==== 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 TRANSFERASE 22-SEP-08 3ELE . COMPND 2 MOLECULE: AMINO TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: EUBACTERIUM RECTALE; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 1591 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 58233.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1116 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 99 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 96 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 114 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 154 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 565 35.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 1.7 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 4 4 5 7 3 1 0 5 3 4 4 4 2 10 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 1 11 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 PARALLEL BRIDGES PER LADDER . 4 8 0 8 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 ANTIPARALLEL BRIDGES PER LADDER . 4 0 4 0 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 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 0 A G 0 0 133 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 21.2 60.5 46.7 -4.8 2 1 A X - 0 0 64 1,-0.1 4,-0.1 2,-0.1 0, 0.0 -0.776 360.0-164.0 -95.0 125.5 62.7 49.5 -6.5 3 2 A V S S+ 0 0 14 -2,-0.5 -1,-0.1 2,-0.1 517,-0.1 0.835 72.1 64.0 -74.8 -35.1 66.4 48.6 -7.1 4 3 A V S S- 0 0 1 1,-0.1 2,-0.4 515,-0.1 514,-0.2 -0.328 104.4 -80.2 -85.7 168.7 67.4 52.3 -7.6 5 4 A N > - 0 0 35 512,-2.9 4,-2.5 511,-0.1 3,-0.3 -0.595 38.8-142.5 -67.7 122.7 67.3 55.2 -5.2 6 5 A E H > S+ 0 0 134 -2,-0.4 4,-2.8 1,-0.2 5,-0.2 0.840 97.6 52.5 -59.7 -39.4 63.7 56.5 -5.2 7 6 A S H > S+ 0 0 81 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.869 111.7 46.9 -63.7 -38.5 64.6 60.2 -5.0 8 7 A X H > S+ 0 0 12 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.937 111.7 50.7 -69.1 -46.1 66.9 59.9 -8.0 9 8 A Y H X S+ 0 0 65 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.927 114.2 45.1 -53.4 -49.2 64.2 58.0 -9.9 10 9 A Q H X S+ 0 0 111 -4,-2.8 4,-2.2 1,-0.2 3,-0.4 0.923 111.4 51.5 -62.8 -43.7 61.7 60.8 -9.0 11 10 A L H < S+ 0 0 31 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.829 116.3 41.4 -64.1 -31.7 64.1 63.6 -9.9 12 11 A G H < S+ 0 0 26 -4,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.608 119.1 43.6 -90.0 -15.2 64.8 61.9 -13.3 13 12 A S H < S+ 0 0 41 -4,-1.3 -2,-0.2 -3,-0.4 -3,-0.2 0.636 83.2 110.6-101.8 -22.4 61.2 60.9 -14.1 14 13 A V < - 0 0 78 -4,-2.2 2,-0.4 -5,-0.2 -4,-0.0 -0.333 68.2-130.1 -58.7 129.7 59.4 64.2 -13.0 15 14 A R - 0 0 186 -2,-0.0 2,-0.6 1,-0.0 -1,-0.1 -0.729 15.4-126.1 -88.2 131.5 58.0 66.0 -16.1 16 15 A S > - 0 0 63 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 -0.718 8.9-154.0 -81.7 118.4 