==== 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 DNA BINDING PROTEIN 28-MAY-06 2H5X . COMPND 2 MOLECULE: HOLLIDAY JUNCTION ATP-DEPENDENT DNA HELICASE RUVA . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR J.R.PRABU,S.THAMOTHARAN,J.S.KHANDUJA,E.Z.ALIPIO,C.Y.KIM,G.S. . 730 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33631.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 550 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 128 17.5 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 . 12 1.6 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 . 64 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 269 36.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.1 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 1 5 2 0 0 5 11 4 4 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 4 4 4 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 . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 38 0, 0.0 580,-2.8 0, 0.0 2,-0.9 0.000 360.0 360.0 360.0 -50.5 40.0 42.4 23.5 2 2 A I E +A 580 0A 9 578,-0.2 48,-0.5 1,-0.2 578,-0.2 -0.737 360.0 170.9 -84.9 109.9 37.4 43.1 20.8 3 3 A A E + 0 0 11 576,-2.9 45,-1.2 -2,-0.9 2,-0.3 0.638 63.0 4.0 -92.0 -20.1 38.1 46.6 19.7 4 4 A S E -AB 579 47A 7 575,-1.3 575,-2.9 43,-0.3 2,-0.4 -0.979 53.1-151.9-165.3 151.9 35.8 46.7 16.6 5 5 A V E -AB 578 46A 0 41,-1.7 41,-2.0 -2,-0.3 2,-0.5 -0.989 13.5-176.0-132.6 124.0 33.2 44.6 14.7 6 6 A R E + B 0 45A 97 571,-3.1 2,-0.3 -2,-0.4 39,-0.3 -0.977 33.8 88.8-123.0 123.9 32.6 45.0 11.0 7 7 A G E S- B 0 44A 2 37,-2.6 37,-1.6 -2,-0.5 2,-0.5 -0.977 73.1 -29.7 179.7-166.2 29.9 43.1 9.1 8 8 A E E -CB 20 43A 80 12,-1.3 12,-2.1 -2,-0.3 2,-0.8 -0.620 55.2-126.7 -79.2 122.1 26.3 42.9 7.9 9 9 A V E +C 19 0A 0 33,-3.7 32,-3.2 -2,-0.5 33,-0.3 -0.548 31.9 176.6 -67.9 104.9 23.8 44.7 10.1 10 10 A L E + 0 0 23 8,-3.1 2,-0.3 -2,-0.8 -1,-0.2 0.743 64.7 9.5 -84.6 -23.8 21.3 42.0 10.9 11 11 A E E -C 18 0A 72 7,-1.0 7,-1.9 28,-0.1 2,-0.6 -0.941 54.2-158.6-161.2 132.4 19.1 43.9 13.2 12 12 A V E +C 17 0A 55 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.936 25.3 174.1-115.4 107.2 18.8 47.5 14.4 13 13 A A - 0 0 26 3,-2.6 -2,-0.0 -2,-0.6 5,-0.0 -0.213 45.5 -98.0 -97.4-168.3 17.0 47.8 17.7 14 14 A L S S+ 0 0 44 1,-0.1 21,-0.1 -2,-0.1 3,-0.1 0.694 119.8 20.8 -87.5 -19.0 16.4 50.9 19.9 15 15 A D S S+ 0 0 86 1,-0.2 15,-1.6 16,-0.1 2,-0.3 0.285 129.4 14.9-130.2 8.0 19.3 50.2 22.3 16 16 A H E - D 0 29A 18 13,-0.3 -3,-2.6 44,-0.0 2,-0.3 -0.983 55.7-137.9-168.3 173.5 21.6 48.0 20.2 17 17 A V E -CD 12 28A 0 11,-2.0 11,-3.0 -2,-0.3 2,-0.5 -0.942 15.4-136.0-139.3 158.6 22.5 46.5 16.8 18 18 A V E -CD 11 27A 7 -7,-1.9 -8,-3.1 -2,-0.3 -7,-1.0 -0.963 20.7-173.0-123.6 113.1 23.6 43.0 15.7 19 19 A I E -CD 9 26A 0 7,-2.1 7,-3.1 -2,-0.5 2,-0.6 -0.910 15.0-142.0-108.8 130.0 26.5 42.8 13.3 20 20 A E E -CD 8 25A 17 -12,-2.1 -12,-1.3 -2,-0.5 2,-0.5 -0.808 18.4-178.5 -97.2 122.0 27.5 39.5 11.7 21 21 A A E > S- D 0 24A 3 3,-3.6 3,-2.9 -2,-0.6 -14,-0.1 -0.976 73.5 -21.3-119.4 121.6 31.2 38.7 11.3 22 22 A A T 3 S- 0 0 47 -2,-0.5 -1,-0.2 1,-0.3 169,-0.1 0.915 130.3 -48.0 45.2 51.5 32.2 35.5 9.6 23 23 A G T 3 S+ 0 0 7 1,-0.2 168,-1.5 -3,-0.1 2,-0.6 0.324 117.8 113.5 76.7 -9.9 28.9 34.0 10.5 24 24 A V E < -DE 21 190A 3 -3,-2.9 -3,-3.6 166,-0.2 2,-0.7 -0.853 56.6-149.0-100.9 124.3 29.0 35.1 14.1 25 25 A G E -DE 20 189A 0 164,-3.4 163,-3.6 -2,-0.6 164,-1.1 -0.809 11.6-162.2 -95.3 116.7 26.5 37.8 15.1 26 26 A Y E -DE 19 187A 22 -7,-3.1 -7,-2.1 -2,-0.7 2,-0.6 -0.833 12.5-139.5-101.2 131.9 27.6 40.1 17.8 27 27 A R E -D 18 0A 82 159,-2.6 32,-0.6 -2,-0.5 2,-0.5 -0.751 23.7-173.7 -85.7 124.0 25.2 42.2 19.9 28 28 A V E -Df 17 59A 0 -11,-3.0 -11,-2.0 -2,-0.6 32,-0.2 -0.965 16.9-137.9-126.6 120.5 26.6 45.6 20.4 29 29 A N E +Df 16 60A 23 30,-2.5 32,-2.5 -2,-0.5 2,-0.3 -0.422 