==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 13-DEC-04 1Y8R . COMPND 2 MOLECULE: UBIQUITIN-LIKE 1 ACTIVATING ENZYME E1A; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.M.LOIS,C.D.LIMA . 1819 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 77110.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1248 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 119 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 183 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.1 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 . 124 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 211 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 504 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 47 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 9 5 3 6 6 5 0 2 0 7 4 0 3 1 2 4 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 2 3 4 8 3 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 . 10 5 5 3 7 4 5 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 2 0 1 3 0 0 0 0 0 0 0 0 0 1 1 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 9 A G 0 0 51 0, 0.0 586,-0.1 0, 0.0 585,-0.1 0.000 360.0 360.0 360.0-169.5 49.9 25.6 68.8 2 10 A G + 0 0 45 583,-0.2 2,-0.3 2,-0.1 585,-0.1 0.280 360.0 77.8-108.2 8.9 51.9 28.6 70.0 3 11 A I S S- 0 0 18 1,-0.1 5,-0.1 2,-0.0 21,-0.0 -0.851 97.1 -69.1-119.3 155.1 48.9 30.9 70.5 4 12 A S > - 0 0 47 -2,-0.3 4,-1.5 1,-0.1 -1,-0.1 0.036 37.9-130.0 -37.9 137.8 46.3 31.2 73.2 5 13 A E T 4 S+ 0 0 168 2,-0.2 4,-0.5 1,-0.2 -1,-0.1 0.910 112.4 49.7 -60.4 -39.2 43.8 28.3 73.2 6 14 A E T >> S+ 0 0 72 1,-0.2 3,-2.6 2,-0.2 4,-2.1 0.958 105.9 54.2 -61.8 -53.5 41.0 30.9 73.2 7 15 A E H 3> S+ 0 0 22 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.798 97.9 67.4 -51.8 -29.6 42.6 32.8 70.3 8 16 A A H 3< S+ 0 0 28 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.767 109.1 35.9 -64.2 -25.0 42.5 29.4 68.5 9 17 A A H X4 S+ 0 0 39 -3,-2.6 3,-0.6 -4,-0.5 4,-0.3 0.801 113.7 54.8 -96.0 -38.1 38.7 29.6 68.5 10 18 A Q H 3< S+ 0 0 9 -4,-2.1 3,-0.2 1,-0.2 -2,-0.2 0.898 120.7 32.0 -64.1 -39.1 38.3 33.4 68.0 11 19 A Y T >X S+ 0 0 4 -4,-2.4 4,-2.9 -5,-0.2 3,-0.6 0.299 85.6 117.3-100.1 9.0 40.5 33.4 64.9 12 20 A D H <> S+ 0 0 12 -3,-0.6 4,-2.2 1,-0.2 5,-0.2 0.887 74.7 48.2 -43.5 -56.5 39.5 29.9 63.7 13 21 A R H 34 S+ 0 0 34 -4,-0.3 -1,-0.2 355,-0.3 653,-0.1 0.855 116.7 41.5 -57.4 -38.6 37.9 31.0 60.5 14 22 A Q H X> S+ 0 0 2 -3,-0.6 4,-1.8 1,-0.2 3,-1.5 0.808 110.7 58.2 -80.3 -27.0 40.7 33.2 59.4 15 23 A I H 3X S+ 0 0 3 -4,-2.9 4,-1.3 1,-0.3 -2,-0.2 0.882 98.5 60.0 -66.7 -35.3 43.2 30.6 60.6 16 24 A R H 3< S+ 0 0 30 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.490 112.1 42.8 -70.5 0.9 41.6 28.2 58.2 17 25 A L H <4 S+ 0 0 41 -3,-1.5 -2,-0.2 -5,-0.2 -1,-0.1 0.822 127.6 14.4-108.6 -66.8 42.6 30.6 55.4 18 26 A W H < S- 0 0 8 -4,-1.8 4,-0.5 1,-0.2 -3,-0.2 0.368 107.4-114.1 -95.8 3.2 46.1 32.1 55.7 19 27 A G X - 0 0 19 -4,-1.3 4,-1.8 -5,-0.4 3,-0.2 0.274 24.6 -79.4 83.6 153.5 47.4 29.6 58.3 20 28 A L H > S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.868 123.5 55.6 -57.1 -44.1 48.5 29.6 61.9 21 29 A E H > S+ 0 0 86 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.912 106.2 52.1 -60.6 -40.0 52.0 31.0 61.2 22 30 A A H > S+ 0 0 1 -4,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.941 108.6 50.2 -60.1 -47.7 50.5 34.0 59.4 23 31 A Q H X S+ 0 0 1 -4,-1.8 4,-2.8 1,-0.2 -1,-0.2 0.877 108.1 55.1 -59.5 -36.3 48.3 34.7 62.4 24 32 A K H X S+ 0 0 47 -4,-2.2 4,-0.9 2,-0.2 3,-0.2 0.987 108.1 46.2 -60.4 -56.1 51.3 34.5 64.6 25 33 A R H < S+ 0 0 125 -4,-2.5 3,-0.4 1,-0.3 -1,-0.2 0.844 114.7 49.3 -55.0 -32.9 53.2 37.1 62.6 26 34 A L H >< S+ 0 0 0 -4,-2.2 3,-1.1 1,-0.2 27,-1.0 0.890 105.2 56.4 -73.0 -37.8 50.1 39.2 62.7 27 35 A R H 3< S+ 0 0 87 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.608 107.9 52.9 -67.4 -12.2 49.8 38.7 66.4 28 36 A A T 3< S+ 0 0 61 -4,-0.9 2,-0.4 -3,-0.4 -1,-0.3 -0.256 92.0 94.2-118.4 43.5 53.3 40.1 66.6 29 37 A S < - 0 0 10 -3,-1.1 25,-1.4 2,-0.0 24,-1.2 -0.998 53.8-153.9-140.4 138.2 52.9 43.3 64.7 30 38 A R E -a 54 0A 46 -2,-0.4 89,-3.3 23,-0.2 90,-0.8 -0.929 16.3-159.7-111.1 129.4 52.1 46.9 65.7 31 39 A V E -ab 55 120A 0 23,-2.5 25,-2.5 -2,-0.5 2,-0.5 -0.880 9.6-151.1-114.0 141.9 50.5 49.2 63.2 32 40 A L E -ab 56 121A 0 88,-2.5 90,-3.0 -2,-0.4 2,-0.5 -0.936 17.1-179.1-109.8 121.1 50.3 53.0 63.0 33 41 A L E -ab 57 122A 0 23,-2.4 25,-2.2 -2,-0.5 2,-0.3 -0.968 6.4-164.9-123.4 116.9 47.3 54.5 61.4 34 42 A V E +a 58 0A 3 88,-1.9 25,-0.2 -2,-0.5 92,-0.1 -0.796 58.3 40.9-103.4 146.8 46.8 58.3 61.0 35 43 A G - 0 0 8 23,-2.5 2,-0.8 -2,-0.3 24,-0.1 0.793 61.4-151.0 87.1 100.3 43.6 60.0 60.1 36 44 A L + 0 0 0 4,-0.1 2,-0.1 21,-0.1 -1,-0.1 -0.534 53.4 114.6-103.0 65.0 40.5 58.6 61.9 37 45 A K S > S- 0 0 56 -2,-0.8 4,-3.7 34,-0.0 5,-0.3 -0.314 87.9 -57.9-110.3-161.7 37.8 59.4 59.4 38 46 A G H > S+ 0 0 7 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.947 141.9 38.4 -46.4 -64.3 35.6 57.0 57.4 39 47 A L H > S+ 0 0 3 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.943 117.2 56.5 -53.8 -43.6 38.5 55.3 55.7 40 48 A G H > S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 -2,-0.2 0.944 109.3 41.4 -51.0 -60.1 40.3 55.5 59.0 41 49 A A H X S+ 0 0 0 -4,-3.7 4,-3.0 2,-0.2 5,-0.3 0.924 113.9 53.2 -56.3 -48.8 37.7 53.8 61.1 42 50 A E H X S+ 0 0 6 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.964 112.4 45.2 -52.6 -53.1 37.1 51.1 58.5 43 51 A I H X S+ 0 0 0 -4,-3.1 4,-2.4 -5,-0.3 -2,-0.2 0.942 112.1 51.3 -56.3 -50.2 40.8 50.4 58.4 44 52 A A H X S+ 0 0 0 -4,-3.1 4,-3.2 1,-0.2 5,-0.3 0.935 111.1 48.0 -51.4 -54.5 41.2 50.4 62.2 45 53 A K H X S+ 0 0 0 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.853 108.8 53.5 -57.5 -39.3 38.3 48.0 62.7 46 54 A N H X S+ 0 0 5 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.946 114.2 41.1 -66.0 -42.3 39.6 45.6 60.0 47 55 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 5,-0.5 0.974 111.8 54.3 -68.1 -51.7 43.0 45.4 61.7 48 56 A I H < S+ 0 0 0 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.851 