==== 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 LYASE 28-NOV-06 2O0T . COMPND 2 MOLECULE: DIAMINOPIMELATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR S.WEYAND,G.KEFALA,M.S.WEISS,TB STRUCTURAL GENOMICS CONSORTIU . 1784 4 4 0 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 58662.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1271 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 219 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 228 12.8 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 . 8 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 16 0.9 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 . 136 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 144 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 431 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 1.5 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 6 6 0 0 4 6 6 4 0 0 8 0 0 0 4 0 0 0 0 0 0 4 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 8 21 7 4 4 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 . 6 4 8 12 6 4 4 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 . 4 4 4 0 0 4 6 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 2 A N 0 0 136 0, 0.0 4,-0.2 0, 0.0 360,-0.0 0.000 360.0 360.0 360.0 -65.6 22.8 9.0 18.1 2 3 A E + 0 0 124 2,-0.2 3,-0.2 1,-0.1 0, 0.0 0.587 360.0 62.4 -98.0 -19.3 19.2 7.8 18.8 3 4 A L S S+ 0 0 29 1,-0.2 352,-0.3 357,-0.1 -1,-0.1 0.499 97.9 61.6 -79.5 -8.0 19.9 6.9 22.4 4 5 A L S S+ 0 0 70 350,-0.1 -1,-0.2 356,-0.0 -2,-0.2 0.750 80.2 107.8 -86.3 -36.1 20.8 10.6 22.9 5 6 A H - 0 0 112 -4,-0.2 2,-0.6 -3,-0.2 -3,-0.0 -0.153 53.8-157.2 -59.9 137.4 17.3 11.9 22.0 6 7 A L - 0 0 26 9,-0.1 -1,-0.1 348,-0.0 9,-0.0 -0.925 22.8-132.8-116.6 96.5 15.0 13.3 24.7 7 8 A A >> - 0 0 5 -2,-0.6 4,-2.5 1,-0.2 3,-1.0 -0.307 9.0-142.0 -56.1 125.1 11.4 13.0 23.4 8 9 A P T 34 S+ 0 0 104 0, 0.0 -1,-0.2 0, 0.0 7,-0.1 0.782 99.6 56.6 -66.8 -27.3 9.8 16.3 24.0 9 10 A N T 34 S+ 0 0 65 1,-0.1 252,-0.6 255,-0.1 4,-0.1 0.763 116.1 37.2 -69.5 -26.6 6.5 14.7 25.0 10 11 A V T <4 S+ 0 0 0 -3,-1.0 390,-0.2 250,-0.1 -1,-0.1 0.882 105.8 67.2 -91.6 -46.7 8.2 12.7 27.7 11 12 A W S < S- 0 0 4 -4,-2.5 297,-0.1 1,-0.2 4,-0.1 -0.298 97.8 -81.2 -81.2 156.4 10.9 15.0 29.2 12 13 A P > - 0 0 4 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 -0.261 44.1-113.3 -52.0 148.2 10.2 18.2 31.3 13 14 A R T 3 S+ 0 0 98 1,-0.3 -2,-0.1 32,-0.1 295,-0.1 0.787 113.8 53.9 -54.0 -33.2 9.4 21.2 29.1 14 15 A N T 3 S+ 0 0 56 294,-0.1 12,-1.6 2,-0.0 13,-0.6 -0.011 78.9 130.3-100.8 30.3 12.6 23.0 30.1 