35.0 158.5 -70.8 143.7 24.9 48.2 22.6 30 30 A A - 0 0 4 -15,-1.6 32,-0.1 30,-0.2 60,-0.0 -0.976 39.3 -92.5-159.4 170.0 24.8 51.7 21.4 31 31 A T > - 0 0 12 30,-0.3 4,-2.7 -2,-0.3 5,-0.2 -0.494 40.1-109.6 -87.1 160.4 23.0 55.1 21.6 32 32 A P H > S+ 0 0 7 0, 0.0 4,-3.5 0, 0.0 5,-0.2 0.936 120.6 58.0 -52.5 -46.5 20.1 56.1 19.4 33 33 A A H > S+ 0 0 54 1,-0.2 4,-0.8 2,-0.2 57,-0.1 0.908 109.4 41.7 -49.0 -52.2 22.5 58.6 17.7 34 34 A T H 4 S+ 0 0 7 1,-0.2 3,-0.4 2,-0.2 -1,-0.2 0.882 116.9 49.6 -66.2 -36.8 24.9 55.8 16.7 35 35 A L H >< S+ 0 0 6 -4,-2.7 3,-3.1 1,-0.2 -2,-0.2 0.890 97.0 67.0 -69.5 -41.3 22.0 53.5 15.7 36 36 A A H 3< S+ 0 0 33 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.826 97.3 56.4 -49.1 -35.6 20.2 56.1 13.5 37 37 A T T 3< S+ 0 0 105 -4,-0.8 2,-0.3 -3,-0.4 -1,-0.3 0.559 96.0 87.3 -75.7 -7.3 23.2 55.9 11.2 38 38 A L < - 0 0 19 -3,-3.1 2,-0.4 -4,-0.1 6,-0.1 -0.746 55.7-168.2-101.2 143.9 22.8 52.1 10.8 39 39 A R > - 0 0 191 -2,-0.3 3,-1.4 4,-0.2 -30,-0.3 -0.989 27.1-109.2-132.7 135.6 20.6 50.2 8.3 40 40 A Q T 3 S+ 0 0 142 -2,-0.4 -30,-0.2 1,-0.2 3,-0.1 -0.220 101.4 24.1 -58.7 145.3 19.7 46.5 8.2 41 41 A G T 3 S+ 0 0 54 -32,-3.2 -1,-0.2 1,-0.3 2,-0.2 0.499 102.6 107.9 76.9 2.6 21.2 44.4 5.5 42 42 A T S < S- 0 0 70 -3,-1.4 -33,-3.7 -33,-0.3 -1,-0.3 -0.687 74.2-107.7-108.4 163.2 24.1 46.8 5.1 43 43 A E E +B 8 0A 124 -35,-0.3 2,-0.3 -2,-0.2 -35,-0.2 -0.556 43.3 171.6 -86.1 156.9 27.7 46.4 6.1 44 44 A A E -B 7 0A 21 -37,-1.6 -37,-2.6 -2,-0.2 2,-0.4 -0.945 24.9-152.9-166.7 143.9 29.0 48.4 9.1 45 45 A R E -B 6 0A 129 -2,-0.3 2,-0.4 -39,-0.3 -39,-0.2 -0.984 15.4-175.3-123.5 130.7 32.0 48.8 11.3 46 46 A L E -B 5 0A 7 -41,-2.0 -41,-1.7 -2,-0.4 2,-0.8 -0.936 28.0-124.7-124.0 146.0 31.7 50.1 14.9 47 47 A I E -BG 4 62A 23 15,-2.8 15,-1.4 -2,-0.4 -43,-0.3 -0.830 43.0-164.2 -93.2 110.2 34.5 50.8 17.3 48 48 A T E - G 0 61A 1 -45,-1.2 2,-0.4 -2,-0.8 13,-0.2 -0.466 26.5-148.9 -98.9 168.0 33.7 48.7 20.4 49 49 A A E - G 0 60A 6 11,-1.4 11,-0.9 -2,-0.2 2,-0.6 -0.953 18.2-150.9-134.3 107.1 34.6 48.4 24.0 50 50 A M E - G 0 59A 26 -48,-0.5 2,-0.6 -2,-0.4 9,-0.2 -0.748 12.6-170.0 -86.0 121.0 34.4 44.8 25.3 51 51 A I E - G 0 58A 15 7,-2.9 7,-2.4 -2,-0.6 2,-0.5 -0.940 1.8-167.3-116.4 110.9 33.6 44.8 29.1 52 52 A V E + G 0 57A 8 -2,-0.6 2,-0.2 557,-0.4 5,-0.2 -0.853 11.5 169.2-104.4 130.4 34.0 41.4 30.8 53 53 A R E > - G 0 56A 108 3,-2.3 3,-1.0 -2,-0.5 556,-0.1 -0.700 52.4 -90.0-123.2 175.2 32.6 40.8 34.3 54 54 A E T 3 S+ 0 0 64 1,-0.2 555,-0.1 -2,-0.2 3,-0.0 0.854 125.1 26.5 -60.2 -37.3 32.2 37.5 36.1 55 55 A D T 3 S+ 0 0 84 184,-0.0 182,-0.3 183,-0.0 2,-0.3 0.042 123.6 40.7-116.3 26.6 28.7 36.8 34.8 56 56 A S E < - G 0 53A 47 -3,-1.0 -3,-2.3 180,-0.1 2,-0.3 -0.992 48.0-159.7-166.5 160.6 28.7 38.7 31.5 57 57 A M E + G 0 52A 21 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.848 29.4 178.6-148.2 104.5 30.6 39.8 28.4 58 58 A T E - G 0 51A 34 -7,-2.4 -7,-2.9 -2,-0.3 2,-0.4 -0.874 21.4-149.5-122.4 149.5 29.3 42.9 26.7 59 59 A L E -fG 28 50A 0 -32,-0.6 -30,-2.5 -2,-0.3 2,-0.4 -0.885 7.9-170.7-111.7 139.3 30.2 45.0 23.7 60 60 A Y E -fG 29 49A 20 -11,-0.9 -11,-1.4 -2,-0.4 2,-0.3 -0.994 15.4-160.2-129.0 119.4 29.5 48.8 23.4 61 61 A G E + G 0 48A 0 -32,-2.5 -30,-0.3 -2,-0.4 -13,-0.2 -0.728 12.2 177.9-108.5 155.9 30.0 50.4 20.0 62 62 A F E - G 0 47A 3 -15,-1.4 -15,-2.8 -2,-0.3 -32,-0.0 -0.961 40.7-106.9-147.3 162.2 30.6 53.9 18.7 63 63 A P S S+ 0 0 70 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.907 97.7 8.1 -55.2 -49.1 31.2 55.8 15.5 64 64 A D S > S- 0 0 55 -17,-0.1 4,-1.7 -18,-0.1 -17,-0.1 -0.711 74.4-107.4-129.8 179.6 34.8 56.5 16.2 65 65 A G H > S+ 0 0 16 -2,-0.2 4,-2.4 2,-0.2 5,-0.2 0.758 113.2 62.5 -80.4 -26.7 37.6 55.7 18.6 66 66 A E H > S+ 0 0 117 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.911 109.8 41.5 -63.9 -41.9 37.5 