.8 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 30 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 31.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 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 4 2 2 0 2 1 0 1 1 1 1 0 0 3 0 1 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 2 4 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 PARALLEL BRIDGES PER LADDER . 2 0 1 1 0 0 0 2 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 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 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 27 B H > 0 0 94 0, 0.0 3,-1.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.8 29.1 1.1 -33.4 2 28 B M T 3 + 0 0 190 1,-0.3 0, 0.0 314,-0.0 0, 0.0 0.781 360.0 58.1 -68.5 -24.1 31.6 2.5 -30.9 3 29 B A T 3 S+ 0 0 13 315,-0.1 314,-2.8 2,-0.1 -1,-0.3 0.403 80.2 125.0 -84.5 6.1 30.4 -0.3 -28.6 4 30 B I B < -A 316 0A 43 -3,-1.6 2,-0.6 312,-0.2 312,-0.2 -0.469 59.5-134.7 -75.1 133.1 31.3 -3.0 -31.1 5 31 B L - 0 0 29 310,-2.7 2,-0.6 -2,-0.2 279,-0.1 -0.747 17.5-154.3 -84.3 117.4 33.6 -5.8 -29.9 6 32 B H - 0 0 143 -2,-0.6 303,-0.0 2,-0.0 300,-0.0 -0.857 20.5-126.7 -93.8 119.0 36.2 -6.4 -32.6 7 33 B T - 0 0 36 -2,-0.6 299,-0.0 1,-0.1 -1,-0.0 -0.261 21.9-167.2 -71.2 149.7 37.5 -10.0 -32.4 8 34 B Q + 0 0 173 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 0.128 59.8 109.4-115.0 13.4 41.1 -10.9 -32.1 9 35 B I - 0 0 39 297,-0.0 -2,-0.1 7,-0.0 284,-0.1 -0.745 55.8-153.9 -96.5 140.6 40.3 -14.6 -32.8 10 36 B N > - 0 0 72 -2,-0.3 3,-2.5 1,-0.1 6,-0.3 -0.918 3.7-159.4-118.0 104.8 41.1 -16.3 -36.1 11 37 B P T 3 S+ 0 0 59 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.547 94.1 54.1 -57.4 -10.8 38.8 -19.3 -36.9 12 38 B R T 3 S+ 0 0 215 4,-0.1 -3,-0.0 5,-0.0 2,-0.0 0.457 84.2 109.9-106.4 -0.9 41.5 -20.6 -39.1 13 39 B S S <> S- 0 0 35 -3,-2.5 4,-2.1 1,-0.1 5,-0.1 -0.246 75.1-121.4 -74.1 161.3 44.4 -20.7 -36.7 14 40 B A H > S+ 0 0 85 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.881 113.9 52.9 -67.6 -38.1 45.9 -23.8 -35.3 15 41 B E H > S+ 0 0 106 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.938 108.6 49.6 -63.5 -46.9 45.1 -22.7 -31.7 16 42 B F H > S+ 0 0 25 -6,-0.3 4,-2.9 1,-0.2 5,-0.2 0.926 110.7 50.4 -58.1 -42.8 41.5 -22.2 -32.6 17 43 B A H X S+ 0 0 58 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.893 110.1 49.7 -64.4 -37.8 41.3 -25.6 -34.2 18 44 B A H X S+ 0 0 50 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.918 112.1 48.0 -66.5 -42.6 42.8 -27.3 -31.2 19 45 B N H X S+ 0 0 8 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.928 112.1 49.9 -61.8 -46.3 40.4 -25.5 -28.9 20 46 B A H X S+ 0 0 14 -4,-2.9 4,-3.2 -5,-0.2 5,-0.2 0.878 107.9 53.4 -62.3 -38.6 