==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 19-APR-05 1ZEL . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN RV2827C; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR R.JANOWSKI,S.PANJIKAR,J.MUELLER-DIECKMANN,M.S.WEISS,TB STRUC . 588 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28715.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 60.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 27 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 179 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 3 0 4 0 6 3 7 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 A 0 0 94 0, 0.0 83,-1.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -50.0 16.8 -17.0 27.2 2 0 A M E -A 83 0A 112 81,-0.2 2,-0.5 83,-0.1 81,-0.2 -0.849 360.0-147.3-125.3 151.2 15.7 -20.0 29.2 3 1 A V E -A 82 0A 22 79,-2.0 79,-3.0 -2,-0.3 2,-0.4 -0.988 32.4-158.8-110.1 124.0 12.6 -21.7 30.5 4 2 A V E -A 81 0A 81 -2,-0.5 77,-0.3 77,-0.2 76,-0.1 -0.852 18.1-123.9-113.6 133.5 13.4 -23.3 33.9 5 3 A S > - 0 0 3 75,-2.9 3,-1.5 -2,-0.4 57,-0.1 -0.637 15.5-145.3 -69.4 127.5 11.8 -26.1 35.7 6 4 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 55,-0.1 0.655 98.6 58.9 -67.7 -11.5 10.7 -24.9 39.2 7 5 A A T 3 S- 0 0 44 1,-0.3 3,-0.2 54,-0.2 5,-0.1 0.438 106.4-126.8 -93.9 -2.0 11.6 -28.4 40.5 8 6 A G < - 0 0 33 -3,-1.5 -1,-0.3 72,-0.2 71,-0.1 -0.270 45.9 -56.3 77.7-173.6 15.2 -28.4 39.4 9 7 A A S S+ 0 0 49 1,-0.2 2,-1.2 69,-0.1 69,-0.6 0.823 121.7 71.7 -74.6 -32.7 16.7 -31.2 37.2 10 8 A D + 0 0 158 -3,-0.2 2,-0.4 68,-0.1 -1,-0.2 -0.719 69.3 172.8 -93.1 95.5 15.7 -34.1 39.5 11 9 A R - 0 0 18 -2,-1.2 2,-0.1 50,-0.0 50,-0.1 -0.856 29.3-126.7-109.4 138.6 11.9 -34.4 39.2 12 10 A R - 0 0 219 -2,-0.4 -5,-0.0 48,-0.2 48,-0.0 -0.456 16.0-149.7 -73.7 152.4 9.6 -37.1 40.5 13 11 A I - 0 0 75 -2,-0.1 5,-0.1 49,-0.0 44,-0.0 -0.925 11.8-141.9-124.8 103.4 7.3 -38.9 38.1 14 12 A P > - 0 0 30 0, 0.0 3,-1.4 0, 0.0 4,-0.4 -0.396 24.1-116.8 -62.1 147.8 4.1 -40.0 39.7 15 13 A T G > S+ 0 0 130 1,-0.3 3,-1.6 2,-0.2 4,-0.4 0.841 113.2 60.8 -56.3 -38.8 3.0 -43.4 38.4 16 14 A W G 3 S+ 0 0 64 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.835 111.3 41.7 -55.2 -33.5 -0.2 -42.0 36.9 17 15 A A G <> S+ 0 0 0 -3,-1.4 4,-3.0 1,-0.2 5,-0.3 0.348 84.5 103.2 -95.7 1.2 2.0 -39.7 34.7 18 16 A S H <> S+ 0 0 52 -3,-1.6 4,-2.8 -4,-0.4 5,-0.2 0.937 86.7 38.8 -56.7 -51.8 4.7 -42.3 33.8 19 17 A R H > S+ 0 0 179 -4,-0.4 4,-2.3 -3,-0.2 -1,-0.2 0.858 115.6 54.1 -67.9 -32.9 3.5 -43.0 30.2 20 18 A V H > S+ 0 0 2 -4,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.956 114.1 40.2 -65.7 -48.4 2.6 -39.3 29.6 21 19 A V H X S+ 0 0 2 -4,-3.0 4,-2.9 1,-0.2 -2,-0.2 0.919 115.5 51.8 -66.1 -42.9 6.1 -38.2 30.6 22 20 A S H X S+ 0 0 51 -4,-2.8 4,-2.0 -5,-0.3 -1,-0.2 0.877 109.9 50.1 -62.6 -36.9 7.8 -41.1 28.8 23 21 A G