15 16 A T E < +A 25 0A 28 -3,-1.6 2,-0.3 10,-0.2 10,-0.2 -0.676 25.3 157.0 -79.3 132.9 15.0 20.2 29.2 16 17 A T E -A 24 0A 75 8,-2.0 8,-2.4 -2,-0.3 2,-0.4 -0.888 34.8-118.1-138.3 172.2 18.1 21.0 27.1 17 18 A R E -A 23 0A 70 -2,-0.3 6,-0.3 6,-0.3 339,-0.0 -0.991 26.4-124.1-118.1 137.2 21.5 19.6 26.4 18 19 A D - 0 0 35 4,-3.7 3,-0.3 -2,-0.4 -1,-0.0 0.089 25.1-111.7 -44.6 167.5 24.9 21.3 27.0 19 20 A E S S+ 0 0 174 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.658 125.1 50.8 -78.5 -21.9 27.7 22.0 24.6 20 21 A V S S- 0 0 113 2,-0.1 339,-0.3 338,-0.0 -1,-0.2 0.328 127.9-102.2 -96.0 4.8 29.5 19.4 26.6 21 22 A G S S+ 0 0 6 1,-0.3 2,-0.5 -3,-0.3 -2,-0.1 0.678 74.5 139.8 86.4 19.7 26.6 16.9 26.3 22 23 A V - 0 0 11 335,-0.1 -4,-3.7 337,-0.0 2,-0.3 -0.835 52.6-124.9 -97.2 131.8 25.1 17.3 29.7 23 24 A V E -A 17 0A 0 333,-2.1 7,-2.7 -2,-0.5 2,-0.3 -0.592 29.5-161.4 -70.2 130.5 21.3 17.4 30.0 24 25 A C E -AB 16 29A 6 -8,-2.4 -8,-2.0 -2,-0.3 2,-0.4 -0.886 11.7-153.1-112.8 145.1 20.1 20.5 31.9 25 26 A I E > S-AB 15 28A 1 3,-2.0 3,-2.6 -2,-0.3 -10,-0.2 -0.989 85.5 -11.4-113.9 132.5 16.7 21.2 33.5 26 27 A A T 3 S- 0 0 15 -12,-1.6 400,-1.9 -2,-0.4 401,-0.1 0.796 134.1 -51.2 47.1 36.3 15.7 24.8 33.7 27 28 A G T 3 S+ 0 0 54 -13,-0.6 -1,-0.3 1,-0.2 -12,-0.1 0.380 113.7 115.7 90.8 -5.2 19.2 25.8 32.6 28 29 A I E < -B 25 0A 6 -3,-2.6 -3,-2.0 399,-0.1 -1,-0.2 -0.871 67.2-121.3-104.6 123.6 21.1 23.7 35.3 29 30 A P E >> -B 24 0A 27 0, 0.0 4,-1.4 0, 0.0 3,-0.6 -0.376 16.0-134.9 -56.9 134.9 23.4 20.8 34.3 30 31 A L H 3> S+ 0 0 0 -7,-2.7 4,-2.1 326,-0.3 5,-0.2 0.797 105.2 61.3 -59.6 -34.3 22.2 17.5 35.9 31 32 A T H 3> S+ 0 0 49 -8,-0.3 4,-2.0 325,-0.2 -1,-0.2 0.867 102.2 50.4 -58.2 -44.9 25.8 16.8 36.9 32 33 A Q H <> S+ 0 0 100 -3,-0.6 4,-2.6 2,-0.2 5,-0.2 0.847 109.1 52.7 -63.5 -36.0 25.9 20.0 39.0 33 34 A L H X S+ 0 0 0 -4,-1.4 4,-2.6 2,-0.2 5,-0.3 0.905 110.1 46.8 -66.6 -40.6 22.6 18.9 40.8 34 35 A A H X S+ 0 0 13 -4,-2.1 4,-2.1 3,-0.2 -2,-0.2 0.885 114.0 50.0 -68.7 -36.8 24.1 15.5 41.6 35 36 A Q H < S+ 0 0 163 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.949 118.6 36.0 -62.7 -50.2 27.2 17.2 42.9 36 37 A E H < S+ 0 0 117 -4,-2.6 -2,-0.2 1,-0.1 -1,-0.2 0.868 134.1 22.1 -74.8 -36.5 25.5 19.7 45.0 37 38 A Y H < S- 0 0 48 -4,-2.6 -3,-0.2 -5,-0.2 382,-0.2 0.600 97.0-128.5-112.5 -14.0 22.6 17.5 46.3 38 39 A G < - 0 0 28 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.1 -0.117 39.4 -48.8 81.5 172.2 23.7 13.9 45.9 39 40 A T S S+ 0 0 22 -4,-0.1 274,-0.2 -2,-0.0 2,-0.1 -0.883 102.3 49.6-128.1 159.8 21.8 11.1 44.2 40 41 