59.2 20.2 67 67 A T H > S+ 0 0 20 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.944 112.9 51.8 -70.0 -49.4 34.0 58.4 21.4 68 68 A R H X S+ 0 0 22 -4,-1.7 4,-1.9 1,-0.3 -2,-0.2 0.887 110.5 50.8 -54.3 -39.9 34.7 54.8 22.4 69 69 A D H X S+ 0 0 79 -4,-2.4 4,-2.0 1,-0.2 -1,-0.3 0.886 104.7 56.6 -65.3 -39.3 37.6 56.1 24.4 70 70 A L H X S+ 0 0 4 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.887 105.6 52.2 -59.6 -38.4 35.4 58.7 26.1 71 71 A F H X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.931 107.4 50.3 -61.8 -50.0 33.2 55.8 27.2 72 72 A L H X S+ 0 0 75 -4,-1.9 4,-0.7 1,-0.2 -1,-0.2 0.841 110.6 52.1 -58.0 -34.6 36.1 53.9 28.7 73 73 A T H >< S+ 0 0 31 -4,-2.0 3,-0.9 2,-0.2 4,-0.3 0.893 104.1 54.1 -70.0 -42.8 37.0 57.2 30.6 74 74 A L H >< S+ 0 0 0 -4,-2.1 3,-1.6 1,-0.3 -1,-0.2 0.898 104.1 59.1 -58.5 -36.8 33.5 57.6 32.0 75 75 A L H 3< S+ 0 0 40 -4,-1.9 -1,-0.3 1,-0.3 5,-0.2 0.787 91.4 68.2 -62.9 -28.5 33.9 54.1 33.3 76 76 A S T << S+ 0 0 73 -3,-0.9 2,-0.3 -4,-0.7 -1,-0.3 0.580 81.5 94.0 -70.5 -7.7 37.0 55.1 35.3 77 77 A V S X S- 0 0 4 -3,-1.6 3,-1.7 -4,-0.3 2,-0.2 -0.660 89.7 -99.2 -87.6 143.6 34.9 57.3 37.7 78 78 A S T 3 S+ 0 0 92 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 -0.410 104.6 10.2 -65.5 124.1 33.6 55.7 40.9 79 79 A G T 3 S+ 0 0 77 -2,-0.2 2,-0.8 1,-0.2 -1,-0.3 0.408 98.4 115.5 90.5 -1.9 30.1 54.5 40.8 80 80 A V < + 0 0 15 -3,-1.7 -1,-0.2 -5,-0.2 -3,-0.2 -0.874 41.7 173.2-106.2 104.9 29.8 55.0 37.0 81 81 A G > - 0 0 29 -2,-0.8 4,-2.6 -3,-0.1 5,-0.2 -0.511 48.1 -78.2-103.0 176.8 29.3 51.7 35.3 82 82 A P H > S+ 0 0 27 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.790 125.4 46.3 -37.3 -54.2 28.6 50.6 31.6 83 83 A R H > S+ 0 0 218 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.970 113.8 45.4 -60.9 -57.5 24.9 51.4 31.7 84 84 A L H > S+ 0 0 40 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.894 112.3 54.3 -55.5 -39.2 25.1 54.8 33.3 85 85 A A H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.919 109.5 46.6 -60.0 -45.8 28.0 55.6 30.9 86 86 A M H X S+ 0 0 18 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.918 111.2 52.0 -63.4 -44.3 25.9 54.8 27.9 87 87 A A H X S+ 0 0 5 -4,-2.8 4,-2.5 2,-0.2 5,-0.3 0.899 104.7 55.4 -59.3 -44.2 22.9 56.8 29.3 88 88 A A H X S+ 0 0 1 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.946 115.0 40.6 -53.7 -47.6 25.2 59.9 29.8 89 89 A L H < S+ 0 0 11 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.814 109.8 56.9 -71.6 -33.1 26.1 59.6 26.1 90 90 A A H < S+ 0 0 13 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.904 117.0 37.7 -64.6 -37.4 22.5 58.7 24.9 91 91 A V H < S+ 0 0 10 -4,-2.5 2,-0.4 1,-0.2 -2,-0.2 0.801 128.4 31.9 -82.0 -34.9 21.4 62.0 26.6 92 92 A H S < S- 0 0 14 -4,-2.3 -1,-0.2 -5,-0.3 6,-0.0 -0.952 82.8-129.4-130.9 115.8 24.5 64.0 25.6 93 93 A D > - 0 0 105 -2,-0.4 4,-3.5 -3,-0.2 3,-0.3 -0.143 37.1-100.5 -54.5 157.1 26.5 63.5 22.4 94 94 A A H > S+ 0 0 11 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.919 122.7 51.6 -45.2 -58.1 30.3 63.1 22.9 95 95 A P H > S+ 0 0 95 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.866 117.3 38.9 -49.1 -45.8 31.0 66.7 21.9 96 96 A A H > S+ 0 0 35 -3,-0.3 4,-3.3 2,-0.2 5,-0.3 0.974 113.9 52.8 -71.5 -54.9 28.4 68.1 24.3 97 97 A L H X S+ 0 0 0 -4,-3.5 4,-2.3 1,-0.2 -3,-0.2 0.896 112.0 47.1 -47.2 -46.7 29.2 65.7 27.1 98 98 A R H X S+ 0 0 69 -4,-3.5 4,-0.6 -5,-0.3 -1,-0.2 0.987 112.0 50.5 -57.7 -57.6 32.8 66.7 26.8 99 99 A Q H >X S+ 0 0 40 -4,-2.2 4,-2.8 -5,-0.3 3,-2.4 0.913 109.2 50.7 -43.8 -56.3 31.8 70.4 26.8 100 100 A V H 3<>S+ 0 0 12 -4,-3.3 5,-1.8 1,-0.3 -1,-0.3 0.915 106.3 55.9 -49.9 -48.1 29.7 69.9 29.9 101 101 A L H 3<5S+ 0 0 1 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.506 112.8 41.7 -65.9 -5.2 32.6 68.2 31.7 102 102 A A H <<5S+ 0 0 51 -3,-2.4 -2,-0.2 -4,-0.6 -1,-0.2 0.763 112.8 50.0-104.4 -46.4 34.8 71.2 31.0 103 103 A D T <5S- 0 0 121 -4,-2.8 3,-0.2 -5,-0.2 -2,-0.2 0.319 107.4-128.0 -73.6 10.6 32.2 73.9 31.8 104 104 A G T 5 + 0 0 23 -5,-0.2 2,-1.4 1,-0.2 -3,-0.2 0.741 40.6 179.9 46.8 24.9 31.6 72.0 35.0 105 105 A N >< + 0 0 59 -5,-1.8 4,-1.5 -6,-0.3 -1,-0.2 -0.378 12.4 168.6 -60.6 90.8 27.9 72.1 33.9 106 106 A V H > S+ 0 0 46 -2,-1.4 4,-1.9 -3,-0.2 -1,-0.2 0.751 71.8 62.6 -77.8 -25.0 26.5 70.2 36.8 107 107 A A H > S+ 0 0 57 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.965 105.2 46.1 -63.2 -51.4 22.9 71.2 35.8 108 108 A A H >> S+ 0 0 5 1,-0.2 3,-0.7 2,-0.2 4,-0.7 0.925 110.5 51.4 -56.7 -52.2 23.3 69.4 32.4 109 109 A L H >< S+ 0 0 1 -4,-1.5 3,-2.0 1,-0.2 6,-0.3 0.915 101.5 62.3 -53.4 -47.3 24.8 66.2 33.9 110 110 A T H 3< S+ 0 0 64 -4,-1.9 5,-0.4 1,-0.3 -1,-0.2 0.856 91.4 66.6 -46.9 -42.8 22.0 65.9 36.5 111 111 A R H << S+ 0 0 79 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.835 78.9 93.0 -50.3 -36.5 19.5 65.6 33.6 112 112 A V S X< S- 0 0 0 -3,-2.0 3,-2.3 -4,-0.7 -24,-0.1 -0.450 95.6-112.0 -61.2 117.6 21.1 62.2 32.8 113 113 A P T 3 S+ 0 0 23 0, 0.0 222,-0.1 0, 0.0 -1,-0.1 -0.341 102.3 28.5 -55.2 125.1 18.9 59.8 34.8 114 114 A G T 3 S+ 0 0 67 -4,-0.2 2,-0.8 1,-0.2 -3,-0.1 0.243 91.1 106.5 109.1 -13.4 21.1 58.4 37.6 115 115 A I < - 0 0 9 -3,-2.3 -1,-0.2 -5,-0.4 -3,-0.1 -0.854 51.2-167.4-105.7 104.6 23.5 61.3 38.0 116 116 A G > - 0 0 16 -2,-0.8 4,-2.2 -3,-0.1 5,-0.2 -0.047 41.2 -90.2 -75.9-175.4 22.7 63.2 41.3 117 117 A K H > S+ 0 0 55 2,-0.2 4,-1.5 1,-0.2 -7,-0.1 0.918 129.8 39.3 -63.0 -44.2 24.1 66.6 42.3 118 118 A R H > S+ 0 0 158 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.953 112.0 55.7 -70.8 -51.9 27.1 64.9 44.0 119 119 A G H > S+ 0 0 14 1,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.908 108.6 49.0 -46.4 -48.5 27.6 62.3 41.3 120 120 A A H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -1,-0.3 0.918 109.1 53.5 -58.8 -44.0 27.9 64.9 38.7 121 121 A E H X S+ 0 0 112 -4,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.860 107.5 49.8 -60.2 -38.6 30.4 66.8 40.8 122 122 A R H X S+ 0 0 121 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.873 111.8 49.4 -67.9 -38.2 32.6 63.8 41.2 123 123 A M H X S+ 0 0 5 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.952 112.6 46.0 -65.0 -49.8 32.5 63.3 37.4 124 124 A V H < S+ 0 0 9 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.910 116.2 46.6 -59.3 -43.4 33.4 66.9 36.7 125 125 A L H < S+ 0 0 108 -4,-2.5 3,-0.4 -5,-0.2 4,-0.3 0.919 113.4 48.0 -64.8 -46.5 36.2 66.8 39.4 126 126 A E H < S+ 0 0 93 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.832 126.1 21.4 -64.9 -37.9 37.6 63.5 38.1 127 127 A L S < S+ 0 0 3 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.1 -0.532 79.1 102.0-143.2 78.1 37.7 64.4 34.5 128 128 A R S > S+ 0 0 117 -3,-0.4 4,-0.5 -2,-0.2 3,-0.5 0.563 98.8 39.8-113.6 -36.7 37.7 68.0 33.4 129 129 A D T 4 S+ 0 0 79 -4,-0.3 -2,-0.1 1,-0.2 -27,-0.1 -0.137 110.1 62.8-105.2 32.4 41.4 67.9 32.7 130 130 A K T 4 S+ 0 0 134 2,-0.0 -1,-0.2 0, 0.0 -3,-0.0 0.124 99.8 48.5-141.1 18.7 41.3 64.5 31.2 131 131 A V T 4 S- 0 0 37 -3,-0.5 -2,-0.1 -30,-0.1 -33,-0.1 0.546 135.6 -31.8-126.9 -34.4 39.1 65.1 28.2 132 132 A G < 0 0 70 -4,-0.5 -3,-0.1 -34,-0.1 -2,-0.0 0.132 360.0 360.0 171.7 57.2 40.6 68.2 26.6 133 133 A V 0 0 137 -4,-0.0 -5,-0.1 -31,-0.0 -1,-0.0 -0.452 360.0 360.0-143.1 360.0 42.3 70.7 29.0 134 ! 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 0.0 135 146 A A > 0 0 118 0, 0.0 3,-0.