==== 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 03-JUN-04 1W0D . COMPND 2 MOLECULE: 3-ISOPROPYLMALATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR R.K.SINGH,G.KEFALA,R.JANOWSKI,C.MUELLER-DIECKMANN,M.S.WEISS, . 1348 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48058.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1007 74.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 132 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 116 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 92 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 143 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 458 34.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 35 2.6 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 5 1 7 3 1 7 0 0 4 4 8 1 7 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 12 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 . 4 0 4 8 0 0 4 0 2 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 1 0 1 0 0 0 4 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 M 0 0 25 0, 0.0 2,-0.2 0, 0.0 30,-0.0 0.000 360.0 360.0 360.0-116.8 -8.8 62.2 8.2 2 1AA S + 0 0 70 26,-0.1 30,-2.5 30,-0.0 2,-0.4 -0.606 360.0 34.8 131.3 -64.2 -12.1 61.1 6.6 3 2 A K E -a 32 0A 97 28,-0.2 59,-1.8 -2,-0.2 60,-1.0 -0.979 63.2-172.5-126.5 121.2 -11.9 57.9 4.4 4 3 A L E -ab 33 63A 0 28,-3.7 30,-3.0 -2,-0.4 2,-0.5 -0.958 13.9-155.5-123.9 125.5 -9.5 55.1 5.2 5 4 A A E -ab 34 64A 0 58,-2.6 60,-3.2 -2,-0.5 2,-0.5 -0.864 18.2-157.6 -90.9 130.3 -8.7 52.1 3.1 6 5 A I E +ab 35 65A 9 28,-3.4 30,-3.1 -2,-0.5 2,-0.6 -0.936 18.7 179.8-117.1 123.6 -7.5 49.2 5.3 7 6 A I E + b 0 66A 0 58,-3.8 60,-2.8 -2,-0.5 30,-0.1 -0.770 8.2 170.0-119.1 87.8 -5.4 46.4 4.0 8 7 A A E + 0 0 15 -2,-0.6 60,-1.8 28,-0.5 2,-0.2 0.876 26.3 176.1 -71.2 -34.4 -4.8 44.3 7.1 9 8 A G E - b 0 68A 0 27,-0.6 60,-0.2 58,-0.2 -1,-0.2 -0.488 26.6 -16.0 80.1-134.9 -3.4 41.6 4.8 10 9 A D S > S- 0 0 6 58,-3.0 3,-3.2 -2,-0.2 58,-0.1 -0.550 97.0 -5.6-113.1 168.7 -1.8 38.4 6.0 11 10 A G T 3 S- 0 0 19 1,-0.3 4,-0.4 -2,-0.2 263,-0.2 -0.282 133.4 -3.2 55.7-121.1 -0.4 36.6 9.0 12 11 A I T 3> S+ 0 0 7 261,-2.4 4,-2.3 1,-0.2 5,-0.3 0.470 111.2 98.2 -81.1 -2.0 -0.3 39.0 11.9 13 12 A G H <> S+ 0 0 0 -3,-3.2 4,-2.8 1,-0.2 5,-0.3 0.926 81.6 47.5 -53.3 -55.5 -1.5 41.8 9.7 14 13 A P H > S+ 0 0 47 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.920 112.3 47.6 -56.0 -46.9 -5.1 41.6 10.8 15 14 A E H > S+ 0 0 30 -4,-0.4 4,-1.0 1,-0.2 -2,-0.2 0.867 117.7 41.1 -66.8 -34.2 -4.4 41.4 14.6 16 15 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.865 114.7 52.0 -77.6 -36.6 -2.0 44.4 14.6 17 16 A T H X S+ 0 0 3 -4,-2.8 4,-2.7 -5,-0.3 5,-0.2 0.881 102.5 59.3 -67.1 -38.0 -4.1 46.3 12.2 18 17 A A H X S+ 0 0 49 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.895 109.5 44.2 -53.6 -42.3 -7.2 45.8 14.4 19 18 A E H X S+ 0 0 21 -4,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.890 112.1 51.6 -68.6 -39.7 -5.3 47.5 17.2 20 19 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.874 111.1 49.0 -66.7 -35.7 -4.0 50.3 14.9 21 20 A V H X S+ 0 0 19 -4,-2.7 4,-3.4 2,-0.2 -1,-0.2 0.905 107.8 53.3 -71.5 -40.3 -7.6 50.9 13.8 22 21 A K H X S+ 0 0 140 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.912 111.7 46.5 -56.9 -43.3 -8.8 51.0 17.4 23 22 A V H X S+ 0 0 0 -4,-2.5 4,-1.4 2,-0.2 5,-0.2 0.953 112.4 49.3 -67.3 -45.9 -6.2 53.7 18.1 24 23 A L H >X S+ 0 0 2 -4,-2.7 4,-2.4 1,-0.2 3,-0.5 0.933 111.3 50.4 -56.8 -44.6 -7.1 55.6 14.9 25 24 A D H 3< S+ 0 0 54 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.847 109.2 51.8 -60.5 -37.0 -10.8 55.4 15.9 26 25 A A H 3< S+ 0 0 55 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.707 116.9 37.4 -74.7 -21.8 -10.0 56.7 19.4 27 26 A V H << S+ 0 0 13 -4,-1.4 -2,-0.2 -3,-0.5 -1,-0.2 0.708 130.3 26.9-102.6 -24.6 -8.1 59.7 18.2 28 27 A V S >< S- 0 0 19 -4,-2.4 3,-0.5 -5,-0.2 -1,-0.3 -0.787 81.0-162.5-136.2 88.2 -10.2 60.6 15.2 29 28 A P T 3 + 0 0 106 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.318 67.8 39.4 -63.5 155.3 -13.8 59.4 15.6 30 29 A G T 3 S+ 0 0 70 1,-0.2 2,-0.4 -5,-0.1 -5,-0.1 0.692 71.3 156.7 78.6 21.7 -16.1 59.1 12.6 31 30 A V < - 0 0 14 -3,-0.5 2,-0.6 -6,-0.1 -1,-0.2 -0.666 41.0-133.1 -79.7 130.0 -13.6 57.7 10.1 32 31 A Q E -a 3 0A 122 -30,-2.5 -28,-3.7 -2,-0.4 2,-0.5 -0.771 28.5-163.8 -78.3 120.9 -15.2 55.8 7.2 33 32 A K E -a 4 0A 84 -2,-0.6 2,-0.5 -30,-0.2 -28,-0.2 -0.935 14.3-168.6-113.4 131.2 -13.2 52.6 6.9 34 33 A T E -a 5 0A 51 -30,-3.0 -28,-3.4 -2,-0.5 2,-0.5 -0.984 14.7-151.9-115.1 126.0 -13.2 50.3 4.0 35 34 A S E -a 6 0A 92 -2,-0.5 2,-0.5 -30,-0.2 -28,-0.2 -0.841 8.3-163.6-101.7 134.3 -11.5 47.0 4.6 36 35 A Y - 0 0 21 -30,-3.1 2,-1.0 -2,-0.5 -27,-0.6 -0.971 18.2-148.8-117.6 128.9 -9.9 45.0 1.8 37 36 A D + 0 0 70 -2,-0.5 2,-0.3 -30,-0.1 -30,-0.1 -0.907 44.2 149.9 -82.8 101.4 -8.9 41.5 1.8 38 37 A L + 0 0 0 -2,-1.0 2,-0.4 4,-0.1 3,-0.2 -0.951 40.8 42.4-124.7 152.8 -5.9 41.8 -0.5 39 38 A G S > S- 0 0 0 -2,-0.3 4,-2.5 9,-0.3 5,-0.2 -0.852 120.0 -11.5 111.8-145.8 -2.9 39.6 -0.2 40 39 A A H > S+ 0 0 6 -2,-0.4 4,-2.9 2,-0.2 5,-0.2 0.760 131.8 53.3 -61.7 -37.2 -3.2 35.8 0.4 41 40 A R H > S+ 0 0 115 -3,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.981 116.5 38.2 -65.2 -57.7 -6.9 35.6 1.3 42 41 A R H >>S+ 0 0 38 2,-0.2 4,-3.0 1,-0.2 6,-0.9 0.875 115.2 55.8 -56.3 -41.8 -8.1 37.4 -1.9 43 42 A F H X5S+ 0 0 44 -4,-2.5 4,-1.6 4,-0.2 -2,-0.2 0.940 113.5 39.9 -63.3 -43.5 -5.3 35.6 -3.9 44 43 A H H <5S+ 0 0 100 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.952 118.6 48.0 -68.9 -41.7 -6.6 32.2 -2.9 45 44 A A H <5S+ 0 0 77 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.889 135.9 3.3 -62.8 -42.7 -10.3 33.2 -3.2 46 45 A T H <5S- 0 0 75 -4,-3.0 -3,-0.2 2,-0.2 -2,-0.2 0.524 89.9-113.8-126.4 -11.9 -10.1 34.9 -6.6 47 46 A G S <> - 0 0 22 0, 0.0 3,-2.6 0, 0.0 4,-1.4 -0.231 26.4-117.2 -52.7 133.7 -6.9 44.0 -9.8 52 51 A D H 3> S+ 0 0 126 1,-0.3 4,-1.5 2,-0.2 3,-0.0 0.794 116.3 52.5 -41.4 -41.5 -6.8 47.2 -11.8 53 52 A S H 3> S+ 0 0 81 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.666 100.3 61.2 -73.6 -24.3 -10.1 48.2 -10.3 54 53 A V H <> S+ 0 0 6 -3,-2.6 4,-3.1 2,-0.2 -1,-0.2 0.915 102.5 50.7 -67.4 -46.4 -8.9 47.7 -6.7 55 54 A V H X S+ 0 0 1 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.952 109.6 53.3 -54.2 -46.4 -6.2 50.4 -7.3 56 55 A A H < S+ 0 0 50 -4,-1.5 4,-0.4 1,-0.2 -2,-0.2 0.864 110.4 45.2 -55.0 -41.0 -9.2 52.5 -8.6 57 56 A E H >< S+ 0 0 105 -4,-1.8 3,-1.8 2,-0.2 -1,-0.2 0.916 108.4 57.0 -68.3 -41.8 -11.1 51.9 -5.3 58 57 A L H >< S+ 0 0 0 -4,-3.1 3,-1.8 1,-0.3 -2,-0.2 0.910 99.4 60.2 -59.3 -38.3 -8.0 52.6 -3.2 59 58 A R T 3< S+ 0 0 104 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.679 90.9 71.2 -58.0 -21.1 -7.8 56.0 -4.9 60 59 A N T < S+ 0 0 112 -3,-1.8 -1,-0.3 -4,-0.4 2,-0.2 0.491 91.3 75.2 -73.3 -5.2 -11.3 56.8 -3.5 61 60 A H S < S- 0 0 16 -3,-1.8 -57,-0.2 -4,-0.2 3,-0.1 -0.708 81.3-126.9-112.2 159.1 -9.8 57.0 0.0 62 61 A D S S- 0 0 59 -59,-1.8 203,-0.6 -2,-0.2 2,-0.3 0.776 88.0 -17.5 -72.0 -30.2 -7.7 59.6 1.9 63 62 A A E -bc 4 265A 0 -60,-1.0 -58,-2.6 201,-0.2 2,-0.4 -0.969 62.9-119.8-165.9 167.0 -5.1 57.1 2.8 64 63 A I E -bc 5 266A 0 201,-2.8 203,-2.4 -2,-0.3 2,-0.5 -0.966 11.2-158.2-120.3 136.3 -4.4 53.5 3.2 65 64 A L E -bc 6 267A 1 -60,-3.2 -58,-3.8 -2,-0.4 2,-0.4 -0.957 17.6-170.9-109.2 123.2 -3.4 51.6 6.3 66 65 A L E -b 7 0A 1 201,-3.1 -58,-0.3 -2,-0.5 3,-0.1 -0.930 15.1-169.9-117.4 144.4 -1.7 48.3 5.5 67 66 A G E - 0 0 