A P S S+ 0 0 14 0, 0.0 379,-0.7 0, 0.0 2,-0.4 0.653 80.1 173.4 -66.8 159.2 19.2 9.6 43.9 41 42 A L E -Cd 312 419B 0 271,-2.0 271,-2.9 377,-0.2 2,-0.6 -0.975 35.2-142.0-145.3 126.2 17.5 13.0 43.3 42 43 A F E -Cd 311 420B 5 377,-2.3 379,-3.1 -2,-0.4 2,-0.6 -0.773 24.7-163.4 -77.1 118.2 14.0 14.0 42.4 43 44 A V E -Cd 310 421B 0 267,-2.6 267,-2.0 -2,-0.6 2,-0.6 -0.944 1.3-160.0-109.8 114.8 14.4 17.1 40.1 44 45 A I E -Cd 309 422B 4 377,-3.2 379,-2.9 -2,-0.6 2,-1.2 -0.834 12.8-149.5-100.2 120.0 11.3 19.2 39.6 45 46 A D E > - d 0 423B 1 263,-3.0 4,-1.9 -2,-0.6 -32,-0.1 -0.742 17.6-168.8 -84.3 98.7 11.0 21.6 36.6 46 47 A E H > S+ 0 0 14 377,-2.0 4,-2.7 -2,-1.2 5,-0.2 0.881 82.1 52.7 -62.7 -42.9 8.7 24.2 38.4 47 48 A D H > S+ 0 0 53 376,-0.5 4,-2.9 1,-0.2 -1,-0.2 0.911 108.8 52.6 -61.2 -39.5 7.8 26.1 35.3 48 49 A D H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.931 110.7 45.7 -56.8 -53.6 6.8 22.9 33.7 49 50 A F H X S+ 0 0 4 -4,-1.9 4,-1.7 2,-0.2 3,-0.4 0.944 115.0 47.7 -56.2 -49.7 4.4 22.0 36.6 50 51 A R H X S+ 0 0 28 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.879 108.3 56.3 -60.5 -43.9 3.0 25.5 36.7 51 52 A S H X S+ 0 0 22 -4,-2.9 4,-2.6 2,-0.2 -1,-0.2 0.825 105.4 50.7 -48.4 -44.1 2.5 25.4 32.9 52 53 A R H X S+ 0 0 34 -4,-1.6 4,-2.0 -3,-0.4 5,-0.2 0.885 109.4 51.6 -71.8 -34.7 0.4 22.2 33.2 53 54 A C H X S+ 0 0 0 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.951 113.3 44.7 -61.7 -48.4 -1.7 24.0 35.8 54 55 A R H X S+ 0 0 119 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.875 114.2 46.3 -68.4 -40.1 -2.3 26.9 33.6 55 56 A E H X S+ 0 0 77 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.877 115.3 46.6 -71.1 -37.4 -3.0 25.0 30.4 56 57 A T H X S+ 0 0 7 -4,-2.0 4,-2.2 2,-0.2 6,-0.2 0.908 112.2 51.0 -70.1 -45.1 -5.4 22.6 32.2 57 58 A A H < S+ 0 0 13 -4,-2.7 5,-0.4 -5,-0.2 4,-0.3 0.904 114.2 44.2 -53.4 -47.8 -7.1 25.6 33.9 58 59 A A H >< S+ 0 0 75 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.940 110.7 54.9 -65.0 -45.8 -7.5 27.3 30.6 59 60 A A H 3< S+ 0 0 28 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.860 113.2 41.4 -57.3 -39.6 -8.7 24.1 28.9 60 61 A F T 3< S- 0 0 18 -4,-2.2 -1,-0.3 2,-0.1 -2,-0.2 0.286 118.0-107.8 -96.9 11.0 -11.5 23.6 31.4 61 62 A G S < S+ 0 0 62 -3,-1.5 2,-0.3 -4,-0.3 -3,-0.2 0.010 88.9 16.8 96.9 -25.5 -12.5 27.2 31.6 62 63 A S S > S- 0 0 50 -5,-0.4 3,-1.4 -6,-0.2 4,-0.1 -0.957 72.2-113.4-174.0 149.9 -11.2 28.0 35.0 63 64 A G G > S+ 0 0 10 -2,-0.3 3,-1.7 1,-0.3 25,-0.8 0.774 113.2 71.3 -63.2 -26.2 -8.8 26.8 37.7 64 65 A A G 3 S+ 0 0 51 1,-0.3 -1,-0.3 