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 34.8 51.2 66.7 18.7 136 147 A V T 3> + 0 0 56 1,-0.2 4,-1.8 2,-0.1 33,-0.0 0.081 360.0 51.7 27.3 -78.2 54.5 64.8 19.0 137 148 A R H 3> S+ 0 0 117 -2,-0.3 4,-1.6 1,-0.2 3,-0.5 0.921 109.6 40.5 -46.5 -73.8 55.7 66.0 22.4 138 149 A S H <> S+ 0 0 69 -3,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.859 113.7 54.4 -48.6 -45.6 52.7 65.3 24.8 139 150 A P H > S+ 0 0 39 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.907 106.3 52.1 -57.8 -43.7 51.8 61.9 23.3 140 151 A V H X S+ 0 0 0 -4,-1.8 4,-1.9 -3,-0.5 -2,-0.2 0.861 110.1 47.2 -63.1 -38.1 55.3 60.6 23.8 141 152 A V H X S+ 0 0 26 -4,-1.6 4,-2.9 2,-0.2 5,-0.3 0.875 108.8 54.6 -73.3 -34.3 55.5 61.5 27.4 142 153 A E H X S+ 0 0 147 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.925 108.1 50.9 -61.4 -41.2 52.1 60.0 28.0 143 154 A A H X S+ 0 0 17 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.918 112.9 45.1 -59.9 -46.0 53.5 56.8 26.5 144 155 A L H <>S+ 0 0 0 -4,-1.9 5,-2.6 2,-0.2 -2,-0.2 0.857 111.6 50.5 -68.7 -37.4 56.5 56.9 28.8 145 156 A V H ><5S+ 0 0 68 -4,-2.9 3,-1.2 1,-0.2 -1,-0.2 0.852 107.4 57.4 -68.7 -30.5 54.4 57.7 31.9 146 157 A G H 3<5S+ 0 0 66 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.827 102.0 53.2 -67.5 -31.6 52.2 54.8 30.9 147 158 A L T 3<5S- 0 0 38 -4,-1.1 -1,-0.3 -5,-0.1 -2,-0.2 0.427 132.5 -93.5 -82.8 0.8 55.3 52.5 31.0 148 159 A G T < 5S+ 0 0 46 -3,-1.2 -3,-0.2 1,-0.3 2,-0.2 0.630 76.2 145.5 99.8 14.7 55.9 53.7 34.5 149 160 A F < - 0 0 16 -5,-2.6 -1,-0.3 -8,-0.1 2,-0.2 -0.553 54.5-104.9 -86.6 152.2 58.3 56.6 34.0 150 161 A A >> - 0 0 58 -2,-0.2 4,-2.5 1,-0.1 3,-1.4 -0.542 28.3-131.0 -73.4 136.3 58.4 59.8 36.1 151 162 A A H 3> S+ 0 0 56 1,-0.3 4,-3.0 -2,-0.2 5,-0.4 0.951 101.6 51.3 -54.2 -62.6 56.9 62.8 34.3 152 163 A K H 34 S+ 0 0 143 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.327 120.3 39.1 -64.4 13.7 59.5 65.4 34.8 153 164 A Q H <> S+ 0 0 81 -3,-1.4 4,-1.6 3,-0.1 -1,-0.3 0.494 110.1 57.9-126.4 -33.7 62.1 62.9 33.6 154 165 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 -3,-0.3 3,-0.2 0.914 110.1 45.4 -65.0 -42.4 59.9 61.5 30.8 155 166 A E H X S+ 0 0 53 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.732 105.3 62.6 -75.4 -18.6 59.6 64.9 29.4 156 167 A E H > S+ 0 0 114 -5,-0.4 4,-1.3 2,-0.2 -1,-0.2 0.881 107.4 42.7 -72.2 -35.3 63.3 65.5 29.8 157 168 A A H X S+ 0 0 9 -4,-1.6 4,-2.7 -3,-0.2 -2,-0.2 0.897 110.7 56.2 -74.8 -40.9 64.1 62.6 27.4 158 169 A T H X S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.2 5,-0.2 0.857 107.6 48.0 -60.9 -36.6 61.4 63.7 25.0 159 170 A D H X S+ 0 0 55 -4,-1.7 4,-2.8 2,-0.2 5,-0.3 0.893 111.1 50.4 -71.2 -40.4 62.9 67.2 24.6 160 171 A T H X S+ 0 0 80 -4,-1.3 4,-3.2 2,-0.2 5,-0.2 0.952 116.2 42.5 -60.0 -50.1 66.4 65.8 24.1 161 172 A V H X S+ 0 0 9 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.968 117.5 44.4 -61.0 -56.6 65.1 63.4 21.4 162 173 A L H < S+ 0 0 28 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.853 119.0 44.1 -59.6 -37.3 62.8 66.0 19.7 163 174 A A H < S+ 0 0 62 -4,-2.8 3,-0.3 -5,-0.2 -1,-0.2 0.923 114.3 47.5 -73.4 -44.6 65.5 68.6 19.9 164 175 A A H < S+ 0 0 86 -4,-3.2 2,-0.3 1,-0.3 -2,-0.2 0.790 133.7 17.0 -65.1 -29.7 68.3 66.3 18.8 165 176 A N < + 0 0 87 -4,-2.3 -1,-0.3 -5,-0.2 3,-0.3 -0.887 65.4 172.6-146.0 108.7 66.0 65.1 16.0 166 177 A H S S+ 0 0 147 -2,-0.3 -1,-0.1 -3,-0.3 -2,-0.1 0.949 73.4 69.3 -82.0 -53.8 63.0 67.2 15.0 167 178 A D S S+ 0 0 98 0, 0.0 -1,-0.2 0, 0.0 -5,-0.1 0.514 78.3 131.0 -44.3 -4.8 61.8 65.3 11.9 168 179 A A - 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0 0 27 -2,-0.7 4,-2.7 -3,-0.1 5,-0.2 -0.560 47.8 -83.8-112.8 178.2 18.5 28.7 35.5 267 82 B P H > S+ 0 0 26 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.858 124.2 47.8 -45.8 -50.8 19.5 27.8 31.9 268 83 B R H > S+ 0 0 220 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.942 114.1 44.5 -60.3 -52.6 18.8 24.1 32.3 269 84 B L H > S+ 0 0 39 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.888 112.0 55.2 -61.4 -37.6 15.3 24.6 33.8 270 85 B A H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.955 109.4 