0 -60,-2.8 2,-0.3 -2,-0.4 -58,-0.2 0.833 58.1 -50.9 -90.6 -87.9 -0.8 45.6 8.0 68 67 A A E -b 9 0A 1 -60,-1.8 -58,-3.0 -58,-0.1 2,-0.4 -0.992 43.1-148.5-154.5 154.0 1.4 43.1 6.3 69 68 A I + 0 0 21 -2,-0.3 204,-0.4 -60,-0.2 2,-0.1 -0.942 48.1 79.1-125.2 140.4 1.5 41.0 3.2 70 69 A G - 0 0 21 -2,-0.4 3,-0.0 202,-0.1 -2,-0.0 -0.122 32.7-179.0 134.0 129.5 3.0 37.6 2.6 71 70 A D > - 0 0 52 3,-0.1 3,-2.0 4,-0.1 8,-0.1 -0.960 34.6-128.2-153.7 138.4 2.1 34.1 3.2 72 71 A P T 3 S+ 0 0 108 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 0.664 105.8 69.8 -62.6 -17.0 4.1 30.9 2.4 73 72 A S T 3 S+ 0 0 62 2,-0.1 0, 0.0 -3,-0.0 0, 0.0 0.635 86.3 77.3 -71.2 -19.7 1.0 29.6 0.7 74 73 A V S < S- 0 0 13 -3,-2.0 -3,-0.1 1,-0.1 3,-0.1 -0.819 96.0-101.2 -96.6 138.4 1.3 32.1 -2.1 75 74 A P > - 0 0 74 0, 0.0 3,-1.5 0, 0.0 4,-0.5 -0.146 57.8 -71.1 -54.2 146.8 3.9 31.4 -4.9 76 75 A S T 3 S- 0 0 124 1,-0.2 2,-0.2 2,-0.1 0, 0.0 0.025 109.5 -7.6 -41.1 134.4 7.1 33.4 -4.7 77 76 A G T 3>>S+ 0 0 34 -3,-0.1 4,-2.8 1,-0.1 5,-0.9 0.286 95.6 116.0 66.5 -14.9 7.0 37.2 -5.4 78 77 A V H <>5S+ 0 0 47 -3,-1.5 4,-1.2 -2,-0.2 -1,-0.1 0.934 88.7 28.7 -51.7 -51.2 3.4 37.1 -6.6 79 78 A L H >>S+ 0 0 8 -4,-0.5 4,-2.1 3,-0.2 5,-2.1 0.879 122.0 52.8 -76.6 -42.2 2.2 39.3 -3.7 80 79 A E H 4>S+ 0 0 67 3,-0.2 5,-3.1 2,-0.2 6,-0.3 0.958 123.9 24.2 -62.0 -52.9 5.5 41.2 -3.3 81 80 A R H <>S+ 0 0 78 -4,-2.8 5,-1.0 3,-0.2 -3,-0.2 0.914 131.5 41.7 -77.2 -40.7 5.9 42.3 -7.0 82 81 A G H <S+ 0 0 42 -4,-1.7 5,-2.8 2,-0.2 4,-0.2 0.909 116.1 39.1 -67.5 -43.2 3.8 51.6 -4.8 89 88 A F H ><5S+ 0 0 69 -4,-2.7 3,-1.2 3,-0.2 -2,-0.2 0.963 117.7 48.4 -70.9 -50.0 4.2 52.3 -8.5 90 89 A E H 3<5S+ 0 0 70 -4,-3.5 -2,-0.2 1,-0.3 -3,-0.2 0.847 116.9 41.8 -58.2 -36.4 0.5 52.7 -9.3 91 90 A L T 3<5S- 0 0 0 -4,-2.5 172,-0.3 -5,-0.3 -1,-0.3 0.379 110.3-121.8 -95.8 4.1 -0.1 55.0 -6.4 92 91 A D T < 5 + 0 0 39 -3,-1.2 2,-2.3 -4,-0.2 3,-0.3 0.933 40.3 177.4 59.5 47.5 3.1 57.0 -7.1 93 92 A H < + 0 0 0 -5,-2.8 165,-0.2 1,-0.2 -1,-0.2 -0.461 15.9 155.1 -80.1 69.6 4.5 56.3 -3.6 94 93 A H + 0 0 0 -2,-2.3 30,-2.4 163,-0.2 2,-0.6 0.709 55.0 67.2 -74.8 -19.4 7.7 58.1 -4.5 95 94 A I E -DE 123 257A 0 162,-2.6 162,-3.4 -3,-0.3 2,-0.7 -0.897 61.2-170.2-104.7 121.2 8.4 59.0 -0.9 96 95 A N E -DE 122 256A 6 26,-2.6 26,-3.1 -2,-0.6 2,-0.6 -0.961 14.3-161.0-106.9 110.3 9.3 56.1 1.4 97 96 A L E +DE 121 255A 11 158,-3.2 158,-2.4 -2,-0.7 24,-0.2 -0.854 15.4 172.8 -98.3 122.1 9.2 57.7 4.9 98 97 A R E -D 120 0A 5 22,-2.6 22,-2.5 -2,-0.6 