==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-FEB-10 3AEQ . COMPND 2 MOLECULE: LIGHT-INDEPENDENT PROTOCHLOROPHYLLIDE REDUCTASE S . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER CAPSULATUS; . AUTHOR N.MURAKI,J.NOMATA,T.SHIBA,Y.FUJITA,G.KURISU . 1667 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 58061.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1231 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 223 13.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 103 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 209 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 583 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 33 2.0 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 8 4 4 2 4 4 8 7 2 5 3 5 4 2 4 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 2 13 13 4 8 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 . 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 6 4 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 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 7 A T 0 0 150 0, 0.0 336,-1.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 125.6 47.3 46.3 75.1 2 8 A F B +A 336 0A 119 334,-0.2 332,-0.1 335,-0.1 333,-0.1 -0.873 360.0 89.8-117.3 153.0 49.0 44.0 77.7 3 9 A G + 0 0 23 332,-2.6 3,-0.3 -2,-0.3 330,-0.2 0.452 25.3 178.6 124.4 97.8 52.6 43.1 78.1 4 10 A C + 0 0 2 328,-3.0 329,-0.2 1,-0.2 3,-0.1 0.194 55.2 110.2-102.9 14.4 55.3 44.8 80.2 5 11 A T S S+ 0 0 84 1,-0.2 -1,-0.2 327,-0.2 328,-0.1 0.698 87.0 38.5 -63.2 -20.3 58.0 42.3 79.4 6 12 A D S S+ 0 0 156 -3,-0.3 -1,-0.2 326,-0.1 -2,-0.1 0.669 86.4 117.3 -99.0 -25.9 59.7 45.0 77.3 7 13 A S S S- 0 0 28 -3,-0.1 2,-0.4 -4,-0.1 -3,-0.1 -0.201 72.2-115.3 -51.1 131.5 59.1 48.0 79.5 8 14 A P - 0 0 122 0, 0.0 333,-0.5 0, 0.0 2,-0.4 -0.602 28.9-139.9 -68.4 121.8 62.4 49.5 80.8 9 15 A V E -b 341 0B 21 -2,-0.4 2,-0.5 331,-0.1 333,-0.2 -0.742 14.4-121.5 -90.7 131.1 62.5 49.2 84.6 10 16 A R E -b 342 0B 95 331,-3.4 333,-3.3 -2,-0.4 2,-0.5 -0.603 19.9-154.9 -72.0 117.6 63.9 52.1 86.6 11 17 A R E +b 343 0B 131 -2,-0.5 2,-0.3 331,-0.2 333,-0.2 -0.850 28.2 167.4 -92.7 126.6 66.9 51.1 88.7 12 18 A E E +b 344 0B 33 331,-1.8 333,-1.2 -2,-0.5 2,-0.3 -0.995 18.5 177.4-151.0 143.0 67.1 53.5 91.7 13 19 A R + 0 0 120 -2,-0.3 2,-0.3 331,-0.2 333,-0.1 -0.982 30.9 83.9-147.1 157.2 68.9 54.0 95.0 14 20 A G S S+ 0 0 18 -2,-0.3 331,-0.1 331,-0.3 -2,-0.0 -0.982 79.3 17.9 147.2-154.0 69.1 56.5 97.9 15 21 A Q S S- 0 0 29 -2,-0.3 332,-2.6 1,-0.1 2,-0.5 -0.205 73.5-160.8 -50.6 128.0 67.1 57.2 101.0 16 22 A K - 0 0 31 457,-0.2 2,-0.9 330,-0.2 435,-0.3 -0.953 24.9-166.7-128.4 123.0 64.9 54.1 101.6 17 23 A A + 0 0 28 -2,-0.5 2,-0.3 433,-0.1 348,-0.2 -0.772 51.3 112.9 -99.4 83.5 61.8 53.6 103.7 18 24 A V - 0 0 9 -2,-0.9 435,-0.3 347,-0.0 2,-0.2 -0.930 63.7-105.3-143.6 163.7 61.5 49.8 103.9 19 25 A F - 0 0 27 -2,-0.3 125,-2.6 277,-0.2 433,-0.1 -0.626 32.8-118.6 -90.4 154.2 61.8 47.1 106.6 20 26 A C > - 0 0 12 431,-0.4 3,-1.4 123,-0.3 123,-0.2 -0.330 33.5 -98.3 -81.4 171.4 64.8 44.7 