37.5 -26.5 -31.1 21 47 B A H X S+ 0 0 62 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.942 110.8 45.9 -61.3 -45.6 38.6 -30.2 -31.2 22 48 B T H X S+ 0 0 62 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.925 117.7 43.9 -63.8 -45.6 38.7 -30.4 -27.4 23 49 B M H X S+ 0 0 6 -4,-2.6 4,-2.5 268,-0.4 3,-0.4 0.943 112.0 51.4 -68.6 -44.6 35.3 -28.6 -27.1 24 50 B L H X S+ 0 0 54 -4,-3.2 4,-3.1 1,-0.2 5,-0.3 0.807 100.8 62.0 -64.6 -29.6 33.6 -30.6 -29.9 25 51 B E H X S+ 0 0 131 -4,-1.7 4,-1.6 -5,-0.2 -1,-0.2 0.937 111.9 39.8 -57.8 -43.0 34.7 -33.9 -28.4 26 52 B Q H X S+ 0 0 50 -4,-1.2 4,-2.3 -3,-0.4 -2,-0.2 0.901 115.5 50.3 -73.0 -40.4 32.5 -33.0 -25.3 27 53 B V H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.912 110.4 50.1 -65.0 -41.8 29.7 -31.4 -27.3 28 54 B N H X S+ 0 0 82 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.912 110.6 49.9 -62.9 -39.6 29.5 -34.6 -29.5 29 55 B A H X S+ 0 0 41 -4,-1.6 4,-2.4 -5,-0.3 -1,-0.2 0.908 110.0 51.3 -65.9 -40.4 29.4 -36.8 -26.4 30 56 B L H X S+ 0 0 2 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.935 109.2 49.9 -61.9 -45.5 26.6 -34.6 -24.9 31 57 B R H X S+ 0 0 117 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.915 111.7 48.5 -60.7 -42.3 24.5 -34.8 -28.1 32 58 B T H X S+ 0 0 108 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.917 112.2 48.5 -64.0 -41.9 24.8 -38.6 -28.2 33 59 B L H X S+ 0 0 22 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.921 110.7 50.3 -66.5 -42.7 23.9 -38.9 -24.5 34 60 B L H X S+ 0 0 64 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.895 107.7 55.1 -62.4 -36.6 20.8 -36.7 -24.9 35 61 B G H X S+ 0 0 39 -4,-2.1 4,-0.6 -5,-0.2 -1,-0.2 0.912 109.7 46.3 -61.9 -40.8 19.8 -38.8 -27.9 36 62 B R H >< S+ 0 0 148 -4,-1.9 3,-1.4 1,-0.2 -2,-0.2 0.924 110.4 52.3 -66.0 -43.8 19.9 -41.9 -25.7 37 63 B I H >< S+ 0 0 13 -4,-2.7 3,-2.2 1,-0.3 -2,-0.2 0.867 97.6 67.2 -61.8 -32.5 18.0 -40.2 -22.9 38 64 B H H 3< S+ 0 0 93 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.776 91.0 65.4 -57.3 -27.6 15.3 -39.2 -25.4 39 65 B E T X< S- 0 0 83 -3,-1.4 3,-2.5 -4,-0.6 -1,-0.3 0.389 87.3-164.2 -78.6 3.0 14.5 -43.0 -25.7 40 66 B G T < S+ 0 0 8 -3,-2.2 48,-0.2 1,-0.3 -1,-0.2 -0.230 70.4 0.5 54.9-126.0 13.3 -43.2 -22.1 41 67 B G T 3 S- 0 0 40 1,-0.2 4,-0.3 46,-0.1 -1,-0.3 0.426 117.5-103.3 -77.1 2.4 13.1 -46.7 -20.8 42 68 B G <> - 0 0 23 -3,-2.5 4,-2.7 1,-0.2 5,-0.3 -0.248 46.5 -51.0 102.7 171.9 14.3 -48.0 -24.2 43 69 B S H > S+ 0 0 102 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.882 131.1 45.1 -50.2 -52.4 12.9 -49.6 -27.3 44 70 B A H > S+ 0 0 65 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.893 115.6 47.1 -63.2 -41.1 11.0 -52.5 -25.6 45 71 B A H > S+ 0 0 