156,-0.2 -0.797 13.9-160.8-135.1 93.7 11.1 55.7 7.5 99 98 A P E -D 119 0A 38 0, 0.0 2,-0.4 0, 0.0 154,-0.4 -0.479 1.8-163.2 -75.5 144.2 11.5 57.4 10.9 100 99 A A E +D 118 0A 2 18,-3.8 18,-2.9 -2,-0.1 2,-0.4 -0.894 22.5 155.3-132.9 99.0 14.2 56.0 13.2 101 100 A R E -D 117 0A 89 -2,-0.4 2,-0.7 16,-0.3 16,-0.2 -0.994 35.9-140.4-129.2 135.7 13.8 57.0 16.8 102 101 A L - 0 0 11 14,-2.2 14,-0.4 -2,-0.4 145,-0.1 -0.857 28.8-158.9 -97.6 112.1 15.2 55.1 19.7 103 102 A Y > - 0 0 24 -2,-0.7 3,-2.3 143,-0.4 14,-0.0 -0.693 26.5 -96.0 -96.3 148.3 12.6 55.2 22.5 104 103 A P T 3 S+ 0 0 39 0, 0.0 687,-0.2 0, 0.0 214,-0.1 -0.323 116.3 37.6 -49.5 131.6 12.9 54.8 26.2 105 104 A G T 3 S+ 0 0 3 684,-1.8 2,-0.5 685,-0.3 686,-0.1 0.301 98.4 97.8 101.9 -10.2 11.9 51.1 26.8 106 105 A V < - 0 0 2 -3,-2.3 2,-0.4 683,-0.1 -1,-0.2 -0.950 67.0-137.4-118.0 130.8 13.6 49.9 23.6 107 106 A A - 0 0 43 -2,-0.5 -4,-0.1 140,-0.2 680,-0.1 -0.687 12.3-148.4 -85.3 133.3 17.1 48.4 23.6 108 107 A S - 0 0 17 -2,-0.4 5,-0.1 2,-0.2 137,-0.1 -0.738 15.8-135.5 -89.7 149.4 19.4 49.3 20.8 109 108 A P S S+ 0 0 25 0, 0.0 340,-3.3 0, 0.0 2,-0.2 0.582 83.4 94.9 -75.6 -11.4 22.0 46.7 19.7 110 109 A L B > S-J 448 0B 5 135,-0.3 3,-0.5 338,-0.3 338,-0.3 -0.507 90.8 -95.6 -75.7 151.6 24.5 49.6 19.8 111 110 A S T 3 S+ 0 0 69 336,-3.0 -1,-0.1 108,-0.2 338,-0.1 -0.381 93.4 4.8 -59.7 134.3 26.6 50.2 22.8 112 111 A G T 3 S- 0 0 39 1,-0.2 671,-0.3 672,-0.1 -1,-0.2 0.612 99.8 -84.6 74.5 29.7 25.4 52.7 25.4 113 112 A N < - 0 0 15 -3,-0.5 668,-1.3 -5,-0.1 -1,-0.2 0.775 53.6-169.4 46.9 51.6 21.9 54.2 24.7 114 113 A P - 0 0 21 0, 0.0 2,-0.4 0, 0.0 667,-0.2 -0.254 31.2-105.6 -66.4 152.5 22.6 57.0 22.2 115 114 A G - 0 0 13 877,-0.3 2,-0.4 665,-0.2 -12,-0.1 -0.668 45.5-179.2 -71.4 129.0 19.9 59.5 21.5 116 115 A I + 0 0 4 -2,-0.4 -14,-2.2 -14,-0.4 2,-0.3 -0.978 17.2 150.3-134.3 126.2 18.8 58.6 18.0 117 116 A D E +D 101 0A 51 108,-0.5 2,-0.3 -2,-0.4 -16,-0.3 -0.765 23.1 131.2-156.3 95.1 16.0 60.5 16.2 118 117 A F E -D 100 0A 1 -18,-2.9 -18,-3.8 -2,-0.3 2,-0.4 -0.925 39.6-140.8-138.4 170.7 16.2 60.7 12.5 119 118 A V E -Df 99 227A 10 107,-2.6 109,-2.9 -2,-0.3 2,-0.5 -1.000 9.8-147.4-134.2 138.6 14.1 60.1 9.5 120 119 A V E -Df 98 228A 0 -22,-2.5 -22,-2.6 -2,-0.4 2,-0.7 -0.887 4.6-162.4-104.6 129.5 15.0 58.5 6.2 121 120 A V E -Df 97 229A 0 107,-3.6 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153.2 20.7 62.9 -20.9 475 136 B R S > S- 0 0 163 -2,-0.3 3,-1.3 6,-0.2 5,-0.2 0.844 84.1-164.1 57.1 40.6 19.3 66.3 -20.5 476 137 B V T 3 + 0 0 78 1,-0.2 -1,-0.2 -3,-0.1 4,-0.1 -0.208 64.5 19.8 -56.0 138.0 21.6 67.0 -17.6 477 138 B G T 3 S+ 0 0 45 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.593 106.8 95.8 83.9 11.7 20.9 69.9 -15.4 478 139 B T S X S- 0 0 53 -3,-1.3 3,-2.0 1,-0.0 -1,-0.3 -0.827 90.9-105.4-123.6 170.0 17.3 70.1 -16.5 479 140 B P T 3 S+ 0 0 102 0, 0.0 -325,-0.4 0, 0.0 -322,-0.1 0.608 120.5 61.3 -69.6 -10.0 14.0 68.7 -15.0 480 141 B N T 3 S+ 0 0 100 -5,-0.2 -6,-0.1 -327,-0.1 -4,-0.1 0.261 74.5 136.2 -95.3 9.6 14.2 66.2 -17.8 481 142 B E < - 0 0 2 -3,-2.0 -328,-2.4 -6,-0.1 -327,-0.4 -0.306 31.1-173.5 -59.6 139.0 17.5 64.7 -16.7 482 143 B V E -LM 152 474C 39 -8,-2.1 -8,-2.3 -330,-0.2 2,-0.4 -0.994 0.8-173.0-131.9 128.0 17.6 61.0 -16.9 483 144 B A E -LM 151 473C 0 -332,-3.2 -332,-2.5 -2,-0.4 2,-0.4 -0.971 2.6-165.7-126.2 133.8 20.6 59.2 -15.5 484 145 B T E -LM 150 472C 41 -12,-3.1 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-42.6 32.8 36.7 -12.6 494 155 B V H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 5,-0.2 0.931 107.5 51.6 -68.2 -46.3 30.3 35.4 -10.2 495 156 B R H X S+ 0 0 133 -4,-2.7 4,-3.3 -5,-0.3 5,-0.2 0.898 106.9 54.7 -59.9 -37.7 31.4 31.8 -10.3 496 157 B R H X S+ 0 0 56 -4,-1.4 4,-1.9 -5,-0.3 -1,-0.2 0.935 113.1 41.8 -57.8 -46.4 35.0 32.8 -9.5 497 158 B V H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.919 116.1 48.9 -67.7 -42.1 34.0 34.7 -6.5 498 159 B V H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.942 109.1 52.2 -66.7 -47.0 31.5 32.1 -5.4 499 160 B A H X S+ 0 0 24 -4,-3.3 4,-2.0 1,-0.2 -1,-0.2 0.896 111.3 48.2 -52.1 -43.8 34.0 29.3 -5.8 500 161 B D H X S+ 0 0 22 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.870 109.1 53.0 -66.1 -40.1 36.5 31.2 -3.7 501 162 B A H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.922 108.8 49.0 -63.1 -42.0 33.9 31.8 -1.0 502 163 B F H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.898 109.3 52.7 -64.4 -38.8 33.0 28.1 -0.8 503 164 B E H X S+ 0 0 93 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.932 111.3 47.3 -62.5 -41.0 36.7 27.3 -0.5 504 165 B R H X S+ 0 0 32 -4,-2.2 4,-0.9 2,-0.2 6,-0.2 0.899 111.3 49.9 -66.4 -38.6 37.0 29.8 2.4 505 166 B A H ><>S+ 0 0 0 -4,-2.5 5,-2.7 1,-0.2 3,-0.6 0.915 108.9 53.0 -69.9 -39.6 33.9 28.5 4.1 506 167 B R H 3<5S+ 0 0 85 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.884 111.5 45.1 -57.9 -39.9 35.3 25.0 3.8 507 168 B R H 3<5S+ 0 0 154 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.599 