58.9 69.7 -16.4 17 16 A A H > S+ 0 0 85 -2,-0.6 4,-1.5 1,-0.2 -1,-0.2 0.858 97.6 48.9 -54.7 -40.1 55.7 71.8 -16.9 18 17 A I H > S+ 0 0 40 2,-0.2 4,-2.4 1,-0.2 24,-0.2 0.892 111.9 46.7 -67.3 -46.6 57.9 74.5 -18.7 19 18 A R H > S+ 0 0 45 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.868 112.2 51.2 -63.8 -39.7 59.6 72.0 -21.0 20 19 A E H X S+ 0 0 77 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.852 109.4 50.8 -65.1 -37.1 56.2 70.4 -21.8 21 20 A L H X S+ 0 0 20 -4,-1.5 4,-1.9 -5,-0.2 -2,-0.2 0.923 110.3 49.8 -65.4 -44.4 54.9 73.9 -22.6 22 21 A F H X S+ 0 0 59 -4,-2.4 4,-1.1 2,-0.2 -2,-0.2 0.916 114.1 43.7 -58.3 -48.6 57.9 74.5 -24.9 23 22 A E H X S+ 0 0 86 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.845 108.7 58.8 -66.5 -37.4 57.3 71.1 -26.7 24 23 A Y H X S+ 0 0 68 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.889 103.0 54.2 -55.4 -41.6 53.5 71.9 -26.8 25 24 A G H X S+ 0 0 3 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.841 105.4 51.7 -62.2 -37.4 54.4 75.1 -28.8 26 25 A K H X S+ 0 0 112 -4,-1.1 4,-1.5 2,-0.2 -1,-0.2 0.883 110.6 48.6 -65.4 -40.2 56.3 73.1 -31.4 27 26 A K H X S+ 0 0 129 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.870 113.1 48.0 -65.1 -40.1 53.3 70.8 -31.8 28 27 A R H X S+ 0 0 60 -4,-2.2 4,-3.1 2,-0.2 5,-0.4 0.833 104.8 59.5 -67.8 -35.8 51.1 73.9 -32.1 29 28 A A H X S+ 0 0 28 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.879 101.9 54.8 -58.7 -41.0 53.6 75.4 -34.7 30 29 A A H < S+ 0 0 91 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.813 116.7 37.0 -60.6 -31.5 52.9 72.3 -36.9 31 30 A I H < S+ 0 0 122 -4,-0.8 -2,-0.2 -3,-0.4 -1,-0.2 0.900 135.9 15.0 -89.7 -47.1 49.1 73.1 -36.8 32 31 A V H < S- 0 0 43 -4,-3.1 -3,-0.2 1,-0.1 4,-0.2 0.379 110.6 -99.6-112.7 -0.2 48.9 76.9 -36.9 33 32 A G >< - 0 0 30 -4,-2.1 3,-1.3 -5,-0.4 -3,-0.1 0.306 28.4 -97.7 88.8 140.5 52.5 78.0 -38.0 34 33 A K G > S+ 0 0 183 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.832 122.2 63.9 -61.1 -32.4 55.3 79.3 -35.8 35 34 A E G 3 S+ 0 0 128 1,-0.3 -1,-0.3 -6,-0.1 -2,-0.1 0.766 104.8 48.1 -58.9 -27.9 54.4 82.9 -36.7 36 35 A N G < S+ 0 0 76 -3,-1.3 2,-0.4 -4,-0.2 -1,-0.3 0.154 95.3 84.2-101.1 14.1 51.0 82.2 -34.9 37 36 A V < - 0 0 11 -3,-1.6 2,-0.8 2,-0.1 320,-0.2 -0.989 62.3-158.7-119.4 125.2 52.5 80.7 -31.7 38 37 A Y E -a 357 0A 26 318,-3.2 320,-2.9 -2,-0.4 2,-0.9 -0.749 14.5-175.5-111.4 82.6 53.7 83.1 -28.9 39 38 A D E +a 358 0A 40 -2,-0.8 320,-0.1 318,-0.2 318,-0.1 -0.729 23.7 152.9 -88.6 104.6 56.1 81.1 -26.9 40 39 A F + 0 0 0 318,-2.1 334,-2.7 -2,-0.9 320,-0.3 -0.025 48.0 99.9-112.7 26.6 57.4 83.0 -23.8 41 40 A S + 0 0 1 332,-0.2 319,-0.1 318,-0.1 -22,-0.1 0.991 61.6 52.7 -81.7 -80.9 58.1 79.8 -21.8 42 41 A I S S- 0 0 41 -24,-0.2 2,-1.0 1,-0.1 334,-0.1 -0.367 70.4-136.3 -69.0 137.3 61.8 78.5 -21.6 43 42 A G + 