7 -4,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.900 111.6 50.2 -68.5 -40.8 9.5 -50.2 -22.9 46 72 B Q H X S+ 0 0 27 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.877 110.6 52.0 -65.7 -33.7 8.4 -47.6 -25.4 47 73 B A H X S+ 0 0 60 -4,-2.1 4,-2.1 -5,-0.3 -2,-0.2 0.891 107.0 50.6 -69.5 -38.8 6.8 -50.4 -27.4 48 74 B R H X S+ 0 0 139 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.882 111.7 50.3 -63.9 -39.0 4.8 -51.7 -24.4 49 75 B H H ><>S+ 0 0 2 -4,-2.0 5,-1.5 1,-0.2 3,-1.3 0.950 111.2 46.3 -64.1 -50.0 3.6 -48.2 -23.8 50 76 B S H ><5S+ 0 0 62 -4,-2.3 3,-1.8 1,-0.3 -2,-0.2 0.856 106.3 60.2 -62.9 -33.9 2.5 -47.6 -27.4 51 77 B A H 3<5S+ 0 0 88 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.666 96.6 61.0 -68.5 -15.3 0.8 -51.0 -27.4 52 78 B R T <<5S- 0 0 150 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.455 123.8-107.4 -88.2 0.4 -1.4 -49.8 -24.5 53 79 B G T < 5S+ 0 0 56 -3,-1.8 200,-0.4 1,-0.3 2,-0.3 0.713 77.5 135.9 80.2 23.0 -2.6 -47.1 -26.9 54 80 B K < - 0 0 27 -5,-1.5 2,-0.3 198,-0.1 -1,-0.3 -0.780 54.9-126.2-104.8 143.9 -0.7 -44.4 -25.0 55 81 B L - 0 0 35 -2,-0.3 2,-0.1 -3,-0.1 5,-0.0 -0.690 35.2-108.0 -82.4 143.3 1.4 -41.6 -26.6 56 82 B L >> - 0 0 39 -2,-0.3 4,-2.3 1,-0.1 3,-0.6 -0.388 33.6-107.8 -65.0 154.4 5.1 -41.4 -25.3 57 83 B V H 3> S+ 0 0 4 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.871 118.7 50.2 -57.1 -40.8 5.7 -38.4 -23.0 58 84 B R H 3> S+ 0 0 45 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.855 111.0 49.4 -68.9 -29.7 7.8 -36.5 -25.5 59 85 B E H <> S+ 0 0 67 -3,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.864 108.7 53.9 -72.2 -34.4 5.1 -37.0 -28.2 60 86 B R H X S+ 0 0 1 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.938 110.6 46.3 -63.2 -44.1 2.5 -35.7 -25.6 61 87 B I H X S+ 0 0 6 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.940 109.5 54.6 -65.1 -42.7 4.5 -32.6 -25.1 62 88 B N H < S+ 0 0 104 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.890 112.6 42.8 -56.7 -39.6 5.0 -32.1 -28.9 63 89 B R H < S+ 0 0 102 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.753 111.7 54.3 -78.9 -24.8 1.2 -32.2 -29.4 64 90 B L H < S+ 0 0 0 -4,-1.8 -2,-0.2 -3,-0.2 -1,-0.2 0.856 97.4 79.7 -74.1 -38.1 0.4 -30.0 -26.4 65 91 B L S < S- 0 0 14 -4,-2.2 34,-0.2 -5,-0.2 3,-0.1 -0.326 95.7 -95.7 -71.4 150.4 2.8 -27.2 -27.6 66 92 B D > - 0 0 33 32,-2.9 3,-2.5 1,-0.1 32,-0.2 -0.359 59.6 -84.8 -59.3 143.6 1.9 -24.7 -30.3 67 93 B P T 3 S+ 0 0 125 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 -0.311 116.3 10.3 -53.1 130.0 3.1 -25.9 -33.7 68 94 B G T 3 S+ 0 0 84 1,-0.2 -2,-0.1 -3,-0.1 -3,-0.0 0.452 90.7 154.4 80.0 1.0 6.8 -24.8 -34.1 69 95 B S < - 0 0 22 -3,-2.5 -1,-0.2 -7,-0.1 -4,-0.1 -0.392 44.9-124.0 -67.5 136.4 7.1 -23.8 -30.4 70 96 B P - 0 0 61 0, 0.0 28,-0.6 0, 0.0 2,-0.4 -0.377 23.9-149.7 -68.9 157.7 10.6 -23.8 -29.0 71 97 B F E -B 97 0B 55 26,-0.1 2,-1.1 -6,-0.1 26,-0.2 -0.968 6.3-152.8-134.9 116.5 10.8 -26.0 -25.8 72 98 B L E -B 96 0B 9 24,-2.6 24,-1.8 -2,-0.4 2,-0.3 -0.779 22.6-155.1 -89.6 98.5 13.4 -25.2 -23.1 73 99 B E E -B 95 0B 53 -2,-1.1 2,-0.4 22,-0.2 22,-0.3 -0.583 3.2-142.8 -81.2 137.1 14.0 -28.6 -21.6 74 100 B L E -B 94 0B 4 20,-3.0 20,-0.6 -2,-0.3 429,-0.2 -0.834 64.2 -17.7-103.0 131.6 15.1 -28.8 -18.0 75 101 B S > + 0 0 1 427,-2.4 3,-1.8 -2,-0.4 -1,-0.2 0.804 60.8 167.8 49.9 50.4 17.6 -31.3 -16.6 76 102 B A T 3 S+ 0 0 13 1,-0.3 13,-0.6 426,-0.2 -1,-0.1 0.822 78.2 57.2 -62.3 -27.2 17.6 -34.0 -19.2 77 103 B L T > S+ 0 0 4 12,-0.1 3,-2.3 11,-0.1 -1,-0.3 0.400 76.8 139.4 -85.9 6.2 20.7 -35.5 -17.5 78 104 B A T < S+ 0 0 2 -3,-1.8 12,-0.8 1,-0.3 11,-0.4 -0.210 73.6 9.1 -52.7 138.6 18.9 -35.8 -14.2 79 105 B A T >> S+ 0 0 2 418,-2.5 3,-1.9 1,-0.2 4,-0.6 0.437 84.3 163.1 69.3 6.6 19.8 -39.1 -12.4 80 106 B H T <4 S- 0 0 46 -3,-2.3 -1,-0.2 1,-0.3 417,-0.1 -0.356 75.1 -12.7 -60.8 122.9 22.6 -40.0 -14.9 81 107 B E T 34 S+ 0 0 151 -2,-0.2 -1,-0.3 1,-0.1 5,-0.1 0.721 108.7 110.2 58.5 27.1 24.8 -42.7 -13.4 82 108 B V T <4 + 0 0 44 -3,-1.9 -2,-0.1 3,-0.2 2,-0.1 0.883 68.5 42.4 -95.7 -43.6 23.3 -42.2 -9.9 83 109 B Y S < S- 0 0 26 -4,-0.6 4,-0.1 2,-0.4 -2,-0.0 -0.334 97.6 -93.9 -98.9 179.8 21.2 -45.4 -9.3 84 111 B G S S+ 0 0 83 -2,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.675 108.2 27.3 -71.0 -7.6 22.1 -49.0 -10.0 85 112 B E S S- 0 0 83 2,-0.0 -2,-0.4 0, 0.0 2,-0.2 -0.878 101.3 -73.8-143.4 168.1 20.3 -48.7 -13.3 86 113 B E + 0 0 120 -2,-0.3 2,-0.2 -4,-0.1 -6,-0.1 -0.481 37.9 176.8 -69.8 136.0 19.4 -46.2 -16.0 87 114 B V > - 0 0 6 -8,-0.2 3,-2.5 -2,-0.2 4,-0.1 -0.734 29.7-141.7-137.5 78.4 16.6 -43.8 -15.0 88 115 B A G > S- 0 0 15 1,-0.3 3,-2.4 -48,-0.2 4,-0.1 -0.244 77.1 -11.4 -55.9 124.5 16.5 -41.6 -18.0 89 116 B A G > S- 0 0 3 -13,-0.6 3,-1.6 -11,-0.4 -1,-0.3 0.679 118.9 -75.4 58.7 23.1 15.9 -37.9 -17.2 90 117 B A G < S- 0 0 0 -3,-2.5 29,-0.4 -12,-0.8 -1,-0.3 0.678 84.0 -68.5 60.7 19.6 14.9 -39.1 -13.7 91 118 B G G < S+ 0 0 1 -3,-2.4 19,-3.1 -13,-0.2 2,-0.4 0.580 116.8 91.9 80.5 10.1 11.7 -40.3 -15.2 92 119 B I E < - C 0 109B 0 -3,-1.6 2,-0.6 17,-0.3 17,-0.2 -0.998 57.1-155.5-137.3 136.4 10.3 -36.9 -15.9 93 120 B V E + C 0 108B 2 15,-2.7 15,-2.8 -2,-0.4 2,-0.3 -0.974 28.8 170.5-108.8 121.3 10.5 -34.6 -18.9 94 121 B A E +BC 74 107B 1 -2,-0.6 -20,-3.0 -20,-0.6 2,-0.3 -0.952 8.5 119.8-131.5 149.2 10.0 -31.0 -17.9 95 122 B G E -BC 73 106B 0 11,-2.1 11,-3.0 -2,-0.3 2,-0.5 -0.968 51.0 -86.1 173.1 177.8 10.4 -27.7 -19.7 96 123 B I E +BC 72 105B 11 -24,-1.8 -24,-2.6 -2,-0.3 2,-0.3 -0.905 47.7 143.7-112.2 129.5 8.9 -24.4 -20.8 97 124 B G E -BC 71 104B 4 7,-1.7 7,-2.6 -2,-0.5 2,-0.4 -0.933 49.1 -81.0-151.8 177.0 7.1 -23.9 -24.1 98 125 B R E + C 0 103B 87 -28,-0.6 -32,-2.9 -2,-0.3 2,-0.4 -0.698 35.0 177.7 -91.2 132.3 4.1 -22.1 -25.7 99 126 B V E > S- C 0 102B 0 3,-2.3 3,-2.2 -2,-0.4 -34,-0.1 -0.984 82.4 -17.0-131.4 116.0 0.6 -23.4 -25.3 100 127 B E T 3 S- 0 0 77 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.888 129.8 -55.7 50.8 41.0 -2.1 -21.2 -26.9 101 128 B G T 3 S+ 0 0 41 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.374 115.2 116.9 76.7 -1.3 0.6 -18.4 -26.9 102 129 B V E < -C 99 0B 18 -3,-2.2 -3,-2.3 168,-0.0 2,-0.8 -0.813 68.8-124.4-102.7 132.0 1.2 -18.7 -23.1 103 130 B E E -C 98 0B 10 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.689 41.2-178.2 -76.4 112.8 4.6 -19.8 -21.7 104 131 B C E -C 97 0B 0 -7,-2.6 -7,-1.7 -2,-0.8 2,-0.6 -0.850 32.1-126.3-115.1 148.6 3.8 -22.8 -19.5 105 132 B M E -Cd 96 140B 0 34,-2.7 36,-2.6 -2,-0.3 2,-0.5 -0.837 31.7-163.7 -88.9 121.8 5.9 -25.0 -17.3 106 133 B I E -Cd 95 141B 0 -11,-3.0 -11,-2.1 -2,-0.6 2,-0.5 -0.924 10.8-177.3-113.6 129.0 5.1 -28.6 -18.5 107 134 B V E +Cd 94 142B 3 34,-2.5 36,-2.7 -2,-0.5 2,-0.5 -0.961 8.1 179.1-129.4 113.3 6.0 -31.6 -16.2 108 135 B G E -Cd 93 143B 0 -15,-2.8 -15,-2.7 -2,-0.5 2,-0.2 -0.952 23.6-133.9-123.9 127.2 5.4 -35.0 -17.6 109 136 B N E -C 92 0B 6 34,-2.3 2,-0.8 -2,-0.5 -17,-0.3 -0.520 16.0-139.1 -71.9 142.2 6.1 -38.4 -16.0 110 137 B D > - 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g 0 250B 0 -21,-1.9 4,-2.7 -2,-0.4 3,-0.8 -0.725 35.6-118.2 -84.9 125.5 -8.2 -40.1 -20.2 207 234 B R T 34 S+ 0 0 83 43,-3.0 4,-0.1 -2,-0.5 -1,-0.1 -0.255 89.4 9.2 -66.0 152.0 -11.0 -42.7 -20.2 208 235 B E T 34 S+ 0 0 121 1,-0.2 -1,-0.2 2,-0.2 3,-0.1 0.843 132.5 53.3 47.2 42.5 -10.3 -46.5 -19.8 209 236 B Q T <4 S+ 0 0 43 -3,-0.8 2,-0.2 1,-0.5 -2,-0.2 0.235 87.3 69.2-162.1 -60.1 -6.7 -45.5 -19.0 210 237 B A < - 0 0 0 -4,-2.7 26,-0.6 -25,-0.2 -1,-0.5 -0.536 55.6-177.6 -79.1 142.6 -6.2 -43.0 -16.3 211 238 B T B -J 235 0E 10 -24,-2.0 2,-0.4 -2,-0.2 24,-0.2 -0.987 9.7-168.6-137.2 151.1 -6.9 -43.9 -12.7 212 239 B I + 0 0 4 22,-2.1 2,-0.3 -2,-0.3 -22,-0.2 -0.985 22.0 141.7-138.7 125.7 -6.8 -41.9 -9.4 213 240 B F B -i 190 0D 27 -24,-1.7 -22,-1.8 -2,-0.4 -19,-0.2 -0.947 48.8-138.7-163.1 145.3 -7.0 -43.3 -5.9 214 241 B L S S+ 0 0 107 -2,-0.3 2,-0.4 1,-0.3 -22,-0.1 0.782 103.8 26.0 -70.8 -27.2 -5.6 -42.8 -2.4 215 242 B A S S- 0 0 36 -24,-0.1 -1,-0.3 -3,-0.1 -3,-0.1 -0.973 83.2-142.5-140.9 125.4 -5.4 -46.7 -2.1 216 243 B G > - 0 0 10 -2,-0.4 4,-2.4 -3,-0.2 3,-0.3 -0.122 36.3 -85.1 -80.5 