45.8 -59.9 -50.4 14.6 27.2 31.2 271 86 B M H X S+ 0 0 17 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.937 111.7 51.2 -57.5 -51.2 15.4 24.9 28.4 272 87 B A H X S+ 0 0 6 -4,-2.6 4,-2.1 1,-0.2 3,-0.3 0.914 108.9 52.5 -52.8 -46.2 13.4 22.0 29.9 273 88 B A H X S+ 0 0 5 -4,-2.7 4,-2.3 1,-0.2 3,-0.3 0.959 113.1 43.3 -55.2 -51.6 10.5 24.4 30.2 274 89 B L H < S+ 0 0 8 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.671 108.8 58.6 -69.7 -18.0 10.8 25.3 26.6 275 90 B A H < S+ 0 0 11 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.874 112.4 39.3 -78.1 -36.0 11.2 21.7 25.5 276 91 B V H < S+ 0 0 10 -4,-2.1 2,-0.5 -3,-0.3 -2,-0.2 0.871 126.1 33.5 -78.9 -41.6 7.9 20.7 27.1 277 92 B H S < S- 0 0 12 -4,-2.3 -1,-0.2 -5,-0.3 5,-0.1 -0.972 84.5-127.9-120.2 123.9 6.0 23.8 26.0 278 93 B D > - 0 0 99 -2,-0.5 4,-3.1 -3,-0.1 5,-0.2 -0.247 39.3 -97.9 -61.1 159.4 6.7 25.6 22.8 279 94 B A H > S+ 0 0 9 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.914 124.7 48.1 -45.0 -58.1 7.3 29.4 23.2 280 95 B P H > S+ 0 0 96 0, 0.0 4,-3.1 0, 0.0 -1,-0.2 0.933 114.8 46.5 -48.8 -52.8 3.7 30.4 22.3 281 96 B A H > S+ 0 0 43 1,-0.2 4,-3.1 2,-0.2 -2,-0.2 0.896 112.3 51.4 -57.1 -43.7 2.3 27.7 24.6 282 97 B L H X S+ 0 0 1 -4,-3.1 4,-2.3 2,-0.2 -1,-0.2 0.880 111.7 44.7 -65.5 -40.2 4.7 28.8 27.4 283 98 B R H X S+ 0 0 43 -4,-2.9 4,-2.8 -5,-0.2 5,-0.3 0.944 114.1 51.7 -68.9 -44.4 3.7 32.5 27.1 284 99 B Q H >X S+ 0 0 99 -4,-3.1 4,-2.6 -5,-0.3 3,-0.6 0.979 110.9 46.3 -51.1 -67.4 0.1 31.5 27.0 285 100 B V H 3<>S+ 0 0 12 -4,-3.1 5,-2.3 1,-0.3 -1,-0.2 0.881 113.3 50.1 -39.9 -56.2 0.4 29.3 30.1 286 101 B L H ><5S+ 0 0 2 -4,-2.3 3,-1.1 1,-0.2 -1,-0.3 0.868 111.8 46.2 -55.7 -42.8 2.2 32.0 32.0 287 102 B A H <<5S+ 0 0 18 -4,-2.8 -1,-0.2 -3,-0.6 -2,-0.2 0.849 114.0 49.8 -70.6 -31.7 -0.3 34.7 31.2 288 103 B D T 3<5S- 0 0 94 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.112 108.1-123.7 -93.8 23.7 -3.1 32.4 32.1 289 104 B G T < 5 + 0 0 18 -3,-1.1 2,-3.6 1,-0.2 3,-0.2 0.711 44.7 173.8 42.0 25.9 -1.6 31.4 35.4 290 105 B N >>< + 0 0 61 -5,-2.3 4,-1.8 -6,-0.2 3,-0.6 -0.250 7.1 164.9 -61.8 65.8 -1.8 27.8 34.2 291 106 B V H 3> S+ 0 0 61 -2,-3.6 4,-2.5 1,-0.2 -1,-0.2 0.829 70.6 61.1 -55.1 -33.2 0.1 26.5 37.2 292 107 B A H 3> S+ 0 0 50 -3,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.921 105.0 46.9 -60.2 -45.5 -1.1 23.0 36.3 293 108 B A H X> S+ 0 0 2 -3,-0.6 3,-0.7 1,-0.2 4,-0.5 0.909 113.3 47.0 -63.8 -46.4 0.7 23.1 32.9 294 109 B L H >< S+ 0 0 2 -4,-1.8 3,-2.0 1,-0.2 6,-0.2 0.911 103.5 61.5 -63.6 -43.9 4.0 24.5 34.3 295 110 B T H 3< S+ 0 0 49 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.769 92.7 68.6 -54.8 -24.5 4.0 21.9 37.1 296 111 B R H << S+ 0 0 117 -4,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.846 79.1 92.4 -63.5 -34.0 4.1 19.3 34.3 297 112 B V S X< S- 0 0 1 -3,-2.0 3,-1.7 -4,-0.5 -24,-0.1 -0.414 92.5-109.2 -62.2 129.4 7.7 20.5 33.4 298 113 B P T 3 S+ 0 0 20 0, 0.0 221,-0.1 0, 0.0 -1,-0.1 -0.339 102.0 22.7 -61.0 141.5 10.2 18.4 35.4 299 114 B G T 3 S+ 0 0 80 1,-0.2 2,-0.7 219,-0.2 5,-0.1 0.178 98.5 104.0 89.5 -21.2 11.9 20.3 38.1 300 115 B I < - 0 0 12 -3,-1.7 -1,-0.2 -6,-0.2 2,-0.1 -0.868 52.8-170.6-100.5 118.2 9.2 22.9 38.4 301 116 B G > - 0 0 40 -2,-0.7 4,-2.5 -3,-0.1 5,-0.2 -0.276 41.0 -85.2 -96.3-175.5 7.0 22.5 41.5 302 117 B K H > S+ 0 0 63 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.914 127.7 42.6 -54.8 -49.6 3.7 24.1 42.6 303 118 B R H >> S+ 0 0 180 2,-0.2 4,-2.4 1,-0.2 3,-0.8 0.979 112.5 51.9 -62.6 -57.9 5.5 27.0 44.2 304 119 B G H 3> S+ 0 0 14 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.885 107.6 53.0 -44.4 -50.0 8.0 27.6 41.4 305 120 B A H 3X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -1,-0.3 0.888 110.7 49.0 -54.3 -41.7 5.2 27.7 38.9 306 121 B E H S- 0 0 27 -2,-0.4 2,-3.7 -3,-0.2 3,-0.7 -0.875 72.7-120.0-153.1 114.4 5.6 39.0 27.9 317 132 B G T 3 S+ 0 0 77 -2,-0.3 -62,-0.1 1,-0.2 -2,-0.0 -0.171 108.8 20.4 -55.7 63.3 6.0 40.5 24.4 318 133 B V T 3 0 0 98 -2,-3.7 -1,-0.2 -35,-0.1 -3,-0.0 -0.085 360.0 360.0 170.2 -48.3 2.5 39.6 23.3 319 134 B A < 0 0 64 -3,-0.7 -2,-0.1 0, 0.0 -4,-0.1 -0.540 360.0 360.0-112.4 360.0 0.4 39.0 26.5 320 ! 