H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.882 112.7 45.0 -67.8 -43.3 5.9 -40.3 25.6 24 22 A L H X S+ 0 0 1 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.873 111.9 54.1 -64.7 -39.7 6.9 -36.6 25.8 25 23 A A H < S+ 0 0 25 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.875 113.6 42.3 -62.5 -37.4 10.4 -37.7 26.6 26 24 A R H < S+ 0 0 184 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.902 123.7 35.8 -71.5 -43.4 10.4 -39.9 23.4 27 25 A D H < S- 0 0 95 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.768 81.4-162.4 -89.0 -29.9 8.7 -37.4 21.1 28 26 A R < - 0 0 136 -4,-2.9 -3,-0.1 -5,-0.2 2,-0.1 0.908 11.6-161.1 46.1 60.8 10.2 -34.1 22.4 29 27 A P - 0 0 34 0, 0.0 45,-0.4 0, 0.0 -1,-0.1 -0.458 21.4-128.8 -66.2 148.0 7.6 -31.8 20.9 30 28 A V S S+ 0 0 97 1,-0.2 2,-0.3 -2,-0.1 44,-0.2 0.936 94.4 10.7 -60.8 -45.4 8.8 -28.1 20.6 31 29 A V S S- 0 0 16 42,-0.1 2,-0.6 59,-0.1 -1,-0.2 -0.977 74.6-138.0-133.8 142.0 5.6 -26.9 22.3 32 30 A V E -B 72 0B 0 40,-3.3 40,-2.0 -2,-0.3 2,-0.2 -0.922 19.4-156.6-101.6 118.2 3.0 -29.0 24.1 33 31 A T E > -B 71 0B 27 -2,-0.6 4,-2.4 38,-0.2 38,-0.2 -0.519 29.2-113.9 -85.5 160.7 -0.6 -27.9 23.4 34 32 A K H > S+ 0 0 66 36,-2.0 4,-2.6 1,-0.2 5,-0.1 0.875 119.8 52.9 -58.0 -35.5 -3.5 -28.6 25.8 35 33 A E H > S+ 0 0 103 35,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.848 107.1 51.0 -69.0 -38.5 -4.9 -30.9 23.1 36 34 A D H > S+ 0 0 42 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.916 112.9 45.5 -65.0 -46.6 -1.7 -32.8 22.7 37 35 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.926 110.6 54.0 -63.5 -42.7 -1.5 -33.4 26.5 38 36 A T H X S+ 0 0 46 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.910 110.8 46.1 -55.7 -47.2 -5.2 -34.4 26.6 39 37 A Q H X S+ 0 0 96 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.893 111.3 52.1 -63.0 -42.4 -4.7 -37.0 23.9 40 38 A R H X S+ 0 0 27 -4,-2.1 4,-1.5 2,-0.2 6,-0.2 0.864 107.3 52.8 -66.4 -35.8 -1.5 -38.3 25.6 41 39 A L H <>S+ 0 0 2 -4,-2.4 5,-2.4 2,-0.2 3,-0.4 0.964 111.1 46.4 -60.1 -49.8 -3.4 -38.7 28.9 42 40 A T H ><5S+ 0 0 93 -4,-1.9 3,-1.8 1,-0.2 -2,-0.2 0.916 110.7 52.7 -57.4 -49.6 -6.2 -40.8 27.2 43 41 A E H 3<5S+ 0 0 135 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.792 105.1 55.7 -54.7 -34.0 -3.5 -42.9 25.4 44 42 A A T 3<5S- 0 0 25 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.468 117.6-112.6 -79.7 -5.4 -1.9 -43.6 28.8 45 43 A G T < 5S+ 0 0 73 -3,-1.8 2,-0.6 1,-0.3 -3,-0.2 0.666 70.7 147.6 77.0 18.7 -5.2 -45.0 30.2 46 44 A C < - 0 0 18 -5,-2.4 -1,-0.3 -6,-0.2 -2,-0.1 -0.784 34.0-170.7 -90.0 120.1 -5.2 -41.9 32.5 47 45 A G + 0 0 83 -2,-0.6 -1,-0.1 -3,-0.1 -5,-0.1 0.195 39.5 133.5 -97.3 15.0 -8.7 -40.7 33.2 48 46 A R - 0 0 80 1,-0.1 -2,-0.1 -7,-0.1 -7,-0.0 -0.364 69.8 -99.6 -61.1 141.3 -7.5 -37.5 34.9 49 47 A D > - 0 0 90 1,-0.1 4,-2.8 -2,-0.1 