176.2 -5.2 -49.1 -5.0 217 244 B P H > S+ 0 0 30 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.859 123.5 53.4 -49.5 -47.1 -6.8 -52.5 -5.5 218 245 B P H > S+ 0 0 100 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.936 112.6 44.4 -58.5 -44.1 -4.1 -54.5 -3.6 219 246 B L H > S+ 0 0 103 -3,-0.3 4,-2.5 1,-0.2 5,-0.2 0.897 111.8 51.9 -69.3 -37.5 -4.4 -52.4 -0.5 220 247 B V H X>S+ 0 0 20 -4,-2.4 4,-2.3 2,-0.2 6,-0.7 0.909 111.9 47.7 -63.3 -40.5 -8.2 -52.4 -0.6 221 248 B K H X5S+ 0 0 111 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.967 113.3 47.8 -63.6 -50.9 -8.2 -56.2 -0.9 222 249 B A H <5S+ 0 0 88 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.869 119.0 38.9 -57.7 -40.0 -5.7 -56.5 2.0 223 250 B A H <5S+ 0 0 77 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.767 137.8 8.2 -85.3 -27.1 -7.6 -54.1 4.3 224 251 B T H <5S- 0 0 92 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.456 88.5-119.4-133.2 -7.1 -11.2 -55.1 3.6 225 252 B G << + 0 0 53 -4,-2.5 -4,-0.2 -5,-0.6 -3,-0.1 0.315 65.5 146.1 80.6 -11.1 -11.1 -58.2 1.4 226 253 B E - 0 0 100 -6,-0.7 2,-0.6 -5,-0.1 -1,-0.3 -0.385 39.6-150.2 -61.6 130.4 -13.0 -56.1 -1.2 227 254 B V + 0 0 108 -3,-0.1 2,-0.3 -2,-0.1 -1,-0.1 -0.939 30.1 152.3-108.4 121.0 -11.9 -57.1 -4.8 228 255 B V - 0 0 25 -2,-0.6 2,-0.1 -11,-0.1 -7,-0.1 -0.997 39.7-120.7-149.0 144.5 -12.1 -54.3 -7.3 229 256 B S > - 0 0 51 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.467 31.5-112.5 -81.6 163.3 -10.3 -53.4 -10.5 230 257 B A H > S+ 0 0 37 1,-0.2 4,-2.7 2,-0.2 -18,-0.2 0.901 118.3 51.9 -62.0 -41.2 -8.3 -50.2 -10.9 231 258 B E H > S+ 0 0 47 1,-0.2 4,-1.9 2,-0.2 7,-0.3 0.911 111.6 45.1 -62.3 -41.5 -10.8 -48.9 -13.5 232 259 B E H 4 S+ 0 0 134 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.829 115.4 49.7 -72.2 -29.1 -13.8 -49.6 -11.2 233 260 B L H < S- 0 0 42 -4,-2.0 -2,-0.2 1,-0.1 -1,-0.2 0.894 138.0 -13.3 -76.9 -42.9 -12.0 -48.1 -8.2 234 261 B G H < S+ 0 0 0 -4,-2.7 -22,-2.1 -5,-0.2 -2,-0.2 0.070 86.1 139.0-156.5 36.9 -10.9 -44.8 -9.7 235 262 B G B X -J 211 0E 0 -4,-1.9 4,-2.2 -24,-0.2 5,-0.2 -0.121 69.1 -87.3 -75.7-179.0 -11.2 -44.6 -13.5 236 263 B A H > S+ 0 0 0 -26,-0.6 4,-2.7 -30,-0.3 5,-0.5 0.836 125.2 56.1 -61.3 -34.7 -12.4 -41.6 -15.5 237 264 B D H >>S+ 0 0 37 2,-0.2 4,-1.9 1,-0.2 5,-0.7 0.952 109.5 47.1 -63.8 -45.1 -16.0 -42.5 -15.3 238 265 B V H >>S+ 0 0 44 -7,-0.3 5,-2.5 1,-0.2 4,-1.6 0.944 120.0 37.0 -59.0 -50.8 -15.9 -42.6 -11.5 239 266 B H H <>S+ 0 0 21 -4,-2.2 7,-1.6 3,-0.2 5,-1.1 0.797 121.2 41.3 -81.3 -25.6 -14.1 -39.3 -11.2 240 267 B C H <5S+ 0 0 33 -4,-2.7 -3,-0.2 -5,-0.2 -1,-0.2 0.807 128.0 29.1 -87.3 -31.7 -15.7 -37.2 -13.9 241 268 B K H <5S+ 0 0 149 -4,-1.9 -3,-0.2 -5,-0.5 -2,-0.2 0.794 133.7 17.0 -97.9 -31.2 -19.2 -38.4 -13.4 242 269 B V T < S- 0 0 78 1,-0.1 4,-2.5 -47,-0.0 5,-0.2 -0.933 81.2 -75.9-166.9 177.5 -7.7 -40.6 -25.6 253 280 B D H > S+ 0 0 4 -200,-0.4 4,-2.4 -2,-0.3 5,-0.2 0.913 126.5 52.9 -56.2 -45.3 -4.3 -38.9 -25.0 254 281 B D H > S+ 0 0 78 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.932 111.5 45.8 -57.4 -44.7 -4.7 -36.7 -28.1 255 282 B H H > S+ 0 0 69 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.910 110.0 54.8 -65.0 -42.4 -8.1 -35.5 -26.9 256 283 B A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.887 108.8 48.0 -58.0 -42.3 -6.8 -34.9 -23.4 257 284 B L H X S+ 0 0 2 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.867 109.9 52.0 -68.6 -37.4 -4.0 -32.7 -24.7 258 285 B A H X S+ 0 0 43 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.884 109.8 49.6 -64.4 -37.7 -6.4 -30.7 -26.9 259 286 B I H X S+ 0 0 23 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.909 107.4 54.8 -67.8 -39.6 -8.6 -30.1 -23.8 260 287 B A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.908 105.8 52.2 -60.5 -38.0 -5.5 -29.0 -21.9 261 288 B R H X S+ 0 0 44 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.903 107.9 51.6 -63.0 -40.3 -4.9 -26.4 -24.6 262 289 B R H X S+ 0 0 133 -4,-1.7 4,-1.0 1,-0.2 -1,-0.2 0.890 106.6 54.7 -62.0 -40.1 -8.5 -25.2 -24.2 263 290 B C H >< S+ 0 0 5 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.941 110.7 44.9 -59.2 -44.8 -7.9 -24.9 -20.5 264 291 B V H >< S+ 0 0 2 -4,-2.2 3,-1.8 1,-0.2 5,-0.3 0.899 105.3 61.3 -66.4 -35.6 -4.9 -22.6 -21.2 265 292 B A H 3< S+ 0 0 38 -4,-2.3 3,-0.4 1,-0.3 -1,-0.2 0.740 105.7 49.6 -62.0 -22.7 -6.8 -20.6 -23.8 266 293 B N T << S+ 0 0 122 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.135 78.4 97.3-105.7 22.0 -9.2 -19.6 -21.0 267 294 B L S < S- 0 0 33 -3,-1.8 -1,-0.2 2,-0.0 3,-0.2 0.612 81.2-136.3 -83.4 -11.7 -6.7 -18.4 -18.4 268 295 B N - 0 0 159 -3,-0.4 2,-0.2 -4,-0.2 -2,-0.1 0.900 39.3-168.0 56.4 44.2 -7.2 -14.7 -19.4 269 296 B W + 0 0 51 -5,-0.3 2,-0.4 -4,-0.1 -1,-0.2 -0.431 21.7 176.1 -77.4 133.6 -3.4 -14.6 -19.1 270 297 B R - 0 0 178 -2,-0.2 2,-0.2 -3,-0.2 -168,-0.0 -0.998 28.3-127.4-133.3 131.7 -1.4 -11.4 -19.1 271 298 B K - 0 0 67 -2,-0.4 252,-0.2 1,-0.1 253,-0.2 -0.565 16.7-163.1 -74.9 140.3 2.5 -11.1 -18.7 272 299 B Q + 0 0 88 251,-1.9 254,-0.3 -2,-0.2 2,-0.3 0.525 54.4 97.0-103.6 -9.5 3.4 -8.6 -15.9 273 300 B G - 0 0 18 249,-2.7 2,-0.4 252,-0.2 249,-0.1 -0.616 49.5-171.3 -88.8 144.3 7.1 -7.9 -16.6 274 301 B Q + 0 0 146 -2,-0.3 2,-0.3 250,-0.0 252,-0.1 -0.999 12.0 164.1-138.9 133.4 8.3 -4.9 -18.6 275 302 B L - 0 0 24 -2,-0.4 2,-1.0 94,-0.0 94,-0.1 -0.951 45.3-107.2-135.8 157.4 11.7 -3.9 -20.0 276 303 B Q - 0 0 145 -2,-0.3 2,-0.2 63,-0.0 -2,-0.0 -0.758 50.7-169.4 -87.9 105.1 12.6 -1.3 -22.5 277 304 B C - 0 0 71 -2,-1.0 2,-0.3 61,-0.1 61,-0.2 -0.552 15.5-148.2 -98.7 162.6 13.5 -3.5 -25.5 278 305 B R - 0 0 130 59,-2.2 3,-0.1 -2,-0.2 -1,-0.0 -0.740 42.4 -78.8-117.3 167.8 15.2 -2.8 -28.8 279 306 B A - 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0 0 6 0, 0.0 5,-0.1 0, 0.0 -2,-0.1 -0.241 14.5-125.5 -58.5 145.4 41.4 -22.7 -24.6 296 323 B A S S+ 0 0 48 -281,-0.2 2,-0.8 -4,-0.1 -2,-0.0 0.826 102.4 71.2 -58.6 -33.8 41.9 -26.4 -24.6 297 324 B D S > S- 0 0 87 1,-0.1 3,-2.0 4,-0.1 -1,-0.1 -0.800 78.6-152.8 -85.1 112.5 43.8 -25.9 -21.3 298 325 B S T 3 S+ 0 0 83 -2,-0.8 118,-0.2 1,-0.3 -1,-0.1 0.646 93.0 56.2 -62.9 -13.2 41.2 -24.9 -18.7 299 326 B K T 3 S+ 0 0 86 2,-0.1 -1,-0.3 -3,-0.0 -3,-0.1 0.532 83.4 105.9 -96.7 -2.8 43.8 -23.0 -16.8 300 327 B Q S < S- 0 0 77 -3,-2.0 2,-0.0 -5,-0.1 0, 0.0 -0.592 70.9-124.7 -81.6 129.1 44.8 -20.8 -19.7 301 328 B P + 0 0 119 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.322 35.7 166.6 -68.8 151.8 43.7 -17.2 -19.6 302 329 B Y - 0 0 42 -7,-0.0 2,-0.8 -8,-0.0 -8,-0.1 -0.936 46.4 -87.3-154.0 167.0 41.7 -15.8 -22.6 303 330 B D > - 0 0 64 -2,-0.3 3,-2.3 1,-0.2 4,-0.4 -0.739 29.9-159.2 -84.8 109.0 39.7 -12.6 -23.2 304 331 B V T >> S+ 0 0 0 -2,-0.8 4,-2.0 1,-0.3 3,-1.4 0.723 85.6 78.6 -63.5 -16.3 36.1 -13.4 -22.0 305 332 B R H 3> S+ 0 0 47 1,-0.3 4,-2.8 2,-0.2 -1,-0.3 0.792 83.3 65.8 -61.3 -23.2 34.9 -10.5 -24.2 306 333 B E H <4 S+ 0 0 15 -3,-2.3 4,-0.5 2,-0.2 -1,-0.3 0.805 102.9 45.7 -67.7 -28.4 35.3 -13.0 -27.1 307 334 B V H X4 S+ 0 0 0 -3,-1.4 3,-1.3 -4,-0.4 4,-0.5 0.933 112.4 50.0 -75.1 -48.7 32.5 -15.0 -25.5 308 335 B I H >X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.3 3,-1.8 0.905 104.1 60.1 -55.0 -42.1 30.3 -11.9 -25.0 309 336 B A T 3< S+ 0 0 0 -4,-2.8 -25,-0.5 1,-0.3 -24,-0.5 0.746 105.8 47.5 -59.7 -26.5 30.9 -10.9 -28.6 310 337 B R T <4 S+ 0 0 3 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.445 115.3 44.7 -96.5 0.9 29.3 -14.1 -29.8 311 338 B L T <4 S+ 0 0 4 -3,-1.8 2,-0.2 -4,-0.5 -2,-0.2 0.718 97.8 74.6-110.2 -30.1 26.2 -13.9 -27.5 312 339 B V S >< S- 0 0 0 -4,-2.1 3,-2.3 1,-0.1 -28,-0.2 -0.574 88.1 -86.4-100.7 156.1 25.0 -10.3 -27.7 313 340 B D G > S- 0 0 3 21,-2.7 3,-2.1 1,-0.3 21,-0.2 -0.230 109.6 -9.0 -57.5 128.1 23.1 -8.2 -30.2 314 341 B G G 3 S- 0 0 3 -32,-1.8 -1,-0.3 1,-0.3 -309,-0.1 0.595 110.1 -88.1 60.2 12.9 25.3 -6.6 -32.8 315 342 B S G < S+ 0 0 0 -3,-2.3 -310,-2.7 1,-0.2 2,-0.4 0.769 85.2 155.1 53.2 29.2 28.3 -7.7 -30.7 316 343 B E B < +A 4 0A 40 -3,-2.1 18,-0.4 -312,-0.2 2,-0.4 -0.703 16.3 169.9 -92.9 131.4 27.8 -4.4 -28.9 317 344 B F - 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