107.0 21 27 A G G > S+ 0 0 0 117,-0.6 3,-3.1 121,-0.4 4,-0.3 0.853 111.9 80.6 -56.8 -39.4 64.6 40.9 106.7 22 28 A L G > S+ 0 0 4 115,-2.6 3,-1.7 1,-0.3 4,-0.3 0.762 80.4 67.5 -33.1 -39.7 64.4 40.6 110.5 23 29 A T G X S+ 0 0 7 -3,-1.4 3,-1.1 1,-0.3 4,-0.4 0.647 79.0 77.9 -69.4 -14.0 60.7 41.4 110.3 24 30 A S G X> S+ 0 0 0 -3,-3.1 4,-3.1 120,-0.4 3,-1.1 0.795 81.1 71.2 -57.8 -28.8 60.0 38.1 108.5 25 31 A I H <> S+ 0 0 0 -3,-1.7 4,-1.9 -4,-0.3 5,-0.2 0.834 84.2 68.3 -58.4 -33.4 60.3 36.5 111.9 26 32 A V H <4 S+ 0 0 7 -3,-1.1 -1,-0.2 -4,-0.3 -2,-0.2 0.814 118.9 17.3 -60.5 -34.6 57.0 38.0 112.9 27 33 A W H X> S+ 0 0 22 -3,-1.1 4,-1.2 -4,-0.4 3,-0.7 0.750 120.1 63.8-105.5 -34.2 54.9 35.9 110.6 28 34 A L H >X S+ 0 0 0 -4,-3.1 4,-2.0 1,-0.2 3,-0.7 0.918 98.7 54.1 -56.1 -48.1 57.4 33.1 109.8 29 35 A H H 3< S+ 0 0 0 -4,-1.9 6,-0.2 1,-0.2 -1,-0.2 0.744 100.0 61.9 -63.8 -25.4 57.6 31.8 113.4 30 36 A R H <4 S+ 0 0 84 -3,-0.7 -1,-0.2 -5,-0.2 -2,-0.2 0.910 110.0 41.2 -62.7 -42.0 53.8 31.4 113.5 31 37 A K H << S+ 0 0 10 -4,-1.2 2,-1.0 -3,-0.7 -2,-0.2 0.911 105.4 61.8 -80.0 -44.3 54.0 28.9 110.7 32 38 A M S >< S- 0 0 2 -4,-2.0 3,-0.9 1,-0.2 168,-0.2 -0.763 73.7-169.1 -81.7 106.8 57.1 26.9 111.7 33 39 A Q T 3 S+ 0 0 91 166,-2.2 -1,-0.2 -2,-1.0 167,-0.1 0.697 76.0 35.5 -79.9 -24.7 55.7 25.6 115.0 34 40 A D T 3 S+ 0 0 22 165,-0.2 64,-2.5 63,-0.1 65,-2.2 -0.189 96.4 101.9-125.5 40.2 58.9 24.1 116.6 35 41 A A E < -g 99 0C 0 -3,-0.9 2,-0.4 -6,-0.2 65,-0.2 -0.809 53.0-154.6-111.4 158.8 61.4 26.6 115.3 36 42 A F E -g 100 0C 8 63,-1.9 65,-3.3 -2,-0.3 2,-0.7 -1.000 6.1-147.0-136.0 137.0 63.0 29.5 117.2 37 43 A F E -gh 101 63C 0 25,-1.6 27,-3.1 -2,-0.4 2,-0.8 -0.868 13.7-176.9-111.1 105.0 64.4 32.7 115.8 38 44 A L E -gh 102 64C 0 63,-2.9 65,-2.2 -2,-0.7 2,-0.6 -0.902 11.6-159.2-100.5 108.5 67.3 34.1 117.7 39 45 A V E -gh 103 65C 0 25,-2.9 27,-2.4 -2,-0.8 2,-1.1 -0.814 5.5-151.7 -87.0 121.4 68.4 37.4 116.1 40 46 A V E +gh 104 66C 0 63,-2.2 65,-0.7 -2,-0.6 68,-0.5 -0.816 54.7 99.0 -96.8 96.1 71.9 38.3 117.1 41 47 A G E - h 0 67C 0 -2,-1.1 27,-1.7 25,-0.9 2,-0.1 -0.721 69.4 -64.1-153.7-159.0 71.9 42.0 116.9 42 48 A S > - 0 0 3 25,-0.2 4,-1.6 -2,-0.2 -1,-0.2 -0.191 55.2 -88.9 -94.8-174.5 71.6 45.2 118.9 43 49 A R H > S+ 0 0 39 497,-0.2 4,-3.0 25,-0.2 5,-0.2 0.823 127.1 62.7 -64.3 -32.6 68.8 46.7 121.0 44 50 A T H > S+ 0 0 2 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.972 101.6 50.4 -52.8 -53.7 67.6 48.3 117.8 45 51 A C H > S+ 0 0 11 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.887 113.3 44.7 -52.0 -45.8 67.0 44.8 116.4 46 52 A A H X S+ 0 0 1 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.875 112.8 52.3 -66.1 -37.9 65.0 43.9 119.6 47 53 A H H X S+ 0 0 14 -4,-3.0 4,-2.5 2,-0.2 -2,-0.2 0.912 109.3 49.2 -64.8 -46.8 63.1 47.2 119.5 48 54 A L H X S+ 0 0 4 -4,-3.2 4,-3.7 2,-0.2 5,-0.2 0.977 112.5 46.7 -53.5 -61.8 62.1 46.7 115.9 49 55 A L H X S+ 0 0 2 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.851 111.9 52.0 -50.6 -39.5 60.9 43.1 116.5 50 56 A Q H X S+ 0 0 21 -4,-2.3 4,-1.8 2,-0.2 