5,-0.2 -0.454 33.8-129.8 -53.8 128.9 -9.1 -34.2 34.1 50 48 A P H > S+ 0 0 32 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.915 107.0 50.3 -53.7 -47.1 -6.6 -32.6 31.6 51 49 A D H > S+ 0 0 64 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.920 112.9 46.8 -57.4 -48.0 -6.6 -29.3 33.5 52 50 A S H > S+ 0 0 31 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.894 111.7 50.7 -56.3 -48.3 -5.9 -31.1 36.8 53 51 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.933 112.2 47.3 -55.5 -47.7 -3.2 -33.2 35.1 54 52 A I H X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.889 108.5 54.4 -63.7 -42.2 -1.5 -30.1 33.7 55 53 A R H X S+ 0 0 139 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.915 113.2 42.7 -58.6 -48.0 -1.7 -28.3 37.1 56 54 A E H X S+ 0 0 34 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.907 113.2 50.8 -65.9 -43.0 0.1 -31.2 38.8 57 55 A L H X>S+ 0 0 2 -4,-2.7 5,-2.3 1,-0.2 6,-1.2 0.850 113.1 48.1 -63.5 -32.7 2.6 -31.6 36.0 58 56 A R H <5S+ 0 0 75 -4,-2.5 3,-0.3 4,-0.2 -2,-0.2 0.916 110.9 50.6 -66.4 -49.4 3.3 -27.8 36.3 59 57 A R H <5S+ 0 0 178 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.919 113.1 44.5 -59.9 -43.5 3.6 -28.1 40.1 60 58 A I H <5S- 0 0 20 -4,-2.8 -1,-0.2 -5,-0.1 -48,-0.2 0.619 119.3-110.2 -85.9 -10.7 6.1 -30.9 39.9 61 59 A G T <5S+ 0 0 0 -4,-0.9 -3,-0.2 -3,-0.3 -54,-0.2 0.518 85.5 110.1 110.7 8.4 8.1 -29.2 37.1 62 60 A W S S- 0 0 12 20,-0.1 3,-1.2 68,-0.1 -2,-0.3 -0.682 96.2-102.9 -88.6 135.5 0.1 -18.2 24.6 69 67 A K T 3 S+ 0 0 191 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 -0.291 103.5 20.2 -57.4 131.7 -3.1 -19.7 26.1 70 68 A G T 3 S+ 0 0 15 1,-0.3 -36,-2.0 -4,-0.1 2,-0.3 0.705 101.3 107.6 87.1 20.2 -3.1 -23.5 25.9 71 69 A T E < +B 33 0B 0 -3,-1.2 -5,-2.2 -5,-0.3 2,-0.3 -0.974 37.7 173.3-132.6 147.7 0.6 -24.1 25.4 72 70 A W E -BC 32 65B 17 -40,-2.0 -40,-3.3 -2,-0.3 2,-0.5 -0.956 28.3-123.5-143.7 156.3 3.4 -25.4 27.7 73 71 A A E - C 0 64B 0 -9,-2.9 -9,-2.3 -2,-0.3 2,-0.5 -0.909 21.9-139.4-100.3 133.9 7.0 -26.3 27.4 74 72 A F E - C 0 63B 12 -2,-0.5 -11,-0.2 -45,-0.4 -12,-0.1 -0.818 9.6-148.1 -87.6 126.9 8.1 -29.8 28.3 75 73 A I - 0 0 0 -13,-2.3 3,-0.1 -2,-0.5 7,-0.1 -0.893 26.5-129.5 -96.8 116.0 11.3 -29.9 30.3 76 74 A P > - 0 0 18 0, 0.0 3,-1.8 0, 0.0 5,-0.1 -0.252 29.2 -82.7 -71.2 154.4 13.0 -33.2 29.3 77 75 A P T 3 S+ 0 0 51 0, 0.0 3,-0.1 0, 0.0 -67,-0.1 -0.201 115.8 23.4 -52.6 140.0 14.3 -35.7 31.7 78 76 A G T 3 S+ 0 0 62 -69,-0.6 2,-0.4 1,-0.2 -69,-0.1 0.426 103.8 100.4 83.8 -0.3 17.8 -34.9 32.9 79 77 A E < - 0 0 108 -3,-1.8 -1,-0.2 -70,-0.2 3,-0.1 -0.943 53.3-162.9-120.5 143.3 17.5 -31.2 32.1 80 78 A A S S- 0 0 44 -2,-0.4 -75,-2.9 1,-0.2 2,-0.3 0.658 77.2 -0.8 -89.2 -20.6 16.9 -28.3 34.5 81 79 A A E -A 4 0A 23 -77,-0.3 2,-0.4 -5,-0.1 -77,-0.2 -0.973 64.3-112.7-160.3 168.9 15.9 -25.9 31.7 82 80 A I E -A 3 