23,-0.2 23,-0.1 0.753 95.5 51.3 -59.7 -26.0 -11.9 26.3 39.8 65 66 A N G < S+ 0 0 12 -3,-1.4 233,-2.3 -8,-0.1 2,-0.5 0.403 98.4 74.6 -93.3 -0.4 -12.8 23.3 37.5 66 67 A V B < -i 298 0C 0 -3,-1.7 22,-2.2 231,-0.2 2,-0.6 -0.973 61.8-170.6-119.9 115.3 -9.5 21.6 37.9 67 68 A H E -j 88 0D 18 231,-2.7 2,-0.3 -2,-0.5 22,-0.3 -0.931 20.1-135.3-107.9 108.6 -8.8 19.8 41.2 68 69 A Y E -j 89 0D 0 20,-2.8 22,-3.3 -2,-0.6 2,-1.0 -0.523 15.3-131.0 -66.5 126.5 -5.3 18.7 41.7 69 70 A A E > -j 90 0D 5 231,-1.8 3,-2.1 -2,-0.3 4,-0.4 -0.719 16.4-161.5 -78.8 99.9 -5.1 15.1 43.1 70 71 A A G > S+ 0 0 1 20,-2.1 3,-1.1 -2,-1.0 -1,-0.2 0.673 80.8 76.7 -57.6 -25.2 -2.7 15.5 46.0 71 72 A X G 3 S+ 0 0 39 1,-0.3 -1,-0.3 19,-0.2 789,-0.3 0.747 84.0 64.9 -60.8 -27.3 -2.1 11.7 46.1 72 73 A A G < S- 0 0 0 -3,-2.1 332,-3.7 1,-0.3 335,-0.5 0.866 131.5 -33.2 -61.4 -39.9 0.2 12.1 43.0 73 74 A F < - 0 0 11 -3,-1.1 2,-0.4 -4,-0.4 -1,-0.3 -0.650 69.2-179.7 176.1 122.3 2.6 14.2 45.1 74 75 A L + 0 0 8 -3,-0.2 2,-0.3 -2,-0.2 787,-0.1 -0.998 16.2 137.1-138.3 142.6 2.1 16.6 48.0 75 76 A C > - 0 0 2 -2,-0.4 4,-2.5 21,-0.0 5,-0.2 -0.904 64.6 -91.0-161.5 171.3 4.2 18.7 50.3 76 77 A S H > S+ 0 0 4 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.852 123.8 54.2 -57.9 -36.5 3.7 22.3 51.5 77 78 A E H > S+ 0 0 25 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.940 111.0 45.0 -65.9 -45.7 5.6 23.8 48.6 78 79 A V H > S+ 0 0 2 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.904 108.4 56.3 -63.7 -42.0 3.4 22.1 46.0 79 80 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.902 107.9 50.9 -54.3 -38.6 0.2 23.0 47.9 80 81 A R H X S+ 0 0 86 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.896 107.7 51.9 -65.2 -44.5 1.5 26.6 47.5 81 82 A W H X S+ 0 0 2 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.939 111.0 46.2 -56.6 -50.4 2.0 26.2 43.8 82 83 A I H X>S+ 0 0 0 -4,-2.7 5,-1.7 1,-0.2 4,-0.6 0.902 112.1 53.1 -60.6 -39.9 -1.6 24.8 43.3 83 84 A S H ><5S+ 0 0 33 -4,-2.1 3,-1.2 -5,-0.3 -2,-0.2 0.961 111.7 43.7 -60.1 -49.8 -2.9 27.7 45.4 84 85 A E H 3<5S+ 0 0 122 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.827 109.1 56.5 -65.1 -35.7 -1.1 30.4 43.4 85 86 A E H 3<5S- 0 0 33 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.540 114.2-118.6 -76.8 -4.3 -2.1 28.8 40.0 86 87 A G T <<5 + 0 0 31 -3,-1.2 -20,-0.2 -4,-0.6 -3,-0.2 0.605 66.8 133.1 79.8 14.4 -5.8 29.0 41.1 87 88 A L < - 0 0 0 -5,-1.7 -1,-0.2 1,-0.1 -20,-0.2 -0.445 54.0-115.7 -87.6 169.4 -6.7 25.3 41.1 88 89 A C E -j 67 0D 14 -22,-2.2 -20,-2.8 -25,-0.8 2,-0.4 -0.488 25.4-127.8 -93.1 