7,-0.3 0.945 114.6 42.0 -62.8 -46.9 59.0 44.4 119.6 51 57 A A H < S+ 0 0 47 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.897 116.7 48.5 -65.5 -44.6 57.3 47.1 117.6 52 58 A A H < S+ 0 0 31 -4,-3.7 -2,-0.2 1,-0.2 -3,-0.2 0.959 113.3 45.3 -61.1 -54.7 56.7 44.8 114.6 53 59 A A H >< S+ 0 0 1 -4,-2.8 3,-1.9 -5,-0.2 2,-0.3 0.848 84.0 171.6 -59.1 -34.9 55.2 42.0 116.7 54 60 A G G >< S+ 0 0 19 -4,-1.8 3,-0.8 -5,-0.3 4,-0.2 -0.476 72.2 4.7 61.0-116.8 53.1 44.5 118.6 55 61 A V G > S+ 0 0 36 -2,-0.3 3,-0.8 1,-0.2 -1,-0.3 0.585 120.1 74.6 -75.2 -14.8 50.8 42.5 120.8 56 62 A M G X S+ 0 0 2 -3,-1.9 3,-3.0 1,-0.2 -1,-0.2 0.885 81.8 72.9 -63.2 -37.7 52.3 39.1 119.8 57 63 A I G < S+ 0 0 8 -3,-0.8 3,-0.4 1,-0.3 -1,-0.2 0.784 88.7 59.8 -43.9 -36.2 55.2 40.0 122.1 58 64 A F G < S+ 0 0 7 -3,-0.8 -1,-0.3 1,-0.2 2,-0.2 0.538 91.3 73.4 -77.3 -2.8 53.1 39.4 125.1 59 65 A A S < S- 0 0 16 -3,-3.0 -1,-0.2 -4,-0.1 -2,-0.1 -0.305 110.5-104.4-110.6 48.8 52.5 35.7 124.1 60 66 A E - 0 0 114 -3,-0.4 -2,-0.1 -2,-0.2 -3,-0.1 0.824 52.9-156.6 33.7 56.3 55.9 34.1 124.8 61 67 A P - 0 0 5 0, 0.0 2,-1.5 0, 0.0 -1,-0.1 -0.155 23.3-111.3 -68.5 154.2 56.7 34.1 121.1 62 68 A R S S+ 0 0 42 -33,-0.1 -25,-1.6 -26,-0.1 2,-0.3 -0.188 91.6 73.9 -81.4 48.2 59.2 31.6 119.6 63 69 A F E +h 37 0C 5 -2,-1.5 2,-0.3 -27,-0.2 -25,-0.2 -0.973 50.6 166.6-146.8 161.6 61.7 34.3 118.8 64 70 A G E -h 38 0C 5 -27,-3.1 -25,-2.9 -2,-0.3 2,-0.5 -0.971 31.0-116.1-161.7 167.9 64.2 36.5 120.7 65 71 A T E -hI 39 420C 2 355,-2.8 355,-3.9 -2,-0.3 2,-0.9 -0.978 11.6-150.0-114.0 125.1 67.2 38.8 120.2 66 72 A A E -hI 40 419C 0 -27,-2.4 -25,-0.9 -2,-0.5 2,-0.5 -0.860 33.5-149.8 -83.7 103.6 70.6 37.9 121.7 67 73 A V E -hI 41 418C 8 351,-2.2 351,-1.2 -2,-0.9 -25,-0.2 -0.713 8.1-118.8 -99.0 128.4 71.7 41.5 122.2 68 74 A L - 0 0 7 -27,-1.7 -25,-0.2 -2,-0.5 2,-0.1 -0.337 28.0-161.8 -59.1 116.9 75.3 42.7 122.0 69 75 A E > - 0 0 59 -2,-0.2 3,-0.8 -27,-0.1 4,-0.3 -0.375 35.9 -97.3 -87.4 177.2 76.6 44.3 125.2 70 76 A E G > S+ 0 0 102 471,-0.5 3,-2.5 1,-0.2 4,-0.4 0.956 121.7 57.2 -57.5 -54.1 79.7 46.6 125.4 71 77 A Q G > S+ 0 0 121 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.643 97.0 66.4 -56.7 -15.7 82.0 43.8 126.5 72 78 A D G < S+ 0 0 24 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.630 91.1 60.8 -83.4 -15.9 81.1 41.9 123.3 73 79 A L G < S+ 0 0 56 -3,-2.5 -1,-0.2 -4,-0.3 -2,-0.2 0.547 81.5 113.0 -87.1 -10.8 82.7 44.5 121.0 74 80 A A S < S- 0 0 57 -3,-0.5 -3,-0.0 -4,-0.4 0, 0.0 -0.154 74.8-124.2 -61.5 156.8 86.2 43.9 122.5 75 81 A G S S+ 0 0 85 1,-0.2 -1,-0.1 3,-0.0 -3,-0.1 0.410 113.4 41.8 -88.3 -1.6 89.0 42.3 120.5 76 82 A L S S+ 0 0 166 2,-0.0 -1,-0.2 0, 0.0 -4,-0.1 0.642 87.5 121.5-102.4 -31.7 89.5 39.5 123.0 77 83 A A - 0 0 38 -6,-0.2 2,-0.6 1,-0.1 -5,-0.1 0.069 66.6-121.3 -36.5 128.5 85.8 39.0 123.5 78 84 A D > - 0 0 77 1,-0.2 4,-1.4 2,-0.1 5,-0.2 -0.683 28.1-178.1 -91.5 117.0 84.8 35.5 122.7 79 85 A A H > S+ 0 0 39 -2,-0.6 4,-2.2 2,-0.2 5,-0.3 0.976 85.5 42.2 -70.2 -59.0 82.1 34.9 120.0 80 86 A H H > S+ 0 0 74 1,-0.2 4,-1.4 2,-0.2 