112.5 45.6 -51.3 -35.8 41.7 45.2 65.2 49 57 A L H < S+ 0 0 1 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.942 105.0 60.4 -73.1 -44.3 39.5 42.3 64.2 50 58 A A H < S- 0 0 9 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.826 115.5-116.1 -49.9 -36.2 42.4 40.6 62.3 51 59 A G < + 0 0 3 -4,-1.9 2,-0.2 -5,-0.1 -3,-0.2 0.896 44.0 177.6 98.4 60.2 44.2 40.5 65.6 52 60 A V - 0 0 2 -5,-0.5 -25,-0.2 1,-0.1 47,-0.2 -0.560 44.1-110.9 -89.1 160.9 47.4 42.6 65.4 53 61 A K S S- 0 0 122 -24,-1.2 46,-1.6 -27,-1.0 2,-0.3 0.895 91.9 -26.5 -57.0 -37.6 49.6 43.0 68.5 54 62 A G E -ac 30 99A 0 -25,-1.4 -23,-2.5 44,-0.2 2,-0.4 -0.960 52.3-144.8-174.5 155.5 48.5 46.6 68.6 55 63 A L E -ac 31 100A 0 44,-1.1 46,-2.7 -2,-0.3 2,-0.6 -0.987 7.8-157.5-135.3 127.8 47.1 49.6 66.8 56 64 A T E -ac 32 101A 6 -25,-2.5 -23,-2.4 -2,-0.4 2,-0.8 -0.891 8.4-156.4-105.8 117.2 47.9 53.3 67.3 57 65 A M E -ac 33 102A 0 44,-2.9 46,-1.7 -2,-0.6 2,-0.4 -0.814 13.2-167.7 -97.3 108.5 45.3 55.7 66.0 58 66 A L E +ac 34 103A 3 -25,-2.2 -23,-2.5 -2,-0.8 2,-0.2 -0.797 24.8 135.9 -99.5 134.8 46.8 59.1 65.4 59 67 A D - 0 0 12 44,-1.4 25,-0.4 -2,-0.4 26,-0.2 -0.798 26.5-175.9-172.7 126.1 44.8 62.2 64.8 60 68 A H + 0 0 78 -2,-0.2 46,-0.1 45,-0.1 44,-0.1 0.558 58.1 106.8-104.5 -9.8 45.1 65.7 66.2 61 69 A E S S- 0 0 102 1,-0.1 22,-2.1 44,-0.1 23,-0.4 -0.271 71.7-115.3 -68.0 151.9 42.0 67.0 64.5 62 70 A Q B -Q 82 0B 100 20,-0.2 2,-1.5 21,-0.1 20,-0.2 -0.428 30.9 -97.7 -86.5 162.9 38.8 67.7 66.6 63 71 A V - 0 0 3 18,-3.5 17,-1.8 15,-0.3 18,-0.3 -0.641 48.3-168.8 -83.9 89.5 35.5 65.8 66.2 64 72 A T > - 0 0 63 -2,-1.5 3,-0.5 15,-0.2 17,-0.0 -0.318 30.6 -90.1 -72.9 161.0 33.6 68.2 64.0 65 73 A P T 3 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 15,-0.0 0.009 108.1 55.4 -61.6 179.2 29.9 67.7 63.5 66 74 A E T 3 S+ 0 0 144 -3,-0.1 -2,-0.1 1,-0.1 -3,-0.0 0.556 83.7 100.5 71.7 6.1 28.7 65.6 60.6 67 75 A D X> + 0 0 10 -3,-0.5 4,-3.3 3,-0.1 3,-2.3 0.852 62.5 66.4 -89.7 -41.1 30.8 62.8 62.0 68 76 A P T 34 S+ 0 0 33 0, 0.0 6,-0.2 0, 0.0 -1,-0.1 0.914 103.6 46.5 -47.4 -51.5 28.2 60.6 63.8 69 77 A G T 34 S+ 0 0 19 1,-0.2 -2,-0.1 7,-0.1 3,-0.1 0.207 123.8 35.4 -79.6 18.8 26.5 59.6 60.6 70 78 A A T <4 S+ 0 0 36 -3,-2.3 2,-0.5 1,-0.3 -1,-0.2 0.456 113.6 55.1-139.1 -24.4 29.8 58.8 58.9 71 79 A Q >< - 0 0 0 -4,-3.3 3,-0.5 1,-0.1 -1,-0.3 -0.974 51.8-174.6-121.7 121.5 31.9 57.4 61.8 72 80 A F T 3 S+ 0 0 6 -2,-0.5 -1,-0.1 1,-0.2 324,-0.0 0.455 80.6 68.9 -92.2 -1.9 30.7 54.4 63.8 73 81 A L T 3 S+ 0 0 2 2,-0.1 17,-0.3 17,-0.1 18,-0.3 0.421 90.5 75.6 -95.2 1.9 33.5 54.5 66.2 74 82 A I S < S- 0 0 2 -3,-0.5 2,-0.2 -6,-0.2 13,-0.1 -0.814 83.3-111.7-114.2 154.3 32.4 57.8 67.8 75 83 A R - 0 0 72 -2,-0.3 3,-0.3 11,-0.3 4,-0.1 -0.577 28.8-113.9 -83.5 146.5 29.5 58.6 70.2 76 84 A T S S+ 0 0 67 319,-0.4 2,-0.5 1,-0.3 3,-0.2 0.773 115.5 46.2 -46.7 -29.8 26.4 60.5 69.1 77 85 A G S S+ 0 0 67 1,-0.1 -1,-0.3 -9,-0.1 -2,-0.1 -0.786 77.6 96.8-120.9 88.3 27.6 63.2 71.5 78 86 A S > + 0 0 7 -2,-0.5 3,-2.2 -3,-0.3 2,-0.4 0.189 40.2 145.3-151.5 9.0 