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 0.0 321 146 B A 0 0 131 0, 0.0 35,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 90.0 3.2 51.0 18.0 322 147 B V > + 0 0 41 33,-0.1 4,-1.7 3,-0.1 5,-0.2 0.509 360.0 60.9-135.7 -34.1 5.7 53.8 18.4 323 148 B R H > S+ 0 0 107 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.996 105.6 45.0 -62.7 -65.8 4.7 55.6 21.6 324 149 B S H > S+ 0 0 77 1,-0.2 4,-3.6 2,-0.2 5,-0.2 0.891 113.2 50.0 -45.4 -54.2 5.1 52.7 24.0 325 150 B P H > S+ 0 0 41 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.937 110.9 48.8 -52.9 -52.5 8.5 51.4 22.6 326 151 B V H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.893 113.9 46.2 -57.5 -40.4 10.0 54.9 22.7 327 152 B V H X S+ 0 0 12 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.953 110.2 55.6 -66.1 -43.8 8.8 55.3 26.3 328 153 B E H X S+ 0 0 117 -4,-3.6 4,-2.5 -5,-0.3 -2,-0.2 0.898 110.8 43.5 -51.9 -45.5 10.1 51.8 26.9 329 154 B A H X S+ 0 0 19 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.896 113.3 51.3 -68.9 -40.5 13.6 52.8 25.7 330 155 B L H <>S+ 0 0 0 -4,-2.5 5,-2.4 -5,-0.2 -2,-0.2 0.836 112.3 46.6 -65.1 -33.8 13.4 56.1 27.6 331 156 B V H ><5S+ 0 0 60 -4,-3.0 3,-2.0 3,-0.2 -2,-0.2 0.914 110.0 55.0 -71.9 -42.6 12.5 54.2 30.7 332 157 B G H 3<5S+ 0 0 67 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.840 102.4 55.9 -58.1 -37.1 15.3 51.8 30.0 333 158 B L T 3<5S- 0 0 41 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.448 132.8 -88.6 -76.9 0.9 17.8 54.6 29.8 334 159 B G T < 5S+ 0 0 46 -3,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.502 83.1 134.3 108.7 2.8 16.8 55.6 33.3 335 160 B F < - 0 0 19 -5,-2.4 -1,-0.3 -6,-0.2 2,-0.2 -0.575 56.7-112.1 -86.7 152.8 13.9 58.0 32.8 336 161 B A > - 0 0 65 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.510 26.6-115.4 -79.6 150.9 10.7 57.8 34.8 337 162 B A H > S+ 0 0 56 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.884 111.7 50.9 -52.8 -46.8 7.5 56.8 33.0 338 163 B K H > S+ 0 0 62 1,-0.2 4,-2.3 2,-0.2 3,-0.4 0.988 113.6 41.8 -56.4 -65.9 5.7 60.1 33.5 339 164 B Q H > S+ 0 0 94 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.838 114.4 55.6 -51.2 -35.9 8.5 62.3 32.2 340 165 B A H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.914 107.7 45.1 -66.3 -46.2 9.1 59.9 29.4 341 166 B E H X S+ 0 0 77 -4,-2.4 4,-3.3 -3,-0.4 5,-0.3 0.958 108.2 60.0 -62.1 -48.7 5.6 59.9 28.0 342 167 B E H X S+ 0 0 132 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.844 111.5 38.3 -46.6 -45.1 5.5 63.7 28.3 343 168 B A H X S+ 0 0 5 -4,-1.5 4,-2.1 -5,-0.2 -1,-0.2 0.844 114.9 53.0 -79.0 -34.5 8.4 64.1 25.9 344 169 B T H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.918 108.5 50.0 -67.7 -43.2 7.4 61.3 23.6 345 170 B D H X S+ 0 0 60 -4,-3.3 4,-2.9 2,-0.2 5,-0.3 0.949 108.9 53.4 -59.5 -48.0 3.9 62.7 23.1 346 171 B T H X S+ 0 0 75 -4,-1.4 4,-2.4 -5,-0.3 5,-0.2 0.951 109.3 47.0 -49.9 -59.8 5.4 66.1 22.3 347 172 B V H X S+ 0 0 9 -4,-2.1 4,-3.5 1,-0.2 -1,-0.2 0.899 114.0 47.5 -51.1 -48.1 7.7 64.8 19.6 348 173 B L H < S+ 0 0 29 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.898 110.0 51.4 -64.0 -41.8 4.9 62.7 18.0 349 174 B A H < S+ 0 0 87 -4,-2.9 3,-0.5 -5,-0.2 -1,-0.2 0.913 116.7 41.6 -61.1 -41.5 2.4 65.6 18.0 350 175 B A H < S+ 0 0 85 -4,-2.4 2,-1.1 1,-0.3 -2,-0.2 0.939 119.7 43.6 -70.3 -48.9 5.0 67.8 16.3 351 176 B N S < S- 0 0 71 -4,-3.5 -1,-0.3 -5,-0.2 -2,-0.1 -0.606 95.9-138.7 -98.1 70.8 6.2 65.1 13.9 352 177 B H S S- 0 0 164 -2,-1.1 