170.6 -8.5 23.4 43.8 89 90 A L E -jk 68 110D 0 20,-2.8 22,-2.3 -22,-0.3 2,-0.5 -0.987 8.4-153.4-130.3 125.9 -7.0 20.6 45.8 90 91 A D E -jk 69 111D 9 -22,-3.3 -20,-2.1 -2,-0.4 2,-0.3 -0.863 16.8-172.7 -96.7 127.9 -8.3 17.0 46.4 91 92 A V E - k 0 112D 2 20,-3.1 22,-3.1 -2,-0.5 3,-0.1 -0.876 12.8-165.8-123.4 154.6 -7.1 15.4 49.6 92 93 A a + 0 0 4 -2,-0.3 2,-0.2 20,-0.2 -1,-0.1 0.781 63.4 12.6-119.5 -41.2 -7.7 11.8 50.6 93 94 A T S > S- 0 0 2 767,-0.2 4,-1.9 24,-0.1 3,-0.3 -0.720 86.0 -86.9-131.4-171.4 -7.0 11.3 54.3 94 95 A G H > S+ 0 0 19 -2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.830 122.2 57.3 -66.0 -33.0 -6.4 13.3 57.4 95 96 A G H > S+ 0 0 11 765,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.868 106.0 48.4 -67.3 -38.0 -2.7 13.6 56.8 96 97 A E H > S+ 0 0 3 764,-0.6 4,-2.4 -3,-0.3 -2,-0.2 0.918 113.4 48.4 -69.6 -41.7 -3.2 15.2 53.3 97 98 A L H X S+ 0 0 3 -4,-1.9 4,-2.9 2,-0.2 5,-0.3 0.963 110.8 49.5 -58.3 -54.2 -5.7 17.6 54.8 98 99 A A H X S+ 0 0 31 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.895 110.8 50.1 -58.7 -36.0 -3.4 18.6 57.7 99 100 A V H X S+ 0 0 0 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.929 112.4 48.8 -67.2 -42.5 -0.4 19.1 55.2 100 101 A A H <>S+ 0 0 0 -4,-2.4 5,-2.9 2,-0.2 -2,-0.2 0.907 113.7 44.9 -58.9 -45.2 -2.7 21.3 53.1 101 102 A L H ><5S+ 0 0 62 -4,-2.9 3,-2.2 1,-0.2 -2,-0.2 0.898 108.9 56.5 -68.8 -39.9 -3.9 23.4 56.1 102 103 A H H 3<5S+ 0 0 115 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.818 107.3 50.4 -53.6 -35.8 -0.3 23.6 57.4 103 104 A A T 3<5S- 0 0 12 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.260 118.4-117.0 -86.6 12.2 0.5 25.2 54.0 104 105 A S T < 5 + 0 0 101 -3,-2.2 -3,-0.2 1,-0.2 -2,-0.1 0.834 49.0 174.9 46.2 39.1 -2.4 27.6 54.5 105 106 A F < - 0 0 4 -5,-2.9 -1,-0.2 -6,-0.1 5,-0.1 -0.569 44.5-102.3 -66.3 131.8 -4.3 26.1 51.4 106 107 A P > - 0 0 29 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 -0.484 28.7-146.9 -64.2 114.4 -7.7 27.9 51.3 107 108 A P G > S+ 0 0 36 0, 0.0 24,-2.2 0, 0.0 3,-1.8 0.742 93.6 66.2 -57.4 -29.7 -10.2 25.3 52.7 108 109 A E G 3 S+ 0 0 130 1,-0.3 22,-0.1 22,-0.3 21,-0.1 0.700 101.2 51.8 -67.8 -15.0 -13.0 26.4 50.5 109 110 A R G < S+ 0 0 66 -3,-2.3 -20,-2.8 22,-0.1 2,-0.4 0.148 94.6 98.9-101.0 15.2 -10.9 25.1 47.5 110 111 A I E < -k 89 0D 0 -3,-1.8 22,-1.8 -22,-0.2 21,-0.5 -0.852 51.2-168.0-107.2 138.7 -10.4 21.7 49.2 111 112 A T E -kl 90 132D 3 -22,-2.3 -20,-3.1 -2,-0.4 2,-0.5 -0.997 13.2-143.8-122.9 137.1 -12.3 18.5 48.5 112 113 A L E -kl 91 133D 1 20,-1.8 22,-2.6 -2,-0.4 2,-0.2 -0.867 