31.4 63.8 71.1 79 87 A V T 3 S+ 0 0 76 1,-0.3 -15,-0.2 -3,-0.2 3,-0.1 -0.408 71.0 28.6 -59.0 112.1 31.4 66.8 68.9 80 88 A G T 3 S+ 0 0 48 -17,-1.8 -1,-0.3 1,-0.4 -16,-0.1 0.312 98.5 102.9 117.9 -6.2 34.3 68.9 70.0 81 89 A R S < S- 0 0 121 -3,-2.2 -18,-3.5 -18,-0.3 2,-0.5 -0.352 85.4 -68.4 -99.4-177.1 36.6 66.2 71.2 82 90 A N B > -Q 62 0B 14 -20,-0.2 4,-2.8 1,-0.1 5,-0.3 -0.617 38.9-138.2 -76.3 124.1 39.7 64.6 69.8 83 91 A R T 4 S+ 0 0 5 -22,-2.1 4,-0.5 -2,-0.5 -1,-0.1 0.816 100.8 48.1 -49.6 -37.6 38.7 62.4 66.8 84 92 A A T >> S+ 0 0 0 -25,-0.4 3,-2.3 -23,-0.4 4,-1.3 0.993 113.2 42.4 -69.5 -65.6 41.1 59.6 67.9 85 93 A E G >4 S+ 0 0 101 1,-0.3 3,-1.5 2,-0.2 4,-0.5 0.934 107.5 62.4 -46.3 -54.4 40.2 59.4 71.6 86 94 A A G 3< S+ 0 0 5 -4,-2.8 4,-0.3 1,-0.3 -11,-0.3 0.751 109.1 43.2 -45.7 -25.3 36.5 59.6 70.7 87 95 A S G <> S+ 0 0 0 -3,-2.3 4,-2.5 -4,-0.5 5,-0.3 0.714 92.0 90.3 -94.0 -23.0 37.0 56.4 68.8 88 96 A L H S+ 0 0 123 -4,-0.5 4,-1.9 1,-0.2 5,-0.2 0.875 117.9 40.9 -35.5 -71.1 36.6 52.8 73.5 90 98 A R H > S+ 0 0 38 -17,-0.3 4,-1.3 -4,-0.3 -1,-0.2 0.898 116.0 50.3 -48.8 -50.2 34.5 51.4 70.7 91 99 A A H >< S+ 0 0 0 -4,-2.5 3,-0.8 -18,-0.3 4,-0.4 0.937 109.0 53.8 -56.2 -44.9 37.5 50.5 68.6 92 100 A Q H >< S+ 0 0 49 -4,-3.3 3,-1.3 -5,-0.3 -1,-0.2 0.857 103.2 55.6 -58.5 -38.5 39.0 48.8 71.7 93 101 A N H 3< S+ 0 0 75 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.770 84.9 81.9 -66.7 -27.5 35.9 46.6 72.2 94 102 A L T << S- 0 0 28 -4,-1.3 -1,-0.3 -3,-0.8 -2,-0.2 0.820 119.7 -7.5 -47.6 -31.3 36.2 45.3 68.7 95 103 A N X - 0 0 1 -3,-1.3 3,-1.8 -4,-0.4 -1,-0.3 -0.565 57.5-162.7-171.2 100.7 38.8 42.9 70.1 96 104 A P T 3 S+ 0 0 95 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.881 87.4 72.4 -52.3 -45.4 40.3 43.0 73.6 97 105 A M T 3 S+ 0 0 63 2,-0.1 2,-0.4 -49,-0.0 -90,-0.0 0.708 90.6 72.9 -44.3 -26.2 43.3 40.8 72.6 98 106 A V S < S- 0 0 2 -3,-1.8 2,-1.1 -6,-0.2 -44,-0.2 -0.783 81.8-133.0 -98.5 138.8 44.6 43.8 70.7 99 107 A D E -c 54 0A 75 -46,-1.6 -44,-1.1 -2,-0.4 2,-0.6 -0.726 23.5-165.4 -92.4 97.1 46.1 46.8 72.4 100 108 A V E -c 55 0A 8 -2,-1.1 2,-0.3 -46,-0.2 -44,-0.2 -0.705 8.8-173.1 -85.8 121.0 44.6 49.9 70.8 101 109 A K E -c 56 0A 82 -46,-2.7 -44,-2.9 -2,-0.6 2,-0.4 -0.769 12.3-143.1-113.2 159.2 46.4 53.1 71.6 102 110 A V E -c 57 0A 40 -2,-0.3 2,-0.4 -46,-0.2 -44,-0.2 -0.969 12.3-175.0-128.6 128.1 45.6 56.7 70.9 103 111 A D E -c 58 0A 35 -46,-1.7 -44,-1.4 -2,-0.4 -19,-0.1 -0.897 7.2-170.0-116.5 148.1 47.9 59.6 69.9 104 112 A T + 0 0 59 -2,-0.4 2,-0.4 -46,-0.2 -46,-0.1 -0.143 45.9 109.5-130.2 40.6 46.8 63.2 69.5 105 113 A E S S- 0 0 100 2,-0.0 2,-0.1 3,-0.0 -45,-0.1 -0.937 79.0 -93.0-120.4 143.3 49.8 65.1 68.0 106 114 A D >> - 0 0 27 -2,-0.4 3,-1.2 1,-0.2 4,-0.9 -0.297 33.6-135.2 -52.1 114.9 50.1 66.5 64.4 107 115 A I T 34 S+ 0 0 14 1,-0.3 3,-0.2 2,-0.2 -1,-0.2 0.743 99.9 66.6 -46.3 -27.7 51.8 63.7 62.5 108 116 A E T 34 S+ 0 0 102 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.927 96.3 50.8 -62.9 -47.6 54.2 66.3 61.0 109 117 A K T <4 S+ 0 0 143 -3,-1.2 -1,-0.2 2,-0.1 -2,-0.2 0.771 85.0 116.8 -62.6 -26.4 55.9 67.2 64.2 110 118 A K < - 0 0 21 -4,-0.9 2,-0.2 -3,-0.2 -3,-0.0 -0.157 64.7-128.3 -50.8 132.3 56.6 63.6 64.9 111 119 A P >> - 0 0 71 0, 0.0 3,-2.0 0, 0.0 4,-0.7 -0.600 23.0-109.9 -84.3 143.2 60.4 62.6 65.0 112 120 A E H >> S+ 0 0 93 1,-0.3 3,-0.9 -2,-0.2 4,-0.9 0.788 118.5 64.2 -39.7 -37.0 61.8 59.8 62.9 113 121 A S H >4 S+ 0 0 81 1,-0.2 3,-1.3 2,-0.2 4,-0.4 0.924 92.6 61.2 -57.8 -44.9 62.3 58.0 66.2 114 122 A F H X4 S+ 0 0 20 -3,-2.0 3,-0.7 1,-0.3 -1,-0.2 0.808 102.5 52.0 -52.5 -31.7 58.5 57.9 66.8 115 123 A F H X< S+ 0 0 0 -3,-0.9 3,-1.6 -4,-0.7 -1,-0.3 0.736 91.1 74.3 -80.4 -22.0 58.0 55.8 63.6 116 124 A T T << S+ 0 0 83 -3,-1.3 -1,-0.2 -4,-0.9 -2,-0.2 0.566 82.7 71.1 -68.8 -6.9 60.5 53.1 64.4 117 125 A Q T < S+ 0 0 96 -3,-0.7 2,-0.3 -4,-0.4 -1,-0.3 0.451 92.1 69.3 -88.1 -0.2 58.2 51.6 67.0 118 126 A F < - 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0 0 108 -3,-0.1 2,-0.4 -4,-0.0 -3,-0.1 -0.999 360.0-163.4-136.9 137.2 50.4 22.2 49.4 175 205 A T - 0 0 72 -2,-0.4 -5,-1.3 2,-0.0 2,-0.2 -0.978 13.3-139.7-125.7 126.4 53.9 23.7 48.8 176 206 A M E -S 169 0D 128 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.2 -0.526 18.1-161.0 -80.3 148.0 55.0 27.2 49.8 177 207 A V E -S 168 0D 54 -9,-0.5 -9,-2.0 -2,-0.2 2,-0.6 -0.982 14.7-127.7-131.8 143.2 57.2 29.2 47.4 178 208 A K E +S 167 0D 165 -2,-0.4 2,-0.3 -11,-0.2 -11,-0.2 -0.804 32.7 170.1 -96.6 122.5 59.5 32.1 48.1 179 209 A K E -S 166 0D 99 -13,-2.5 -13,-2.7 -2,-0.6 2,-0.4 -0.885 17.7-150.4-125.8 159.1 59.0 35.2 45.9 180 210 A K E -S 165 0D 135 -2,-0.3 2,-0.4 -15,-0.3 -15,-0.3 -0.990 10.1-173.0-133.1 138.5 60.4 38.7 46.1 181 211 A V E -S 164 0D 37 -17,-4.0 -17,-2.0 -2,-0.4 2,-0.5 -0.976 12.8-142.9-132.8 147.3 59.0 42.0 45.0 182 212 A V E -S 163 0D 81 -2,-0.4 -19,-0.2 -19,-0.2 2,-0.1 -0.933 13.7-169.2-118.2 126.1 60.4 45.5 44.8 183 213 A F - 0 0 12 -21,-1.9 -23,-0.1 -2,-0.5 131,-0.1 -0.447 11.0-139.1 -98.8 172.9 58.4 48.8 45.5 184 214 A C - 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0 0 67 0, 0.0 402,-0.3 0, 0.0 -3,-0.1 0.087 20.4-164.6 -35.5 130.4 20.1 25.9 38.5 477 164 B K - 0 0 47 -5,-0.2 -2,-0.0 400,-0.1 400,-0.0 -0.935 29.3 -94.1-123.4 147.1 22.8 25.2 41.0 478 165 B P - 0 0 56 0, 0.0 -46,-0.2 0, 0.0 3,-0.1 -0.261 18.1-153.3 -60.1 141.3 22.9 22.4 43.6 479 166 B T S S+ 0 0 76 1,-0.2 -46,-0.4 -47,-0.1 -47,-0.4 0.715 83.6 10.1 -84.6 -23.1 21.7 23.2 47.1 480 167 B Q S S- 0 0 139 -48,-0.1 2,-1.0 -49,-0.1 -1,-0.2 -0.942 87.3 -96.2-147.6 166.7 24.0 20.5 48.5 481 168 B R - 0 0 176 -2,-0.3 2,-0.2 -3,-0.1 0, 0.0 -0.750 42.2-162.7 -93.3 99.1 26.8 18.3 47.3 482 169 B T - 0 0 107 -2,-1.0 -2,-0.0 1,-0.0 0, 0.0 -0.555 3.6-163.7 -82.0 144.4 25.3 14.9 46.4 483 170 B F - 0 0 36 -2,-0.2 2,-0.3 17,-0.0 -2,-0.0 -0.971 23.6-109.6-129.6 144.3 27.5 11.8 46.0 484 171 B P > - 0 0 73 0, 0.0 4,-1.2 0, 0.0 3,-0.3 -0.549 19.3-134.5 -74.2 127.5 26.8 8.4 44.4 485 172 B G H > S+ 0 0 31 -2,-0.3 4,-1.4 1,-0.2 37,-0.2 0.588 101.1 68.0 -56.7 -6.7 26.4 5.5 46.8 486 173 B A H >>S+ 0 0 27 2,-0.2 4,-2.6 3,-0.2 5,-1.3 0.981 103.0 34.7 -76.7 -64.9 28.8 3.7 44.4 487 174 B T H 45S+ 0 0 38 -3,-0.3 -2,-0.2 3,-0.2 -1,-0.2 0.608 120.4 55.6 -67.1 -10.0 32.0 5.5 44.8 488 175 B I H <5S+ 0 0 0 -4,-1.2 -1,-0.2 4,-0.1 -2,-0.2 0.885 121.1 22.7 -88.4 -43.2 31.1 5.9 48.5 489 176 B R H <5S+ 0 0 41 -4,-1.4 -2,-0.2 -5,-0.2 -3,-0.2 0.539 141.4 20.1-100.3 -11.4 30.5 2.3 49.4 490 177 B N T <5S+ 0 0 0 -4,-2.6 -3,-0.2 31,-0.1 -4,-0.1 0.709 128.4 21.9-124.5 -45.2 32.6 0.6 46.7 491 178 B T < - 0 0 15 -5,-1.3 2,-0.4 6,-0.0 -2,-0.1 -0.608 60.4-175.6-134.4 78.9 35.2 3.0 45.1 492 179 B P + 0 0 7 0, 0.0 -4,-0.1 0, 0.0 -5,-0.0 -0.577 11.3 165.4 -75.0 124.0 36.3 6.0 47.2 493 180 B S + 0 0 67 -2,-0.4 -5,-0.1 -6,-0.1 3,-0.0 0.762 58.8 49.9-106.9 -36.4 38.7 8.2 45.1 494 181 B E S >> S- 0 0 113 1,-0.1 3,-1.9 154,-0.1 4,-0.7 -0.766 83.6-118.5-106.2 151.5 38.8 11.5 47.0 495 182 B P H >> S+ 0 0 40 0, 0.0 4,-1.8 0, 0.0 3,-1.3 0.863 114.8 65.4 -54.4 -34.2 39.4 12.0 50.8 496 183 B I H 3> S+ 0 0 24 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.810 91.3 63.8 -57.9 -30.1 36.0 13.5 50.9 497 184 B H H <> S+ 0 0 15 -3,-1.9 4,-1.5 1,-0.2 -1,-0.3 0.811 105.1 44.9 -64.4 -31.8 34.5 10.1 50.0 498 185 B C H X>S+ 0 0 0 -4,-1.6 4,-2.5 1,-0.2 5,-0.9 0.890 111.7 45.9 -72.7 -42.6 27.8 7.8 62.2 507 194 B N H 3<5S+ 0 0 33 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.553 111.6 54.4 -77.5 -8.1 24.2 8.1 61.2 508 195 B Q T 3<5S+ 0 0 0 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.523 118.1 32.5 -99.7 -10.2 24.0 4.3 61.0 509 196 B L T <45S+ 0 0 7 -3,-0.7 -2,-0.2 -4,-0.4 -3,-0.2 0.760 138.7 9.1-113.3 -40.6 25.3 3.7 64.5 510 197 B F T <5S+ 0 0 6 -4,-2.5 112,-1.5 -5,-0.1 -3,-0.2 0.490 122.0 49.5-120.5 -8.8 24.1 6.6 66.6 511 198 B G S 0 0 13 0, 0.0 4,-1.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 60.1 24.6 -1.5 59.1 534 241 B K H > + 0 0 52 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.684 360.0 69.4 -61.2 -18.0 22.9 -1.1 62.5 535 242 B E H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.999 102.2 37.7 -62.8 -68.1 22.1 -4.8 62.2 536 243 B W H > S+ 0 0 74 1,-0.2 4,-0.6 2,-0.2 6,-0.2 0.769 115.5 61.3 -53.7 -29.5 25.7 -6.1 62.7 537 244 B A H ><>S+ 0 0 0 -4,-1.4 5,-2.5 2,-0.2 3,-0.9 0.985 110.5 31.8 -63.8 -63.9 26.1 -3.3 65.3 538 245 B K H ><5S+ 0 0 144 -4,-2.1 3,-1.4 1,-0.2 -2,-0.2 0.778 112.7 64.2 -68.5 -27.3 23.5 -4.1 67.9 539 246 B S H 3<5S+ 0 0 93 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.697 108.3 42.5 -69.4 -19.0 23.9 -7.9 67.2 540 247 B T T <<5S- 0 0 33 -3,-0.9 -1,-0.3 -4,-0.6 3,-0.2 0.122 118.4-110.0-111.6 15.1 27.5 -7.6 68.5 541 248 B G T < 5 - 0 0 43 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.732 63.7 -72.4 62.8 24.2 26.6 -5.3 71.5 542 249 B Y S - 0 0 67 -6,-0.3 4,-3.3 -3,-0.2 5,-0.2 -0.907 28.7-149.2-107.0 112.8 31.9 -3.5 70.3 544 251 B P H > S+ 0 0 2 0, 0.0 4,-4.0 0, 0.0 5,-0.2 0.876 99.8 46.9 -42.9 -50.5 34.5 -1.3 68.6 545 252 B V H > S+ 0 0 51 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.958 112.1 48.5 -60.4 -52.6 36.8 -4.2 68.1 546 253 B K H > S+ 0 0 118 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.939 118.2 43.6 -51.9 -47.3 34.1 -6.4 66.7 547 254 B L H >X S+ 0 0 6 -4,-3.3 4,-2.4 1,-0.2 3,-1.9 0.939 105.3 59.8 -63.5 -52.8 33.1 -3.5 64.5 548 255 B F H 3X S+ 0 0 0 -4,-4.0 4,-2.6 1,-0.3 -1,-0.2 0.876 106.4 48.9 -43.6 -47.6 36.6 -2.5 63.4 549 256 B T H 3<>S+ 0 0 25 -4,-2.0 5,-3.5 1,-0.2 -1,-0.3 0.683 112.9 47.4 -70.8 -18.2 37.2 -5.9 61.9 550 257 B K H <<>S+ 0 0 21 -3,-1.9 5,-1.4 -4,-0.6 -2,-0.2 0.748 119.6 37.1 -93.5 -25.9 33.9 -5.8 60.0 551 258 B L H <5S+ 0 0 1 -4,-2.4 -2,-0.2 3,-0.1 -3,-0.2 0.747 130.7 27.8 -95.1 -29.2 34.3 -2.3 58.6 552 259 B F T <5S+ 0 0 0 -4,-2.6 23,-4.1 -5,-0.4 -3,-0.1 0.067 137.4 16.2-121.5 24.6 38.1 -2.4 57.9 553 260 B K T >5S+ 0 0 45 21,-0.3 4,-2.3 -4,-0.2 -3,-0.2 0.253 122.8 40.8-153.0 -68.1 38.6 -6.1 57.3 554 261 B D H > S+ 0 0 2 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.888 111.0 52.4 -64.1 -38.0 37.0 -4.9 52.5 557 264 B R H X S+ 0 0 146 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.938 111.7 44.0 -63.2 -46.8 37.7 -8.6 52.1 558 265 B Y H < S+ 0 0 79 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.759 109.1 61.6 -68.0 -22.7 34.2 -9.2 50.6 559 266 B L H >< S+ 0 0 5 -4,-1.4 3,-1.3 1,-0.2 -2,-0.2 0.898 100.5 50.5 -69.5 -41.3 34.9 -6.0 48.6 560 267 B L H 3< S+ 0 0 64 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.750 92.8 76.6 -68.0 -22.7 37.8 -7.7 46.9 561 268 B T T 3< S+ 0 0 60 -4,-0.9 2,-1.4 1,-0.3 -1,-0.3 0.774 82.0 72.4 -57.6 -26.0 35.5 -10.6 46.1 562 269 B M X> + 0 0 1 -3,-1.3 3,-0.8 -4,-0.4 4,-0.8 -0.543 60.9 169.0 -91.2 68.0 34.2 -8.3 43.4 563 270 B D T 34 + 0 0 89 -2,-1.4 -1,-0.2 1,-0.2 -2,-0.1 0.580 68.4 72.6 -56.6 -9.8 37.2 -8.5 41.1 564 271 B K T 34 S+ 0 0 68 1,-0.2 -1,-0.2 -3,-0.1 -36,-0.1 0.970 99.4 40.7 -69.8 -55.3 35.0 -6.8 38.5 565 272 B L T <4 S+ 0 0 1 -3,-0.8 2,-0.6 1,-0.2 -1,-0.2 0.605 113.5 63.5 -67.8 -12.8 35.1 -3.4 40.2 566 273 B W < + 0 0 25 -4,-0.8 -1,-0.2 1,-0.1 4,-0.1 -0.799 66.1 115.2-115.9 86.6 38.8 -4.1 40.9 567 274 B R S S- 0 0 200 -2,-0.6 -1,-0.1 -3,-0.1 -2,-0.1 0.737 93.7 -10.3-115.3 -63.1 40.4 -4.4 37.5 568 275 B K S S+ 0 0 198 -3,-0.1 2,-0.3 2,-0.1 -2,-0.1 0.593 110.4 96.5-114.5 -22.0 43.0 -1.6 37.0 569 276 B R S S- 0 0 97 -4,-0.2 0, 0.0 1,-0.1 0, 0.0 -0.539 92.1 -90.9 -76.8 134.6 42.1 0.6 40.0 570 277 B K - 0 0 136 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 -0.142 45.6-126.4 -45.0 125.4 44.3 0.1 43.1 571 278 B P - 0 0 61 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.490 25.4-105.5 -78.5 147.1 42.7 -2.6 45.3 572 279 B P - 0 0 7 0, 0.0 74,-0.2 0, 0.0 73,-0.1 -0.135 23.5-127.9 -66.7 167.4 42.0 -1.9 49.0 573 280 B V - 0 0 79 72,-1.9 74,-0.1 71,-0.0 -16,-0.1 -0.884 21.3-135.5-123.6 99.3 44.1 -3.3 51.9 574 281 B P - 0 0 42 0, 0.0 -21,-0.3 0, 0.0 2,-0.2 -0.097 22.0-143.2 -49.8 145.6 42.1 -5.1 54.6 575 282 B L - 0 0 23 -23,-4.1 2,-0.3 -27,-0.2 3,-0.1 -0.543 7.9-151.4-108.3 176.1 43.1 -4.2 58.2 576 283 B D > - 0 0 28 -2,-0.2 4,-2.8 1,-0.1 5,-0.3 -0.896 17.3-140.3-153.4 