2,-0.3 -3,-0.5 -1,-0.2 0.344 71.6 -33.2 12.1 -86.7 2.7 63.8 13.0 353 178 B D S S+ 0 0 82 -3,-0.1 -1,-0.1 -4,-0.0 -5,-0.0 -0.938 84.5 137.2-153.2 127.7 3.8 60.2 13.1 354 179 B A - 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0 0 10 -5,-1.5 2,-0.4 -219,-0.1 -1,-0.3 -0.297 58.3-104.8 -65.0 150.5 57.2 11.2 34.7 703 161 D A >> - 0 0 58 1,-0.1 4,-3.0 4,-0.0 3,-0.5 -0.622 24.0-126.7 -79.1 129.9 60.5 11.2 36.6 704 162 D A H 3> S+ 0 0 48 -2,-0.4 4,-3.9 1,-0.2 5,-0.3 0.876 108.8 53.1 -37.6 -59.4 63.5 12.4 34.6 705 163 D K H 3> S+ 0 0 59 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.905 116.0 39.1 -46.0 -51.5 65.5 9.3 35.4 706 164 D Q H <4 S+ 0 0 79 -3,-0.5 -1,-0.3 2,-0.2 -2,-0.2 0.818 115.0 55.1 -69.9 -32.1 62.7 7.0 34.2 707 165 D A H >X S+ 0 0 0 -4,-3.0 4,-1.4 2,-0.2 3,-1.0 0.932 111.7 42.7 -65.9 -47.1 62.0 9.4 31.3 708 166 D E H >X S+ 0 0 77 -4,-3.9 4,-2.7 1,-0.2 3,-0.7 0.960 107.5 60.5 -62.9 -51.6 65.6 9.2 30.1 709 167 D E H 3< S+ 0 0 136 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.472 110.8 40.9 -58.5 -1.8 65.8 5.5 30.6 710 168 D A H <> S+ 0 0 8 -3,-1.0 4,-1.6 -4,-0.2 -1,-0.3 0.621 111.9 54.3-115.6 -27.5 63.0 5.0 28.1 711 169 D T H X S+ 0 0 4 -4,-1.6 3,-1.5 2,-0.2 4,-1.3 0.927 110.8 51.0 -69.7 -48.7 63.8 4.3 21.9 715 173 D L H 3< S+ 0 0 29 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.734 111.1 52.9 -62.6 -19.8 66.4 6.4 20.1 716 174 D A T 3< S+ 0 0 63 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.637 97.9 67.0 -86.9 -17.1 68.4 3.2 20.1 717 175 D A T <4 S- 0 0 73 -3,-1.5 2,-0.3 1,-0.4 -2,-0.2 0.991 130.6 -13.2 -61.9 -64.8 65.5 1.3 18.5 718 176 D N S < S- 0 0 74 -4,-1.3 -1,-0.4 1,-0.2 3,-0.1 -0.907 74.7-148.2-132.0 149.1 65.8 3.2 15.3 719 177 D H S S+ 0 0 140 -2,-0.3 2,-1.6 1,-0.2 -1,-0.2 0.939 81.1 58.0 -92.0 -66.1 68.0 6.3 15.4 720 178 D D S S+ 0 0 176 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.496 75.1 146.7 -68.8 94.1 66.7 9.0 13.0 721 179 D A - 0 0 16 -2,-1.6 5,-0.1 -3,-0.1 -6,-0.0 -0.991 55.3-103.5-131.7 136.9 63.2 9.2 14.5 722 180 D T > - 0 0 62 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.218 32.8-117.2 -55.3 151.1 61.1 12.4 14.7 723 181 D T H > S+ 0 0 49 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.877 118.8 49.1 -60.0 -34.3 61.2 13.9 18.2 724 182 D S H > S+ 0 0 35 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.934 108.7 51.8 -69.5 -46.4 57.4 13.3 18.3 725 183 D S H > S+ 0 0 34 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.836 109.3 49.7 -58.8 -36.5 57.8 9.7 17.1 726 184 D A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.880 110.4 53.9 -70.9 -34.3 60.4 9.0 19.8 727 185 D L H X S+ 0 0 2 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.955 111.5 39.4 -64.4 -57.2 57.9 10.5 22.3 728 186 D R H X S+ 0 0 101 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.892 114.8 56.0 -63.0 -35.0 54.9 8.4 21.6 729 187 D S H X S+ 0 0 44 -4,-1.5 4,-1.4 -5,-0.3 -1,-0.2 0.916 107.4 48.4 -61.7 -42.4 57.1 5.4 21.2 730 188 D A H X S+ 0 0 0 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.786 107.8 57.6 -68.0 -27.5 58.5 6.1 24.7 731 189 D L H >X S+ 0 0 8 -4,-1.6 4,-2.0 2,-0.2 3,-0.6 0.933 101.9 51.3 -69.9 -46.1 54.9 6.4 26.0 732 190 D S H 3< S+ 0 0 80 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.898 110.2 52.7 -57.4 -37.1 53.8 3.0 24.9 733 191 D L H 3< S+ 0 0 78 -4,-1.4 3,-0.4 1,-0.2 -1,-0.3 0.804 110.5 47.0 -67.1 -29.9 56.9 1.7 26.7 734 192 D L H << S+ 0 0 8 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.706 105.2 56.1 -86.2 -20.8 55.8 3.6 29.8 735 193 D G S < S+ 0 0 16 -4,-2.0 -1,-0.2 -3,-0.1 -2,-0.2 0.293 93.6 118.8 -88.5 10.0 52.3 2.3 29.7 736 194 D K 0 0 99 -3,-0.4 -2,-0.1 -5,-0.2 -255,-0.1 0.733 360.0 360.0 -45.1-141.4 54.1 -1.0 29.7 737 195 D A 0 0 114 -4,-0.2 -1,-0.1 -256,-0.0 -4,-0.0 0.171 360.0 360.0-159.5 360.0 53.7 -3.7 32.4