123.9 37.7 -79.4 -13.9 38.6 26.1 5.5 508 169 B R T <<5S- 0 0 62 -4,-0.9 -3,-0.1 -3,-0.6 -2,-0.1 0.424 129.3 -39.7-107.1-120.1 36.6 28.0 8.1 509 170 B R T 5S- 0 0 118 2,-0.2 -3,-0.1 -5,-0.1 -4,-0.1 0.256 76.6-115.4-102.4 11.1 33.3 27.1 9.9 510 171 B K S > + 0 0 8 4,-0.2 4,-3.0 31,-0.2 3,-1.2 -0.423 43.9 162.7-152.8 62.4 18.7 41.3 -3.3 518 179 B T T 34 + 0 0 26 1,-0.3 8,-0.2 2,-0.2 7,-0.1 0.668 63.3 67.2 -68.0 -18.1 17.2 38.6 -5.5 519 180 B N T 34 S+ 0 0 30 1,-0.1 -1,-0.3 6,-0.1 3,-0.2 0.811 121.6 15.6 -73.6 -26.9 13.6 39.6 -5.2 520 181 B V T <4 S+ 0 0 6 -3,-1.2 2,-1.1 1,-0.2 -389,-0.3 0.595 121.3 58.7-121.5 -24.2 14.2 42.8 -7.1 521 182 B L S X S+ 0 0 13 -4,-3.0 4,-2.1 1,-0.2 -4,-0.2 -0.747 73.2 165.6 -94.7 78.0 17.5 42.5 -8.8 522 183 B T H > + 0 0 51 -2,-1.1 4,-1.8 3,-0.2 -1,-0.2 0.820 63.5 41.9 -69.7 -32.5 16.0 39.5 -10.5 523 184 B F H > S+ 0 0 60 -377,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.952 123.3 35.4 -83.5 -54.8 18.6 38.9 -13.2 524 185 B A H > S+ 0 0 1 -378,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.919 121.6 51.3 -62.5 -41.4 21.8 39.6 -11.3 525 186 B G H X S+ 0 0 0 -4,-2.1 4,-3.3 -8,-0.2 -2,-0.2 0.927 108.4 48.6 -59.1 -48.6 20.1 37.9 -8.2 526 187 B G H X S+ 0 0 18 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.861 112.0 51.8 -62.9 -37.0 19.0 34.8 -10.1 527 188 B L H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.952 112.6 43.6 -66.9 -44.9 22.6 34.5 -11.5 528 189 B W H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.3 0.944 115.6 49.0 -63.2 -45.9 24.1 34.8 -8.0 529 190 B L H X S+ 0 0 53 -4,-3.3 4,-2.4 1,-0.2 -2,-0.2 0.949 114.5 44.3 -57.9 -51.6 21.5 32.3 -6.5 530 191 B R H X S+ 0 0 70 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.895 113.2 51.3 -63.0 -40.2 22.0 29.8 -9.2 531 192 B T H X S+ 0 0 9 -4,-2.4 4,-2.9 -5,-0.3 5,-0.3 0.924 110.3 47.5 -63.4 -44.7 25.8 30.1 -9.1 532 193 B V H X S+ 0 0 2 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.920 114.5 48.6 -62.5 -38.9 25.9 29.6 -5.4 533 194 B D H X S+ 0 0 102 -4,-2.4 4,-0.6 -5,-0.3 -2,-0.2 0.940 114.4 44.9 -66.1 -43.0 23.6 26.6 -5.7 534 195 B E H >< S+ 0 0 98 -4,-2.8 3,-1.0 1,-0.2 4,-0.4 0.921 116.8 43.1 -70.0 -44.7 25.6 25.1 -8.6 535 196 B V H >< S+ 0 0 2 -4,-2.9 3,-1.9 1,-0.2 4,-0.3 0.903 105.8 66.0 -67.8 -34.0 29.0 25.6 -6.9 536 197 B G H >< S+ 0 0 15 -4,-2.3 3,-1.6 -5,-0.3 -1,-0.2 0.704 82.2 76.7 -58.9 -20.2 27.6 24.4 -3.6 537 198 B E T << S+ 0 0 150 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.816 95.0 