0A 37 -79,-3.0 -79,-2.0 -2,-0.3 2,-0.9 -0.952 20.0-149.7-112.2 133.1 15.4 -25.2 28.0 83 81 A S E +A 2 0A 104 -2,-0.4 -81,-0.2 -81,-0.2 -2,-0.0 -0.851 53.1 117.3-102.2 96.7 17.7 -22.8 26.2 84 82 A D > - 0 0 25 -83,-1.6 3,-0.7 -2,-0.9 -2,-0.1 -0.819 43.4-164.8-159.8 113.6 15.6 -21.4 23.4 85 83 A P T 3 S+ 0 0 44 0, 0.0 4,-0.1 0, 0.0 -83,-0.1 0.548 85.1 59.8 -81.5 -6.8 14.8 -17.6 23.4 86 84 A Y T >> + 0 0 9 1,-0.2 4,-2.4 -85,-0.1 3,-0.9 0.243 63.5 112.9-106.8 13.5 12.0 -17.9 20.9 87 85 A L H <> S+ 0 0 2 -3,-0.7 4,-2.6 1,-0.3 5,-0.2 0.857 73.9 59.5 -58.3 -37.3 9.7 -20.2 22.8 88 86 A P H 3> S+ 0 0 16 0, 0.0 4,-1.1 0, 0.0 -1,-0.3 0.905 110.8 42.3 -52.9 -41.1 7.1 -17.5 23.2 89 87 A L H <> S+ 0 0 0 -3,-0.9 4,-2.2 2,-0.2 -2,-0.2 0.881 112.3 52.1 -74.6 -41.1 6.9 -17.2 19.4 90 88 A R H X S+ 0 0 41 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.859 106.0 56.6 -60.7 -35.5 6.9 -20.9 18.8 91 89 A S H X S+ 0 0 0 -4,-2.6 4,-1.0 -5,-0.3 -1,-0.2 0.866 105.9 51.0 -65.1 -33.1 4.0 -21.1 21.3 92 90 A W H >X S+ 0 0 8 -4,-1.1 4,-2.9 -5,-0.2 3,-0.9 0.950 109.2 48.8 -63.2 -49.8 2.1 -18.7 19.1 93 91 A L H 3< S+ 0 0 58 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.807 103.6 63.3 -59.6 -29.6 2.8 -20.8 16.0 94 92 A A H 3< S+ 0 0 42 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.840 115.1 30.5 -63.4 -36.1 1.6 -23.9 18.0 95 93 A R H << S+ 0 0 101 -4,-1.0 2,-0.4 -3,-0.9 -2,-0.2 0.780 135.5 25.8 -87.8 -35.4 -1.8 -22.3 18.3 96 94 A D >< - 0 0 49 -4,-2.9 3,-1.5 -5,-0.1 -1,-0.3 -0.869 55.7-171.7-138.3 99.8 -1.8 -20.3 14.9 97 95 A Q T 3 S+ 0 0 173 -2,-0.4 3,-0.3 1,-0.3 -4,-0.1 0.705 92.7 56.1 -62.1 -18.3 0.3 -21.6 12.1 98 96 A N T 3 + 0 0 129 1,-0.2 -1,-0.3 -3,-0.1 -5,-0.1 -0.059 63.2 132.2-104.0 28.5 -0.6 -18.3 10.3 99 97 A A < - 0 0 0 -3,-1.5 -1,-0.2 1,-0.1 -2,-0.1 0.870 52.4-154.3 -47.3 -41.8 0.7 -16.0 13.1 100 98 A G + 0 0 38 -3,-0.3 2,-0.1 1,-0.2 -1,-0.1 0.575 39.1 137.6 81.7 12.9 2.4 -14.1 10.3 101 99 A F - 0 0 4 26,-0.1 2,-0.4 -12,-0.1 -1,-0.2 -0.470 35.5-158.5 -87.7 161.2 5.3 -12.6 12.3 102 100 A M E -D 126 0C 10 24,-2.0 24,-2.9 -2,-0.1 77,-0.3 -0.995 29.7-106.7-132.5 139.9 8.9 -12.2 11.3 103 101 A L E +De 125 179C 0 75,-2.8 77,-2.6 -2,-0.4 22,-0.3 -0.395 53.9 174.8 -54.8 135.7 11.9 -11.8 13.6 104 102 A A >> + 0 0 0 20,-3.0 4,-1.7 75,-0.2 3,-1.4 -0.629 32.1 10.6-131.9-171.5 13.0 -8.2 13.2 105 103 A G H 3> S+ 0 0 0 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.054 126.4 4.8 42.9-128.5 15.4 -5.5 14.4 106 104 A A H 3> S+ 0 0 11 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.769 132.4 53.4 -60.5 -32.9 18.1 -6.9 16.7 107 105 A S H <> S+ 0 0 7 -3,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.934 111.9 44.0 -70.0 -45.1 17.1 -10.5 16.3 108 106 A A H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.920 115.2 49.7 -60.2 -46.7 17.3 -10.4 12.6 109 107 A A H X>S+ 0 0 