119.2 43.3 -6.2 61.4 577 284 B W H > S+ 0 0 61 -2,-0.3 4,-1.1 1,-0.2 -1,-0.1 0.790 105.6 50.6 -46.9 -34.7 42.9 -4.9 65.0 578 285 B A H 4 S+ 0 0 60 2,-0.2 3,-0.4 1,-0.1 -1,-0.2 0.975 112.6 41.8 -69.6 -58.5 45.7 -7.1 66.1 579 286 B E H 4 S+ 0 0 132 1,-0.2 -2,-0.2 3,-0.1 -1,-0.1 0.929 110.8 57.7 -54.8 -49.7 48.3 -6.2 63.5 580 287 B V H >< S+ 0 0 6 -4,-2.8 2,-2.0 1,-0.3 3,-0.7 0.854 95.8 66.9 -50.5 -40.4 47.4 -2.5 63.8 581 288 B Q T 3< S+ 0 0 54 -4,-1.1 -1,-0.3 -3,-0.4 -4,-0.0 -0.478 83.8 78.6 -83.1 68.6 48.2 -2.6 67.5 582 289 B S T 3 0 0 87 -2,-2.0 -1,-0.2 -3,-0.0 -2,-0.1 0.258 360.0 360.0-156.4 11.3 52.0 -3.2 66.9 583 290 B Q < 0 0 163 -3,-0.7 -2,-0.1 11,-0.0 -3,-0.1 0.648 360.0 360.0-107.1 360.0 53.5 0.1 66.0 584 ! 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 0.0 585 305 B L 0 0 164 0, 0.0 -583,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 101.1 54.4 22.9 65.2 586 306 B G - 0 0 16 1,-0.3 2,-0.2 -585,-0.1 3,-0.0 0.522 360.0 -34.7 -79.2-129.7 51.0 24.0 63.9 587 307 B L >> - 0 0 19 -586,-0.1 3,-2.7 1,-0.1 4,-1.0 -0.631 55.8-110.0 -96.6 155.3 47.8 23.3 65.9 588 308 B K G >4 S+ 0 0 161 1,-0.3 3,-0.7 -2,-0.2 65,-0.1 0.905 123.4 42.6 -44.3 -49.6 47.1 20.3 68.0 589 309 B D G 34 S+ 0 0 32 1,-0.2 65,-3.1 63,-0.1 66,-0.4 0.347 102.1 71.2 -82.7 4.9 44.5 19.2 65.4 590 310 B Q G <4 S+ 0 0 62 -3,-2.7 2,-0.3 63,-0.2 62,-0.2 0.738 80.6 82.0 -92.6 -24.5 46.8 20.1 62.5 591 311 B Q S << S- 0 0 102 -4,-1.0 62,-0.4 -3,-0.7 2,-0.2 -0.631 78.3-130.2 -83.8 135.9 49.3 17.2 63.0 592 312 B V - 0 0 69 -2,-0.3 2,-0.2 60,-0.1 60,-0.1 -0.528 19.1-143.0 -84.3 152.7 48.3 13.8 61.6 593 313 B L - 0 0 89 58,-0.2 2,-0.2 -2,-0.2 57,-0.1 -0.574 21.9 -93.8-108.9 174.3 48.5 10.6 63.7 594 314 B D > - 0 0 78 -2,-0.2 4,-1.7 1,-0.1 3,-0.3 -0.540 39.6-102.7 -87.4 155.3 49.4 7.0 63.0 595 315 B V H >> S+ 0 0 18 1,-0.2 4,-2.8 2,-0.2 3,-0.7 0.881 121.8 48.5 -37.8 -60.0 47.0 4.3 62.0 596 316 B K H 3> S+ 0 0 34 1,-0.3 4,-2.7 -16,-0.2 5,-0.3 0.918 106.8 56.5 -51.4 -49.1 47.0 2.7 65.4 597 317 B S H 3> S+ 0 0 29 -3,-0.3 4,-1.2 1,-0.2 -1,-0.3 0.840 113.2 41.5 -53.1 -36.2 46.5 6.0 67.1 598 318 B Y H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 3,-1.1 0.965 106.1 47.9 -63.9 -52.6 29.4 8.4 72.0 610 330 B R H 3X S+ 0 0 74 -4,-2.4 4,-0.6 1,-0.3 -1,-0.2 0.761 106.6 59.2 -62.1 -23.1 27.0 5.7 73.2 611 331 B V H 3< S+ 0 0 83 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.800 109.6 42.7 -73.6 -29.7 27.5 6.9 76.8 612 332 B H H XX S+ 0 0 78 -3,-1.1 3,-2.2 -4,-1.0 4,-1.1 0.886 110.3 54.7 -80.8 -42.3 26.2 10.3 75.8 613 333 B L H 3< S+ 0 0 41 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.671 99.5 65.2 -63.9 -15.6 23.4 8.9 73.7 614 334 B A T 3< S+ 0 0 79 -4,-0.6 -1,-0.3 -5,-0.3 -2,-0.2 0.590 100.1 50.5 -83.1 -10.2 22.4 7.0 76.8 615 335 B E T <4 S+ 0 0 142 -3,-2.2 2,-1.8 1,-0.1 -2,-0.2 0.761 85.2 92.3 -94.8 -31.5 21.6 10.2 78.6 616 336 B K S X S- 0 0 101 -4,-1.1 4,-0.8 4,-0.1 3,-0.2 -0.449 101.4 -90.6 -70.3 85.7 19.4 11.6 75.9 617 337 B G T 4 - 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