49.1 -63.8 -29.8 27.1 21.0 -5.2 538 199 B C T < S+ 0 0 87 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.508 109.8 55.9 -85.1 -2.3 30.9 20.5 -4.7 539 200 B Y X + 0 0 25 -3,-1.6 3,-1.9 -4,-0.3 -1,-0.2 -0.508 51.6 151.0-128.6 63.3 30.6 21.6 -1.1 540 201 B P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.824 76.6 65.1 -64.4 -23.5 28.0 19.5 0.7 541 202 B D T 3 S+ 0 0 57 -3,-0.2 2,-0.6 2,-0.0 -2,-0.1 0.693 89.9 82.6 -66.7 -18.3 30.1 20.2 3.9 542 203 B V S < S- 0 0 10 -3,-1.9 2,-0.4 -6,-0.2 -31,-0.2 -0.811 73.2-145.3 -97.2 123.1 29.1 23.9 3.5 543 204 B E E -t 511 0D 131 -33,-2.7 -31,-3.2 -2,-0.6 2,-0.4 -0.729 20.7-152.1 -80.4 131.9 25.8 25.1 4.9 544 205 B V E +t 512 0D 57 -2,-0.4 2,-0.3 -33,-0.2 -31,-0.2 -0.910 16.7 178.5-112.6 131.2 24.4 27.8 2.6 545 206 B A E -t 513 0D 28 -33,-3.0 -31,-2.8 -2,-0.4 2,-0.4 -0.922 15.1-146.9-125.9 152.8 22.2 30.6 3.7 546 207 B Y E +t 514 0D 69 -2,-0.3 2,-0.3 -33,-0.2 -31,-0.2 -0.980 17.9 175.1-117.5 140.1 20.7 33.4 1.7 547 208 B Q E -t 515 0D 16 -33,-2.4 -31,-1.4 -2,-0.4 2,-0.0 -0.981 32.1-121.2-138.9 136.4 20.0 36.9 3.0 548 209 B H E > -t 516 0D 50 -2,-0.3 4,-2.9 -33,-0.2 -31,-0.2 -0.372 37.3-113.5 -60.7 146.4 18.8 40.0 1.3 549 210 B V H > S+ 0 0 0 -33,-2.7 4,-2.4 1,-0.2 5,-0.2 0.839 116.0 54.4 -56.9 -37.5 21.4 42.7 1.9 550 211 B D H > S+ 0 0 18 -34,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.954 112.2 43.6 -64.5 -43.7 18.9 44.7 4.1 551 212 B A H > S+ 0 0 34 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.887 111.8 54.2 -68.0 -36.0 18.4 41.8 6.3 552 213 B A H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.893 106.3 51.4 -65.9 -37.1 22.1 41.0 6.4 553 214 B T H X S+ 0 0 0 -4,-2.4 4,-0.8 2,-0.2 -1,-0.2 0.890 108.4 51.9 -69.7 -36.6 22.9 44.5 7.5 554 215 B I H >X S+ 0 0 27 -4,-1.9 4,-2.3 1,-0.2 3,-1.2 0.962 112.0 47.4 -57.9 -48.7 20.4 44.1 10.4 555 216 B H H 3X S+ 0 0 45 -4,-2.5 4,-2.4 1,-0.3 7,-0.2 0.835 100.7 64.8 -64.8 -30.5 22.1 40.9 11.3 556 217 B M H 3< S+ 0 0 0 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.803 115.3 31.9 -60.6 -24.8 25.5 42.4 11.2 557 218 B I H << S+ 0 0 4 -3,-1.2 -2,-0.2 -4,-0.8 -1,-0.2 0.745 130.4 32.2-104.5 -26.5 24.5 44.6 14.1 558 219 B T H < S+ 0 0 68 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.760 138.1 11.7-100.2 -29.2 22.1 42.4 16.0 559 220 B D >< + 0 0 66 -4,-2.4 3,-2.3 -5,-0.3 4,-0.1 -0.272 66.8 152.7-143.9 53.2 23.5 38.9 15.3 560 221 B P G > + 0 0 4 0, 0.0 3,-1.7 0, 0.0 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