5,-0.2 0.885 119.4 44.2 -57.7 -46.3 81.9 31.1 120.1 81 87 A K H > S+ 0 0 152 2,-0.2 4,-1.9 1,-0.1 -1,-0.2 0.950 115.6 45.6 -66.3 -50.1 81.9 31.0 124.0 82 88 A E H X S+ 0 0 33 -4,-1.4 4,-1.0 1,-0.2 -2,-0.2 0.927 114.2 45.1 -62.1 -52.5 79.5 33.8 124.6 83 89 A L H X S+ 0 0 6 -4,-2.2 4,-1.8 -5,-0.2 3,-0.3 0.880 112.0 53.0 -60.2 -42.1 76.8 32.9 122.1 84 90 A D H X S+ 0 0 25 -4,-1.4 4,-2.3 -5,-0.3 5,-0.3 0.890 103.6 54.2 -66.1 -42.7 76.8 29.2 123.1 85 91 A R H X S+ 0 0 113 -4,-1.9 4,-0.9 1,-0.2 -1,-0.3 0.799 111.6 50.0 -57.6 -28.0 76.3 29.9 126.8 86 92 A E H X S+ 0 0 4 -4,-1.0 4,-0.9 -3,-0.3 -2,-0.2 0.842 110.0 46.4 -82.2 -34.1 73.3 31.9 125.6 87 93 A V H X S+ 0 0 0 -4,-1.8 4,-3.0 2,-0.2 -2,-0.2 0.819 112.4 50.2 -77.1 -30.8 71.8 29.2 123.3 88 94 A A H X S+ 0 0 41 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.829 108.5 52.8 -74.4 -32.4 72.2 26.4 125.9 89 95 A K H X S+ 0 0 91 -4,-0.9 4,-0.8 -5,-0.3 -1,-0.2 0.787 113.4 46.4 -68.3 -31.5 70.5 28.7 128.5 90 96 A L H >X S+ 0 0 7 -4,-0.9 4,-1.9 2,-0.2 3,-0.7 0.959 112.2 45.9 -73.1 -56.5 67.7 29.0 125.9 91 97 A L H 3< S+ 0 0 22 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.763 102.9 68.0 -62.8 -25.4 67.3 25.3 125.0 92 98 A E H 3< S+ 0 0 158 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.934 112.2 29.9 -55.8 -49.8 67.4 24.4 128.7 93 99 A R H << S+ 0 0 144 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.697 121.1 55.3 -86.9 -21.1 64.0 26.1 129.3 94 100 A R >< + 0 0 48 -4,-1.9 3,-0.8 1,-0.2 -1,-0.2 -0.647 55.3 153.3-110.7 76.6 62.6 25.5 125.8 95 101 A P T 3 + 0 0 80 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.691 66.6 72.3 -75.8 -13.8 62.9 21.7 125.2 96 102 A D T 3 S+ 0 0 85 -3,-0.2 2,-0.2 2,-0.0 -2,-0.1 0.771 76.4 95.2 -66.4 -30.7 60.0 21.9 122.8 97 103 A I < + 0 0 1 -3,-0.8 -62,-0.2 1,-0.1 3,-0.1 -0.473 39.5 169.1 -77.6 129.9 62.1 23.6 120.1 98 104 A R + 0 0 99 -64,-2.5 33,-2.9 -2,-0.2 2,-0.4 0.611 65.6 51.8-115.0 -21.8 63.7 21.5 117.3 99 105 A Q E -gj 35 131C 5 -65,-2.2 -63,-1.9 31,-0.2 2,-0.5 -0.984 64.3-166.8-117.9 128.6 64.9 24.1 114.8 100 106 A L E -gj 36 132C 0 31,-2.5 33,-3.4 -2,-0.4 2,-0.6 -0.948 3.1-161.5-117.5 118.8 67.0 27.0 115.8 101 107 A F E -gj 37 133C 0 -65,-3.3 -63,-2.9 -2,-0.5 2,-1.1 -0.860 6.3-158.5 -98.6 121.3 67.6 30.0 113.5 102 108 A L E -gj 38 134C 0 31,-2.4 33,-1.0 -2,-0.6 2,-0.4 -0.797 21.6-154.0 -93.6 91.9 70.6 32.2 114.2 103 109 A V E -gj 39 135C 0 -65,-2.2 -63,-2.2 -2,-1.1 33,-0.2 -0.520 6.4-134.1 -76.5 124.1 69.4 35.3 112.3 104 110 A G E -gj 40 136C 3 31,-3.1 33,-3.1 -2,-0.4 2,-0.2 -0.563 25.4-172.6 -77.9 139.4 72.2 37.7 111.1 105 111 A S > - 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0 0 24 -365,-0.1 2,-0.5 -372,-0.0 -1,-0.4 -0.770 65.9-167.4 -99.9 141.7 60.8 42.9 125.6 423 7 B T - 0 0 6 -2,-0.4 330,-0.1 -377,-0.1 -3,-0.0 -0.970 15.1-159.7-130.6 115.7 62.6 46.2 125.8 424 8 B Y S S+ 0 0 9 328,-0.5 2,-0.4 -2,-0.5 -1,-0.1 0.796 82.4 40.1 -59.5 -27.5 61.2 49.0 127.9 425 9 B E S S- 0 0 5 327,-0.1 -1,-0.1 -3,-0.1 -378,-0.1 -0.970 73.5-136.4-132.8 137.9 63.4 51.5 126.0 426 