0 -4,-2.5 5,-2.8 -5,-0.2 4,-0.9 0.858 108.9 54.0 -60.8 -37.7 20.6 -8.5 12.8 110 108 A W H ><5S+ 0 0 75 -4,-2.0 3,-0.6 -5,-0.2 5,-0.3 0.962 112.7 40.1 -64.6 -50.3 22.0 -11.0 15.2 111 109 A H H 3<5S+ 0 0 33 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.786 112.1 56.2 -73.2 -26.1 21.3 -14.1 13.0 112 110 A L H 3<5S- 0 0 5 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.641 119.7-113.9 -77.4 -16.8 22.4 -12.2 9.8 113 111 A G T <<5S+ 0 0 42 -4,-0.9 -3,-0.2 -3,-0.6 -2,-0.1 0.599 80.5 121.3 100.4 17.9 25.7 -11.6 11.6 114 112 A Y < + 0 0 0 -5,-2.8 2,-0.4 -6,-0.2 91,-0.3 0.340 56.7 78.9 -96.5 8.1 25.7 -7.8 12.1 115 113 A L - 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0 0 5 -3,-1.3 3,-0.3 -4,-0.4 -91,-0.0 -0.876 61.6-170.0-112.1 130.6 60.4 49.2 -1.2 493 195 B G + 0 0 64 -2,-0.5 2,-2.2 1,-0.2 3,-0.3 0.989 69.3 51.9 -83.8 -66.3 62.2 48.9 2.1 494 196 B P >> + 0 0 31 0, 0.0 4,-1.7 0, 0.0 3,-0.6 -0.265 55.1 147.0 -82.1 59.0 65.9 48.1 1.9 495 197 B W H 3> S+ 0 0 7 -2,-2.2 4,-2.9 -3,-0.3 -2,-0.1 0.876 72.1 58.1 -54.8 -41.2 67.1 50.8 -0.6 496 198 B A H 34 S+ 0 0 43 -3,-0.3 -1,-0.2 1,-0.2 92,-0.0 0.866 109.5 45.3 -59.5 -34.6 70.5 51.0 1.1 497 199 B D H <4 S+ 0 0 64 -3,-0.6 -85,-0.4 1,-0.1 -1,-0.2 0.769 117.5 44.1 -77.9 -29.9 71.0 47.3 0.5 498 200 B L H >< S+ 0 0 0 -4,-1.7 3,-2.6 1,-0.1 -2,-0.2 0.890 96.6 71.3 -81.2 -43.6 69.8 47.5 -3.1 499 201 B V G >< S+ 0 0 4 -4,-2.9 3,-1.4 1,-0.3 4,-0.2 0.774 90.6 58.7 -52.6 -37.2 71.6 50.6 -4.4 500 202 B P G 3 S+ 0 0 55 0, 0.0 -1,-0.3 0, 0.0 3,-0.3 0.705 109.1 48.2 -62.8 -15.0 75.1 49.1 -4.5 501 203 B H G <> + 0 0 40 -3,-2.6 4,-2.3 -91,-0.3 3,-0.4 0.105 69.6 113.0-116.2 19.9 73.8 46.4 -6.9 502 204 B L H <> S+ 0 0 2 -3,-1.4 4,-2.8 1,-0.2 5,-0.2 0.836 77.2 59.9 -62.0 -34.0 72.0 48.6 -9.5 503 205 B D H > S+ 0 0 103 -3,-0.3 4,-1.7 -4,-0.2 -1,-0.2 0.899 106.9 45.5 -55.3 -42.0 74.6 47.5 -12.0 504 206 B D H > S+ 0 0 48 -3,-0.4 4,-0.6 2,-0.2 -2,-0.2 0.933 115.3 46.9 -69.3 -47.3 73.6 43.9 -11.5 505 207 B L H >< S+ 0 0 0 -4,-2.3 3,-1.3 1,-0.2 4,-0.2 0.931 111.1 50.9 -58.3 -45.4 69.9 44.7 -11.7 506 208 B V H >< S+ 0 0 1 -4,-2.8 3,-1.4 1,-0.3 -1,-0.2 0.857 103.9 57.6 -71.3 -33.3 70.2 46.8 -14.8 507 209 B A H 3< S+ 0 0 72 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.691 105.4 53.1 -65.5 -20.4 72.2 44.3 -16.7 508 210 B D T << S+ 0 0 12 -3,-1.3 2,-0.5 -4,-0.6 -1,-0.3 0.410 90.8 95.6 -95.1 2.7 69.3 41.8 -16.2 509 211 B C < - 0 0 9 -3,-1.4 2,-0.5 -4,-0.2 3,-0.0 -0.821 64.9-143.9-104.4 131.6 66.6 44.0 -17.5 510 212 B S > - 0 0 28 -2,-0.5 4,-2.7 1,-0.1 3,-0.2 -0.778 12.0-145.2 -83.2 125.4 65.3 43.9 -21.1 511 213 B D H > S+ 0 0 33 -2,-0.5 4,-2.4 1,-0.2 5,-0.1 0.822 100.4 55.7 -64.6 -28.1 64.5 47.5 -22.1 512 214 B E H > S+ 0 0 133 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.903 109.2 46.8 -69.6 -40.7 61.5 46.3 -24.2 513 215 B R H > S+ 0 0 47 -3,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.905 111.0 52.4 -64.5 -44.2 60.1 44.6 -21.1 514 216 B L H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 5,-0.2 0.945 110.0 48.6 -56.7 -44.6 60.7 47.8 -19.0 515 217 B E H X S+ 0 0 68 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.901 111.0 50.0 -66.0 -38.2 58.9 49.8 -21.6 516 218 B R H < S+ 0 0 143 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.933 114.1 44.4 -62.9 -45.3 56.0 47.3 -21.6 517 219 B L H < S+ 0 0 7 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.718 113.8 50.4 -74.4 -22.5 55.7 47.4 -17.8 518 220 B L H >< S+ 0 0 0 -4,-1.9 3,-2.7 -5,-0.2 2,-0.5 0.630 81.6 114.7 -82.0 -18.2 56.0 51.2 -17.6 519 221 B S T 3< S+ 0 0 57 -4,-1.0 30,-0.1 -3,-0.5 -3,-0.0 -0.419 86.4 14.0 -66.6 111.0 53.3 51.6 -20.2 520 222 B G T 3 S+ 0 0 51 -2,-0.5 -1,-0.3 1,-0.5 -2,-0.1 0.204 98.2 120.3 108.4 -12.3 50.5 53.4 -18.4 521 223 B R S < S- 0 0 33 -3,-2.7 -1,-0.5 1,-0.1 5,-0.1 -0.432 75.6 -87.9 -75.3 158.2 52.5 54.4 -15.3 522 224 B P >> - 0 0 78 0, 0.0 3,-1.2 0, 0.0 4,-1.0 -0.245 39.4-106.7 -58.3 157.3 52.8 58.1 -14.5 523 225 B T H 3> S+ 0 0 21 1,-0.2 4,-2.2 2,-0.2 3,-0.3 0.845 118.8 67.3 -51.3 -39.4 55.6 60.0 -16.1 524 226 B S H 3> S+ 0 0 32 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.833 96.4 54.9 -51.0 -38.6 57.4 60.0 -12.7 525 227 B A H <> S+ 0 0 0 -3,-1.2 4,-2.7 2,-0.2 -1,-0.2 0.899 108.3 47.8 -62.9 -43.2 57.8 56.3 -13.0 526 228 B W H X S+ 0 0 3 -4,-1.0 4,-2.6 -3,-0.3 5,-0.2 0.913 111.7 49.6 -64.0 -42.1 59.6 56.7 -16.3 527 229 B Q H X S+ 0 0 3 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.947 116.0 42.5 -62.8 -49.5 61.9 59.4 -15.0 528 230 B R H X S+ 0 0 28 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.893 115.3 48.5 -65.4 -39.7 62.8 57.3 -12.0 529 231 B A H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.922 113.1 47.9 -67.7 -41.2 63.2 54.0 -13.9 530 232 B S H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.870 110.0 53.0 -63.4 -39.9 65.3 55.7 -16.6 531 233 B Y H X S+ 0 0 12 -4,-2.0 4,-3.3 -5,-0.2 -1,-0.2 0.819 104.8 55.4 -66.1 -34.4 67.4 57.3 -13.8 532 234 B L H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.924 106.7 50.1 -62.8 -42.5 67.9 53.8 -12.3 533 235 B L H <>S+ 0 0 0 -4,-2.0 5,-2.5 2,-0.2 3,-0.3 0.959 112.3 47.9 -56.9 -50.0 69.3 52.6 -15.7 534 236 B D H ><5S+ 0 0 46 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.948 112.5 48.9 -53.0 -50.8 71.6 55.7 -15.6 535 237 B S H 3<5S+ 0 0 35 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.764 103.7 60.3 -61.2 -29.1 72.6 54.9 -12.0 536 238 B G T 3<5S- 0 0 8 -4,-2.1 -1,-0.3 -3,-0.3 -2,-0.2 0.234 131.5 -91.8 -85.2 13.9 73.3 51.2 -12.9 537 239 B G T < 5S+ 0 0 53 -3,-1.7 -3,-0.2 -5,-0.1 -2,-0.2 0.610 100.7 106.2 91.5 15.6 75.9 52.4 -15.3 538 240 B E >< + 0 0 79 -5,-2.5 4,-2.4 -6,-0.2 5,-0.2 -0.521 