21.1-179.4-102.0 125.0 -12.1 15.4 50.7 113 114 A H + 0 0 14 -22,-3.1 2,-0.1 -2,-0.5 22,-0.1 -0.714 17.5 118.9-115.3 165.7 -12.2 12.0 49.1 114 115 A G > - 0 0 4 -2,-0.2 3,-0.5 20,-0.2 22,-0.3 -0.298 53.2-129.6 140.7 137.9 -12.0 8.5 50.5 115 116 A N T 3 S+ 0 0 1 1,-0.2 665,-0.1 704,-0.2 25,-0.1 0.595 108.6 30.9 -76.6 -17.1 -13.8 5.2 50.9 116 117 A N T 3 S+ 0 0 8 703,-0.3 2,-0.2 665,-0.0 -1,-0.2 -0.347 73.0 173.3-145.0 58.2 -13.3 5.0 54.6 117 118 A K < - 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0 0 29 -4,-2.0 -1,-0.2 -5,-0.4 -3,-0.1 -0.006 38.5 -47.6 78.5 168.6 -4.6 2.6 68.7 486 40 B T S S+ 0 0 26 -4,-0.1 274,-0.2 2,-0.0 2,-0.1 -0.845 103.5 50.3-120.9 161.0 -5.1 0.9 65.3 487 41 B P S S+ 0 0 15 0, 0.0 379,-0.6 0, 0.0 2,-0.4 0.688 80.7 172.8 -61.8 156.7 -3.7 -0.1 62.8 488 42 B L E -De 759 866I 0 271,-1.9 271,-3.2 -2,-0.1 2,-0.5 -0.979 34.1-143.5-144.1 126.7 -1.2 -1.9 65.1 489 43 B F E -De 758 867I 6 377,-2.4 379,-2.6 -2,-0.4 2,-0.5 -0.812 23.6-161.9 -81.8 123.8 1.6 -4.4 64.5 490 44 B V E -De 757 868I 0 267,-2.7 267,-1.8 -2,-0.5 2,-0.6 -0.957 0.9-158.6-113.1 117.2 1.5 -6.8 67.4 491 45 B I E -De 756 869I 4 377,-3.2 379,-2.9 -2,-0.5 2,-1.2 -0.865 12.3-148.9-101.7 118.1 4.7 -8.9 68.0 492 46 B D E > - e 0 870I 0 263,-3.1 4,-2.1 -2,-0.6 5,-0.2 -0.731 17.9-167.8 -78.6 99.6 4.5 -12.2 69.9 493 47 B E H > S+ 0 0 8 377,-2.3 4,-2.4 -2,-1.2 -1,-0.2 0.907 82.0 50.4 -62.5 -45.5 8.0 -11.9 71.3 494 48 B D H > S+ 0 0 56 376,-0.5 4,-2.7 1,-0.2 -1,-0.2 0.889 108.1 53.6 -54.9 -44.6 8.2 -15.5 72.6 495 49 B D H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.954 109.7 47.8 -56.0 -52.8 7.0 -16.8 69.2 496 50 B F H X S+ 0 0 5 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.929 113.9 46.9 -56.3 -47.3 9.9 -14.9 67.4 497 51 B R H X S+ 0 0 23 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.883 109.4 54.3 -62.6 -43.0 12.4 -16.2 69.9 498 52 B S H X S+ 0 0 29 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.855 106.3 51.8 -54.0 -45.5 11.1 -19.8 69.6 499 53 B R H X S+ 0 0 32 -4,-2.0 4,-2.0 2,-0.2 5,-0.2 0.888 111.0 48.7 -58.3 -44.2 11.5 -19.7 65.9 500 54 B C H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.942 113.5 46.9 -59.5 -52.1 15.2 -18.5 66.4 501 55 B R H X S+ 0 0 125 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.877 114.2 44.8 -63.2 -41.0 15.8 -21.3 68.9 502 56 B E H X S+ 0 0 68 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.889 114.6 47.5 -78.7 -32.0 14.3 -24.1 66.9 503 57 B T H X S+ 0 0 5 -4,-2.0 4,-2.0 2,-0.2 6,-0.2 0.897 111.4 52.2 -71.4 -40.1 16.0 -23.1 63.6 504 58 B A H <>S+ 0 0 