10 B G - 0 0 0 -2,-0.4 119,-2.2 1,-0.2 120,-0.2 -0.137 50.1 -71.0 -70.3 176.1 64.5 52.0 122.4 427 11 B P >> - 0 0 0 0, 0.0 3,-1.5 0, 0.0 4,-0.9 -0.305 50.2-103.9 -63.0 157.0 68.1 52.8 121.3 428 12 B P H >> S+ 0 0 0 0, 0.0 3,-1.9 0, 0.0 4,-1.7 0.908 118.5 63.0 -50.7 -47.5 69.4 56.3 122.2 429 13 B H H 3> S+ 0 0 0 1,-0.3 4,-2.3 2,-0.2 5,-0.1 0.747 96.3 58.3 -53.8 -26.2 69.1 57.4 118.5 430 14 B V H <> S+ 0 0 0 -3,-1.5 4,-2.0 2,-0.2 -1,-0.3 0.834 103.9 53.4 -70.3 -31.2 65.3 56.9 118.8 431 15 B G H -r 476 0G 2 0, 0.0 3,-1.5 0, 0.0 2,-0.9 -0.334 53.9 -92.9 -76.7 162.4 71.5 51.0 107.7 450 34 B Q T 3 S+ 0 0 15 26,-1.5 -433,-0.1 1,-0.2 -435,-0.0 -0.667 115.2 43.1 -72.2 105.3 68.5 50.7 105.4 451 35 B G T > S+ 0 0 2 -2,-0.9 3,-1.1 -435,-0.3 -431,-0.4 0.172 79.8 93.3 139.1 -18.1 65.8 49.4 107.7 452 36 B D G X + 0 0 16 -3,-1.5 3,-1.6 1,-0.2 -2,-0.1 0.585 65.9 87.8 -77.2 -8.8 66.3 51.4 110.8 453 37 B T G > + 0 0 4 -435,-0.3 3,-2.2 1,-0.3 4,-0.3 0.572 59.8 93.0 -65.0 -7.4 63.7 53.7 109.3 454 38 B Y G X + 0 0 6 -3,-1.1 3,-1.1 1,-0.3 4,-0.4 0.738 69.9 72.8 -53.8 -25.7 61.1 51.4 111.0 455 39 B A G <> S+ 0 0 0 -3,-1.6 4,-0.5 1,-0.3 3,-0.4 0.625 78.6 74.6 -70.7 -13.1 61.3 53.9 113.9 456 40 B D H X> S+ 0 0 18 -3,-2.2 4,-2.2 1,-0.2 3,-1.4 0.874 86.3 63.1 -61.0 -36.9 59.3 56.4 111.7 457 41 B L H <>>S+ 0 0 34 -3,-1.1 4,-2.7 -4,-0.3 5,-0.8 0.795 88.1 68.7 -62.7 -32.7 56.2 54.3 112.4 458 42 B L H 3>>S+ 0 0 16 -4,-0.4 5,-1.5 -3,-0.4 4,-0.9 0.879 111.4 34.4 -49.1 -39.3 56.4 55.0 116.1 459 43 B F H <<>S+ 0 0 0 -3,-1.4 6,-1.0 -4,-0.5 5,-0.7 0.931 120.9 43.4 -86.3 -48.8 55.5 58.6 115.2 460 44 B T H <5S+ 0 0 0 -4,-2.2 -3,-0.2 4,-0.2 -2,-0.2 0.760 128.4 29.4 -70.9 -23.0 53.2 58.2 112.2 461 45 B M H <5S+ 0 0 38 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.811 127.7 31.3-109.5 -41.5 51.3 55.3 113.9 462 46 B I T < -S 480 0H 30 3,-0.8 3,-2.2 -28,-0.2 -337,-0.2 -0.969 50.1 -55.3-166.7-179.3 74.0 48.5 102.8 478 62 B A T 3 S+ 0 0 56 -338,-1.9 3,-0.3 1,-0.3 -337,-0.1 0.785 127.5 44.5 -32.0 -55.1 75.7 45.4 101.4 479 63 B S T 3 S+ 0 0 81 -339,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.633 115.5 48.0 -77.6 -14.9 76.7 46.9 98.1 480 64 B H B < S+S 477 0H 50 -3,-2.2 -3,-0.8 -340,-0.1 -1,-0.2 -0.708 77.0 118.4-131.2 82.2 77.9 50.3 99.5 481 65 B M > + 0 0 54 -2,-0.3 3,-1.7 -3,-0.3 2,-0.2 -0.500 49.2 38.3-121.9-167.3 80.3 49.9 102.5 482 66 B G T >> S+ 0 0 55 1,-0.3 3,-1.2 2,-0.2 4,-0.6 -0.408 127.6 4.8 67.4-126.2 84.0 50.9 103.2 483 67 B T H 3> S+ 0 0 126 1,-0.2 4,-0.7 -2,-0.2 -1,-0.3 0.725 130.1 63.9 -62.0 -21.7 85.0 54.2 101.8 484 68 B D H <> S+ 0 0 53 -3,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.648 84.0 71.5 -78.2 -20.7 81.4 54.7 100.6 485 69 B T H <> S+ 0 0 5 -3,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.933 100.6 47.4 -62.6 -43.3 79.8 54.8 104.1 486 70 B A H X S+ 0 0 29 -4,-0.6 4,-1.5 -3,-0.2 -1,-0.2 0.855 109.6 53.8 -61.3 -40.8 81.4 58.2 104.7 487 71 B I H X S+ 0 0 91 -4,-0.7 4,-1.9 1,-0.2 -1,-0.2 0.897 105.8 52.6 -61.0 -43.6 80.1 59.4 101.2 488 72 B L H X S+ 0 0 18 