27.1 156.1-127.5 65.6 73.7 52.7 -18.5 539 241 B P H > S+ 0 0 59 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.860 76.5 52.9 -62.0 -37.2 73.0 56.4 -19.2 540 242 B A H > S+ 0 0 76 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.938 111.6 46.1 -64.5 -43.9 72.4 55.8 -23.0 541 243 B R H > S+ 0 0 53 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.896 112.2 52.2 -61.2 -42.9 69.8 53.1 -22.2 542 244 B G H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.925 111.5 45.3 -59.0 -45.7 68.2 55.3 -19.5 543 245 B Q H X S+ 0 0 97 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.893 113.2 50.3 -71.1 -36.2 67.9 58.3 -22.0 544 246 B A H < S+ 0 0 48 -4,-2.3 4,-0.3 -5,-0.2 -1,-0.2 0.879 111.4 48.4 -67.7 -39.1 66.5 56.0 -24.7 545 247 B L H >< S+ 0 0 4 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.933 110.0 52.5 -62.0 -45.9 63.9 54.5 -22.3 546 248 B L H >< S+ 0 0 7 -4,-2.3 3,-1.9 1,-0.3 -2,-0.2 0.882 100.4 61.0 -61.9 -40.0 62.8 58.0 -21.1 547 249 B A T 3< S+ 0 0 73 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.593 96.8 63.2 -61.9 -11.1 62.3 59.2 -24.7 548 250 B K T < S+ 0 0 101 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.371 76.8 120.8 -95.2 4.3 59.6 56.5 -25.0 549 251 B R < - 0 0 42 -3,-1.9 -30,-0.1 -4,-0.1 -26,-0.0 -0.141 68.0-126.4 -63.1 163.5 57.3 57.9 -22.3 550 252 B H S S+ 0 0 125 1,-0.1 2,-0.6 2,-0.0 -1,-0.1 0.814 90.8 65.1 -84.6 -32.3 53.8 58.9 -23.2 551 253 B T - 0 0 72 1,-0.2 -2,-0.1 2,-0.0 -1,-0.1 -0.835 65.3-158.5 -96.6 122.0 53.9 62.5 -21.9 552 254 B E S S+ 0 0 152 -2,-0.6 2,-0.7 1,-0.1 -1,-0.2 0.926 77.7 60.6 -63.2 -49.3 56.3 65.0 -23.7 553 255 B V S S- 0 0 113 1,-0.0 -1,-0.1 0, 0.0 -30,-0.1 -0.727 74.6-155.5 -91.7 118.3 56.6 67.5 -21.0 554 256 B M - 0 0 32 -2,-0.7 2,-0.1 -31,-0.0 3,-0.1 -0.791 4.5-146.3 -95.3 123.0 58.1 66.2 -17.8 555 257 B P - 0 0 87 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.416 42.2 -86.5 -69.5 161.2 57.4 67.9 -14.5 556 258 B V - 0 0 86 -2,-0.1 2,-0.3 20,-0.1 20,-0.2 -0.611 51.7-165.1 -68.8 129.4 60.2 67.8 -11.9 557 259 B T E -o 576 0H 14 18,-2.3 20,-2.7 -2,-0.3 2,-0.3 -0.899 11.7-136.0-113.4 150.8 59.9 64.5 -9.9 558 260 B R E -o 577 0H 127 -2,-0.3 2,-0.7 18,-0.2 20,-0.2 -0.806 5.1-145.2 -98.1 144.2 61.6 63.7 -6.7 559 261 B F E +o 578 0H 0 18,-2.9 20,-2.2 -2,-0.3 2,-0.3 -0.928 54.1 124.3-105.1 102.3 63.3 60.3 -6.1 560 262 B T - 0 0 30 -2,-0.7 -70,-0.2 18,-0.1 3,-0.2 -0.985 61.5-143.7-156.5 154.6 62.6 59.8 -2.4 561 263 B T S S- 0 0 64 1,-0.3 2,-0.1 -2,-0.3 -1,-0.1 0.528 102.8 -2.5 -99.6 -9.2 60.9 57.4 0.1 562 264 B A S S- 0 0 64 -3,-0.0 2,-0.5 2,-0.0 -1,-0.3 -0.518 79.7-126.3 179.2 103.3 59.7 60.3 2.1 563 265 B H 0 0 101 -3,-0.2 -3,-0.1 -2,-0.1 -5,-0.0 -0.479 360.0 360.0 -64.6 112.9 60.5 63.9 1.2 564 266 B S 0 0 133 -2,-0.5 -2,-0.0 0, 0.0 0, 0.0 -0.482 360.0 360.0 166.3 360.0 62.1 65.5 4.4 565 ! 