13 -4,-2.5 5,-0.8 -5,-0.2 4,-0.2 0.930 113.4 44.1 -59.3 -46.0 19.3 -22.7 65.4 505 59 B A H ><5S+ 0 0 78 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.916 110.7 54.2 -66.4 -42.3 18.9 -26.2 66.8 506 60 B A H 3<5S+ 0 0 27 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.817 112.2 44.2 -62.6 -34.2 17.8 -27.7 63.5 507 61 B F T 3<5S- 0 0 17 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.314 119.3-106.0 -95.4 8.1 20.9 -26.3 61.7 508 62 B G T < 5S+ 0 0 64 -3,-1.5 2,-0.3 -4,-0.2 -3,-0.2 0.035 89.3 8.9 97.6 -24.8 23.3 -27.4 64.5 509 63 B S S > S+ 0 0 10 1,-0.3 3,-1.5 -2,-0.3 25,-0.9 0.753 114.3 70.2 -59.9 -26.6 22.8 -20.2 65.7 511 65 B A G 3 S+ 0 0 43 1,-0.3 -1,-0.3 23,-0.2 23,-0.1 0.737 96.6 51.9 -63.1 -22.7 26.0 -19.5 63.9 512 66 B N G < S+ 0 0 22 -3,-1.5 233,-2.2 -8,-0.1 2,-0.5 0.384 99.5 73.3 -95.3 3.2 24.6 -21.4 60.9 513 67 B V B < -k 745 0K 0 -3,-1.5 22,-2.1 231,-0.2 2,-0.7 -0.966 62.6-171.1-123.9 110.9 21.3 -19.4 60.9 514 68 B H E -l 535 0L 15 231,-3.1 22,-0.3 -2,-0.5 2,-0.2 -0.910 20.0-135.7-106.8 109.2 21.6 -15.8 59.6 515 69 B Y E -l 536 0L 0 20,-2.9 22,-3.4 -2,-0.7 2,-0.9 -0.440 15.1-132.2 -68.1 129.0 18.5 -13.7 60.1 516 70 B A E > -l 537 0L 6 231,-1.8 3,-1.8 -2,-0.2 4,-0.4 -0.739 15.4-161.5 -84.3 103.5 17.7 -11.7 57.0 517 71 B A G > S+ 0 0 1 20,-2.0 3,-0.6 -2,-0.9 -1,-0.2 0.682 80.1 79.1 -63.2 -22.4 17.0 -8.2 58.4 518 72 B X G 3 S+ 0 0 39 19,-0.3 -1,-0.3 1,-0.2 -105,-0.2 0.767 84.3 63.3 -56.7 -27.1 15.2 -7.2 55.2 519 73 B A G < S- 0 0 1 -3,-1.8 332,-2.9 1,-0.3 335,-0.5 0.902 131.8 -31.0 -65.8 -40.4 12.1 -9.0 56.6 520 74 B F < - 0 0 10 -3,-0.6 2,-0.4 -4,-0.4 -1,-0.3 -0.729 68.8-180.0-178.9 125.7 12.0 -6.6 59.5 521 75 B L + 0 0 9 -2,-0.2 2,-0.3 -3,-0.2 -107,-0.1 -0.999 16.7 136.3-139.6 136.8 14.6 -4.7 61.4 522 76 B C > - 0 0 2 -2,-0.4 4,-2.4 24,-0.0 5,-0.2 -0.883 64.6 -92.7-153.6 173.5 14.8 -2.2 64.3 523 77 B S H > S+ 0 0 21 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.873 124.2 55.8 -57.8 -41.6 17.2 -2.0 67.3 524 78 B E H > S+ 0 0 20 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.958 110.1 44.3 -56.3 -50.0 14.9 -4.1 69.5 525 79 B V H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.904 108.6 56.2 -63.6 -42.7 14.9 -7.0 66.9 526 80 B A H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.919 107.3 52.7 -55.8 -42.4 18.7 -6.8 66.4 527 81 B R H X S+ 0 0 87 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.907 107.8 49.0 -55.0 -48.3 18.9 -7.3 70.2 528 82 B W H X S+ 0 0 1 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.947 111.9 49.2 -60.6 -48.1 16.7 -10.4 70.1 529 