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.854 105.3 54.1 -67.8 -36.5 76.5 58.4 102.0 489 73 B L H X S+ 0 0 0 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.935 107.1 53.0 -59.7 -44.4 76.5 60.4 105.2 490 74 B K H X S+ 0 0 102 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.922 111.7 42.1 -59.3 -51.2 77.6 63.5 103.3 491 75 B D H X S+ 0 0 72 -4,-1.9 4,-3.8 2,-0.2 5,-0.4 0.868 107.9 61.2 -66.6 -38.1 74.8 63.4 100.7 492 76 B A H X S+ 0 0 17 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.910 112.1 39.3 -52.1 -46.2 72.3 62.5 103.3 493 77 B L H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.864 115.8 52.2 -69.2 -41.2 73.1 65.8 105.0 494 78 B A H X S+ 0 0 36 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.951 114.7 40.5 -63.1 -52.0 73.5 67.7 101.7 495 79 B A H X S+ 0 0 60 -4,-3.8 4,-2.6 2,-0.2 5,-0.3 0.940 113.5 54.4 -60.8 -52.0 70.0 66.5 100.4 496 80 B A H X S+ 0 0 7 -4,-2.0 4,-2.1 -5,-0.4 5,-0.4 0.922 115.6 38.9 -46.0 -56.1 68.4 67.0 103.8 497 81 B H H X S+ 0 0 19 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.943 114.4 51.6 -64.0 -54.3 69.6 70.6 104.0 498 82 B A H < S+ 0 0 64 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.848 117.1 41.8 -51.6 -37.1 69.1 71.6 100.3 499 83 B R H < S+ 0 0 99 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.979 124.2 25.6 -81.2 -61.4 65.5 70.3 100.5 500 84 B Y H < S- 0 0 101 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.2 0.623 86.5-142.9 -84.8 -11.4 63.9 71.4 103.7 501 85 B K < - 0 0 135 -4,-1.9 -4,-0.1 -5,-0.4 -3,-0.1 0.943 29.2-163.5 49.4 58.9 66.1 74.4 104.3 502 86 B P - 0 0 6 0, 0.0 -60,-0.2 0, 0.0 3,-0.1 -0.218 28.0-128.1 -73.8 161.0 66.1 73.8 108.1 503 87 B Q S S- 0 0 62 -62,-2.0 2,-0.3 1,-0.3 -61,-0.2 0.871 90.1 -7.8 -72.1 -37.8 67.2 76.5 110.6 504 88 B A E S-o 442 0F 0 -63,-1.0 -61,-1.4 27,-0.2 2,-0.3 -0.965 70.0-142.7-155.6 164.4 69.7 74.0 112.1 505 89 B M E -oq 443 533F 0 27,-2.4 29,-3.8 -2,-0.3 2,-0.3 -0.873 3.4-148.9-135.0 159.1 70.6 70.3 111.9 506 90 B A E -oq 444 534F 1 -63,-2.5 -61,-2.4 -2,-0.3 2,-0.4 -0.957 7.3-166.7-124.8 150.7 71.8 67.3 113.9 507 91 B V E +oq 445 535F 0 27,-1.7 29,-1.3 -2,-0.3 2,-0.3 -0.990 21.0 157.3-133.1 140.0 73.9 64.4 112.9 508 92 B A E -o 446 0F 0 -63,-1.9 -61,-2.1 -2,-0.4 2,-0.4 -0.929 33.6-101.4-154.9 175.5 74.2 61.2 114.9 509 93 B L E -o 447 0F 28 27,-0.4 -80,-0.2 -2,-0.3 2,-0.2 -0.901 16.1-145.4-114.5 135.4 75.1 57.5 114.9 510 94 B T >> - 0 0 0 -63,-2.4 4,-1.9 -2,-0.4 3,-0.5 -0.516 41.9-100.7 -78.0 160.9 73.0 54.3 114.8 511 95 B C T 34 S+ 0 0 2 1,-0.2 29,-0.1 2,-0.2 -1,-0.1 0.861 126.9 51.5 -47.2 -42.5 74.3 51.3 116.8 512 96 B T T >4 S+ 0 0 2 1,-0.2 3,-0.9 2,-0.2 -1,-0.2 0.816 108.7 49.4 -69.2 -32.9 75.5 49.9 113.5 513 97 B A G X4 S+ 0 0 2 -3,-0.5 3,-2.1 -66,-0.4 -1,-0.2 0.747 95.8 73.7 -76.0 -24.4 77.3 53.1 112.6 514 98 B E G 3< S+ 0 0 69 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.457 92.5 56.1 -65.5 -1.6 78.9 53.1 116.0 515 99 B L G < S+ 0 0 37 -3,-0.9 -1,-0.3 -4,-0.0 2,-0.2 0.276 95.2 87.7-112.9 7.4 81.1 50.2 114.7 516 100 B L S < S- 0 