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 0.0 566 270 B G 0 0 124 0, 0.0 2,-0.2 0, 0.0 14,-0.1 0.000 360.0 360.0 360.0 128.2 68.6 65.1 3.6 567 271 B E - 0 0 75 12,-0.2 2,-0.3 13,-0.1 15,-0.0 -0.593 360.0-165.9 -93.2 151.7 71.1 65.5 0.7 568 272 B S - 0 0 70 -2,-0.2 2,-0.4 14,-0.1 11,-0.2 -0.998 15.5-154.7-147.4 150.6 70.0 65.8 -3.1 569 273 B V E -P 578 0H 31 9,-2.2 9,-3.3 -2,-0.3 2,-0.5 -0.951 18.1-136.5-124.2 137.6 71.3 65.6 -6.7 570 274 B W E -P 577 0H 128 -2,-0.4 7,-0.2 7,-0.2 -2,-0.0 -0.830 17.1-177.7 -99.6 128.4 69.8 67.2 -9.7 571 275 B A E >>> -P 576 0H 6 5,-2.9 5,-1.8 -2,-0.5 3,-1.8 -0.786 3.3-179.4-123.2 86.5 69.5 65.3 -13.0 572 276 B P G >45S+ 0 0 56 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.775 78.3 68.7 -57.0 -28.9 68.1 67.6 -15.7 573 277 B E G 345S+ 0 0 101 1,-0.3 -2,-0.0 2,-0.1 -42,-0.0 0.799 116.0 26.1 -58.8 -32.4 68.2 64.8 -18.3 574 278 B Y G <45S- 0 0 0 -3,-1.8 -1,-0.3 2,-0.2 -17,-0.2 0.283 106.4-123.4-111.3 4.3 65.5 63.0 -16.3 575 279 B Q T <<5 + 0 0 58 -3,-0.6 -18,-2.3 -4,-0.6 2,-0.4 0.945 67.9 142.4 46.7 52.4 64.0 66.2 -14.8 576 280 B L E < -oP 557 571H 0 -5,-1.8 -5,-2.9 -20,-0.2 2,-0.6 -0.976 52.8-152.7-133.7 135.0 64.6 64.5 -11.5 577 281 B V E -oP 558 570H 30 -20,-2.7 -18,-2.9 -2,-0.4 2,-0.9 -0.934 23.2-149.4-100.8 113.5 65.8 65.5 -8.0 578 282 B D E +oP 559 569H 0 -9,-3.3 -9,-2.2 -2,-0.6 -18,-0.1 -0.744 32.6 158.2 -92.0 107.2 67.5 62.4 -6.5 579 283 B E S S+ 0 0 43 -20,-2.2 -18,-0.2 -2,-0.9 -1,-0.2 0.223 75.4 34.2-100.7 11.2 67.0 62.4 -2.7 580 284 B L S > S+ 0 0 12 -21,-0.3 4,-1.6 -20,-0.1 5,-0.1 0.722 107.3 43.7-131.7 -58.8 67.6 58.7 -2.4 581 285 B V H > S+ 0 0 0 2,-0.2 4,-2.8 3,-0.2 5,-0.2 0.984 118.9 33.6 -74.9 -59.8 70.0 56.8 -4.6 582 286 B V H > S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.944 118.5 54.1 -65.0 -46.7 73.2 58.9 -4.9 583 287 B P H > S+ 0 0 12 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.899 111.6 46.2 -50.6 -41.4 72.8 60.2 -1.3 584 288 B L H X S+ 0 0 40 -4,-1.6 4,-2.8 2,-0.2 5,-0.2 0.944 110.3 52.5 -66.4 -46.9 72.6 56.6 -0.1 585 289 B L H X S+ 0 0 66 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.881 109.1 50.8 -54.8 -40.4 75.6 55.6 -2.2 586 290 B R H X S+ 0 0 126 -4,-2.8 4,-1.3 2,-0.2 -1,-0.2 0.924 111.2 46.7 -63.6 -45.5 77.6 58.5 -0.6 587 291 B V H >X S+ 0 0 96 -4,-1.9 3,-0.6 1,-0.2 4,-0.6 0.947 113.3 49.3 -58.5 -49.9 76.7 57.4 2.9 588 292 B I H >< S+ 0 0 57 -4,-2.8 3,-1.2 1,-0.2 -1,-0.2 0.860 102.5 63.6 -59.0 -39.6 77.6 53.8 2.1 589 293 B G H 3< S+ 0 0 57 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.878 99.0 53.3 -50.0 -44.6 80.9 55.1 0.6 590 294 B K H << 0 0 190 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.636 360.0 360.0 -71.6 -16.2 82.0 56.3 4.1 591 295 B A << 0 0 137 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.337 360.0 360.0 -76.7 360.0 81.4 52.9 5.6