83 B I H X>S+ 0 0 0 -4,-2.7 5,-1.7 2,-0.2 4,-0.6 0.951 112.5 47.5 -55.0 -50.1 18.8 -11.9 67.2 530 84 B S H ><5S+ 0 0 31 -4,-2.7 3,-1.2 1,-0.2 -2,-0.2 0.930 113.9 47.3 -58.4 -48.1 22.0 -11.2 69.1 531 85 B E H 3<5S+ 0 0 104 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.817 108.0 54.5 -63.0 -36.6 20.7 -12.7 72.4 532 86 B E H 3<5S- 0 0 31 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.504 116.4-116.2 -77.7 -5.6 19.3 -15.8 70.6 533 87 B G T <<5 + 0 0 33 -3,-1.2 -3,-0.2 -4,-0.6 -20,-0.2 0.618 67.6 133.0 85.7 15.4 22.8 -16.4 69.2 534 88 B L < - 0 0 0 -5,-1.7 -1,-0.2 1,-0.1 -23,-0.2 -0.465 53.6-113.3 -91.9 168.0 22.1 -16.0 65.5 535 89 B C E -l 514 0L 12 -22,-2.1 -20,-2.9 -25,-0.9 2,-0.4 -0.449 25.8-130.7 -90.2 171.6 23.9 -14.1 62.8 536 90 B L E -lm 515 557L 0 20,-2.9 22,-2.8 -22,-0.3 2,-0.5 -0.992 6.9-152.4-134.2 127.4 22.5 -11.1 61.0 537 91 B D E -lm 516 558L 7 -22,-3.4 -20,-2.0 -2,-0.4 2,-0.3 -0.879 16.2-170.4 -99.8 125.0 22.3 -10.4 57.2 538 92 B V E - m 0 559L 1 20,-3.0 22,-3.2 -2,-0.5 3,-0.1 -0.886 11.3-167.8-118.2 152.7 22.3 -6.8 56.3 539 93 B b + 0 0 5 -2,-0.3 2,-0.2 20,-0.2 -1,-0.1 0.789 62.8 10.5-116.0 -41.3 21.7 -5.4 52.8 540 94 B T S > S- 0 0 2 -127,-0.2 4,-2.0 24,-0.1 3,-0.2 -0.755 86.7 -85.7-128.9-174.6 22.6 -1.7 52.5 541 95 B G H > S+ 0 0 23 -2,-0.2 4,-3.1 1,-0.2 5,-0.1 0.836 123.4 56.7 -58.6 -35.1 24.5 0.9 54.6 542 96 B G H > S+ 0 0 11 -129,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.879 106.0 48.1 -66.7 -40.6 21.3 1.8 56.6 543 97 B E H > S+ 0 0 4 -130,-0.6 4,-2.5 2,-0.2 -2,-0.2 0.956 114.0 48.3 -65.7 -44.8 20.7 -1.8 57.8 544 98 B L H X S+ 0 0 7 -4,-2.0 4,-2.9 1,-0.2 5,-0.3 0.960 111.0 50.2 -54.5 -56.2 24.4 -1.9 58.8 545 99 B A H X S+ 0 0 29 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.851 111.0 48.9 -52.9 -37.8 24.1 1.4 60.6 546 100 B V H X S+ 0 0 1 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.938 112.3 49.1 -70.5 -40.8 21.0 0.2 62.5 547 101 B A H <>S+ 0 0 0 -4,-2.5 5,-2.7 2,-0.2 3,-0.3 0.922 113.7 44.8 -59.5 -48.8 22.7 -3.0 63.4 548 102 B L H ><5S+ 0 0 60 -4,-2.9 3,-1.9 1,-0.2 -2,-0.2 0.909 109.8 56.7 -66.5 -38.4 25.8 -1.2 64.7 549 103 B H H 3<5S+ 0 0 111 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.825 107.0 49.3 -56.3 -36.4 23.6 1.3 66.5 550 104 B A T 3<5S- 0 0 23 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.266 119.3-112.3 -88.4 5.6 22.0 -1.6 68.3 551 105 B S T < 5 + 0 0 102 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.770 51.9 173.3 70.4 26.2 25.4 -2.9 69.3 552 106 B F < - 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