0 40 -3,-2.1 -3,-0.0 2,-0.1 -406,-0.0 -0.505 78.9-127.0-100.2 172.2 82.4 52.2 111.8 517 101 B Q + 0 0 189 -2,-0.2 -1,-0.1 2,-0.1 -3,-0.0 0.646 66.4 128.3 -86.8 -17.7 85.4 54.6 111.5 518 102 B D - 0 0 31 -5,-0.1 -2,-0.1 1,-0.1 0, 0.0 -0.028 53.0-139.5 -58.1 141.2 83.3 57.4 110.1 519 103 B D > - 0 0 87 1,-0.2 4,-2.4 2,-0.1 5,-0.3 -0.852 17.2-176.6-107.6 101.7 83.4 60.8 111.6 520 104 B P H > S+ 0 0 22 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.928 89.9 49.4 -58.8 -44.3 80.1 62.7 111.9 521 105 B N H > S+ 0 0 73 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.921 115.5 40.6 -61.5 -50.2 81.9 65.7 113.3 522 106 B G H > S+ 0 0 29 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.865 115.8 49.6 -68.0 -39.8 84.5 65.9 110.6 523 107 B I H X S+ 0 0 29 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.895 111.4 49.3 -67.7 -42.2 82.2 65.1 107.7 524 108 B S H X S+ 0 0 8 -4,-2.3 4,-1.1 -5,-0.3 5,-0.4 0.868 114.8 46.0 -57.1 -40.3 79.7 67.7 108.8 525 109 B R H < S+ 0 0 185 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.777 109.4 50.7 -84.1 -32.2 82.5 70.3 109.1 526 110 B A H < S+ 0 0 88 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.861 107.8 56.5 -67.0 -37.2 84.2 69.5 105.7 527 111 B L H < S- 0 0 44 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.812 94.2-160.3 -65.3 -36.0 80.6 69.9 104.1 528 112 B N < - 0 0 132 -4,-1.1 -3,-0.1 1,-0.1 -2,-0.1 0.943 7.6-156.4 61.6 71.9 80.5 73.4 105.6 529 113 B L - 0 0 29 -5,-0.4 -1,-0.1 2,-0.2 4,-0.1 -0.429 27.8-121.0 -87.4 151.2 76.8 74.3 105.7 530 114 B P S S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.539 101.0 46.5 -62.5 -7.4 75.0 77.7 105.8 531 115 B V S S- 0 0 33 1,-0.0 -2,-0.2 -27,-0.0 -27,-0.2 -0.848 102.0 -82.8-127.4 167.9 73.4 76.6 109.1 532 116 B P - 0 0 48 0, 0.0 -27,-2.4 0, 0.0 2,-0.5 -0.443 32.9-162.2 -68.4 144.5 74.6 74.9 112.3 533 117 B V E -q 505 0F 20 -29,-0.2 -27,-0.2 -2,-0.1 -5,-0.1 -0.917 10.3-157.3-128.8 100.4 75.0 71.1 112.2 534 118 B V E -q 506 0F 15 -29,-3.8 -27,-1.7 -2,-0.5 22,-0.1 -0.712 5.2-147.4 -88.9 116.6 75.1 69.8 115.8 535 119 B P E -q 507 0F 41 0, 0.0 2,-0.4 0, 0.0 -27,-0.2 -0.407 13.5-145.2 -74.1 158.8 76.7 66.4 116.2 536 120 B L - 0 0 12 -29,-1.3 2,-0.9 -2,-0.1 -27,-0.4 -0.994 7.8-141.4-133.4 132.6 75.4 64.1 119.0 537 121 B E + 0 0 139 -2,-0.4 18,-0.1 -29,-0.1 -29,-0.1 -0.786 32.6 162.9 -92.1 100.7 77.3 61.7 121.2 538 122 B L - 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0 0 3 -5,-3.0 2,-0.2 -8,-0.1 -1,-0.2 -0.952 43.2-157.1-118.4 113.1 53.4 83.7 134.5 601 185 B K E -t 571 0I 150 -31,-1.2 -29,-1.4 -2,-0.6 2,-0.5 -0.600 24.7-111.9 -84.4 149.7 53.4 83.5 130.7 602 186 B V E -t 572 0I 45 -2,-0.2 -29,-0.2 -31,-0.2 3,-0.2 -0.709 26.5-168.9 -85.8 123.8 55.4 80.7 129.0 603 187 B N E - 0 0 27 -31,-3.7 2,-0.4 -2,-0.5 -30,-0.2 0.996 68.5 -8.0 -72.5 -75.0 58.5 81.9 127.0 604 188 B V E - 0 0 4 -32,-0.2 -30,-1.7 14,-0.1 2,-0.6 -0.997 59.7-152.1-126.8 128.7 59.7 79.0 124.9 605 189 B C E -t 574 0I 28 -2,-0.4 5,-0.2 -32,-0.2 -30,-0.2 -0.916 35.3-126.2 -98.5 123.8 58.3 75.4 125.2 606 190 B A E -t 575 0I 0 -32,-2.5 -30,-1.3 -2,-0.6 -29,-1.0 -0.985 63.7 -14.4-143.9 150.9 61.0 72.9 124.2 607 191 B P E > S+t 577 0I 0 0, 0.0 3,-2.3 0, 0.0 -167,-0.2 -0.924 115.9 81.3 -65.8 -29.0 61.7 70.7 122.5 608 192 B L T 3 S- 0 0 38 -31,-2.6 -169,-0.2 1,-0.3 -3,-0.1 -0.066 115.6 -10.6 -51.4 120.7 57.9 70.4 121.8 609 193 B G T 3 S+ 0 0 49 -171,-2.1 2,-0.3 1,-0.2 -1,-0.3 0.246 105.6 125.4 81.5 -10.8 56.7 72.8 119.2 610 194 B A < - 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0 0 0 -3,-1.8 -49,-0.2 -55,-0.2 -57,-0.1 -0.465 68.5-138.8 -78.6 153.8 63.2 83.6 130.7 622 206 B H S S- 0 0 56 -51,-3.0 2,-0.3 1,-0.2 -50,-0.2 0.878 80.8 -10.6 -78.2 -41.0 63.3 84.2 134.5 623 207 B F E -u 572 0I 0 -52,-0.9 -50,-1.9 22,-0.2 2,-0.4 -0.889 65.6-116.0-148.1 177.5 63.2 80.5 135.3 624 208 B N E -uv 573 647I 0 22,-2.3 24,-2.0 -2,-0.3 2,-0.8 -0.974 11.0-143.7-123.9 137.9 62.6 77.0 133.9 625 209 B V E -u 574 0I 0 -52,-2.8 -50,-2.7 -2,-0.4 2,-1.2 -0.905 17.4-151.7 -96.4 108.4 59.9 74.4 134.6 626 210 B L E +u 575 0I 8 -2,-0.8 -50,-0.1 22,-0.3 -52,-0.1 -0.739 22.2 173.4 -84.4 98.3 61.7 71.1 134.4 627 211 B M + 0 0 0 -52,-2.1 -1,-0.2 -2,-1.2 -51,-0.2 0.828 66.8 20.7 -79.6 -37.3 58.8 69.0 133.4 628 212 B Y >> - 0 0 3 -53,-0.8 4,-1.0 -3,-0.2 3,-0.8 -0.890 55.5-166.7-139.4 105.9 60.5 65.7 132.8 629 213 B P H >> S+ 0 0 18 0, 0.0 4,-1.6 0, 0.0 3,-0.8 0.898 91.1 64.3 -49.7 -43.1 64.0 64.9 134.3 630 214 B E H 34 S+ 0 0 15 1,-0.2 -80,-0.5 2,-0.1 -54,-0.1 0.846 121.0 18.1 -55.7 -35.7 64.2 61.9 132.0 631 215 B T H <4 S+ 0 0 2 -3,-0.8 -55,-0.3 -82,-0.1 -1,-0.2 0.209 135.9 33.3-123.1 15.8 64.3 64.2 128.9 632 216 B G H XX S+ 0 0 0 -4,-1.0 4,-2.0 -3,-0.8 3,-1.4 0.532 80.1 102.3-138.7 -22.0 65.2 67.7 130.3 633 217 B E H 3X S+ 0 0 52 -4,-1.6 4,-1.6 -5,-0.5 -3,-0.1 0.763 86.4 45.9 -36.1 -47.7 67.6 67.2 133.2 634 218 B S H 3> S+ 0 0 30 -5,-0.3 4,-1.3 1,-0.2 -1,-0.3 0.792 113.6 46.2 -76.0 -30.0 70.7 68.2 131.3 635 219 B A H <> S+ 0 0 0 -3,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.734 109.8 54.1 -87.4 -25.5 69.4 71.3 129.6 636 220 B A H X S+ 0 0 0 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.907 110.7 49.1 -65.7 -42.6 67.9 72.6 132.8 637 221 B R H X S+ 0 0 137 -4,-1.6 4,-2.0 -5,-0.3 -2,-0.2 0.813 109.8 49.1 -69.0 -36.0 71.3 72.2 134.3 638 222 B H H X S+ 0 0 15 -4,-1.3 4,-3.7 1,-0.2 5,-0.3 0.890 109.5 53.2 -70.2 -38.6 73.1 74.0 131.5 639 223 B L H X S+ 0 0 0 -4,-1.7 6,-2.4 2,-0.2 4,-0.6 0.665 108.0 50.5 -72.4 -16.4 70.6 76.8 131.7 640 224 B E H X S+ 0 0 80 -4,-0.9 4,-0.6 4,-0.2 -1,-0.2 0.882 115.9 42.2 -80.8 -45.1 71.3 77.2 135.4 641 225 B R H < S+ 0 0 159 -4,-2.0 -2,-0.2 2,-0.1 -3,-0.2 0.986 129.9 26.1 -56.4 -59.1 75.1 77.3 134.6 642 226 B A H < S+ 0 0 46 -4,-3.7 -3,-0.2 1,-0.2 -2,-0.1 0.902 132.9 27.8 -83.1 -48.1 74.8 79.6 131.6 643 227 B C H < S- 0 0 9 -4,-0.6 -1,-0.2 -5,-0.3 -3,-0.1 0.219 96.0-124.6-100.9 11.0 71.7 81.7 131.9 644 228 B K < + 0 0 172 -4,-0.6 -4,-0.2 -6,-0.2 -3,-0.1 0.703 58.8 152.2 50.8 25.4 71.6 81.7 135.7 645 229 B Q - 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