0 0 14 -2,-0.1 -1,-0.1 332,-0.1 291,-0.1 -0.404 44.5 151.9 -90.8 57.7 64.5 81.0 -20.5 44 43 A N - 0 0 66 -2,-1.0 426,-0.0 332,-0.2 204,-0.0 -0.711 54.7-100.8 -92.5 133.4 67.3 80.2 -23.0 45 44 A P - 0 0 11 0, 0.0 -1,-0.1 0, 0.0 203,-0.0 -0.281 38.0-177.6 -46.6 127.5 69.9 82.8 -24.1 46 45 A S + 0 0 43 331,-0.1 420,-0.1 2,-0.1 -2,-0.0 0.473 53.2 82.2-111.3 -9.7 68.7 84.1 -27.6 47 46 A I S S- 0 0 11 419,-0.1 257,-0.1 418,-0.1 2,-0.1 -0.777 83.9-110.1 -96.6 143.2 71.6 86.6 -28.6 48 47 A P - 0 0 72 0, 0.0 257,-0.4 0, 0.0 203,-0.1 -0.374 37.9 -95.1 -71.2 154.4 74.8 85.2 -30.1 49 48 A A - 0 0 10 202,-0.3 202,-0.1 1,-0.1 201,-0.1 -0.246 52.1 -90.5 -58.1 151.7 78.1 85.2 -28.2 50 49 A P >> - 0 0 23 0, 0.0 3,-2.0 0, 0.0 4,-0.5 -0.399 41.0-109.0 -63.6 150.8 80.3 88.2 -28.9 51 50 A Q H 3> S+ 0 0 111 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.742 112.8 74.0 -57.2 -26.0 82.7 87.5 -31.8 52 51 A I H 3> S+ 0 0 63 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.798 91.7 58.9 -56.1 -31.0 85.8 87.3 -29.4 53 52 A V H <> S+ 0 0 0 -3,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.987 112.3 34.6 -61.3 -64.1 84.5 83.9 -28.2 54 53 A N H X S+ 0 0 9 -4,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.867 118.9 53.1 -61.7 -41.2 84.6 82.1 -31.6 55 54 A D H X S+ 0 0 60 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.915 112.3 44.9 -57.9 -46.2 87.7 84.0 -32.7 56 55 A T H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.903 110.8 52.6 -67.3 -44.2 89.5 83.0 -29.5 57 56 A I H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.920 110.0 50.1 -55.6 -46.6 88.4 79.3 -29.7 58 57 A K H X S+ 0 0 59 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.900 110.5 50.3 -57.0 -43.7 89.7 79.3 -33.3 59 58 A E H X S+ 0 0 98 -4,-1.8 4,-2.9 2,-0.2 5,-0.5 0.869 110.7 47.1 -64.0 -42.0 93.1 80.7 -32.1 60 59 A L H X S+ 0 0 18 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.942 112.6 49.1 -66.9 -48.0 93.6 78.2 -29.3 61 60 A V H < S+ 0 0 7 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.833 119.9 39.6 -58.4 -33.6 92.8 75.2 -31.5 62 61 A T H < S+ 0 0 82 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.867 132.7 15.5 -86.2 -39.4 95.2 76.6 -34.2 63 62 A D H < S+ 0 0 131 -4,-2.9 2,-0.3 -5,-0.1 -3,-0.2 0.621 96.9 91.3-116.2 -20.2 98.2 77.9 -32.0 64 63 A Y S < S- 0 0 98 -4,-1.9 5,-0.0 -5,-0.5 2,-0.0 -0.664 91.6 -95.2 -83.3 134.6 98.0 76.5 -28.5 65 64 A D > - 0 0 105 -2,-0.3 4,-3.4 1,-0.1 5,-0.2 -0.316 35.3-137.0 -45.8 119.6 100.0 73.2 -27.9 66 65 A S H > S+ 0 0 19 2,-0.2 4,-2.4 1,-0.2 -1,-0.1 0.839 100.3 49.7 -55.4 -42.8 97.2 70.5 -28.3 67 66 A V H > S+ 0 0 45 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.935 117.8 41.1 -61.4 -46.7 98.3 68.4 -25.3 68 67 A A H 4 S+ 0 0 43 2,-0.2 3,-0.4 1,-0.2 -2,-0.2 0.891 114.4 52.5 -67.3 -45.0 98.4 71.5 -23.1 69 68 A L H < S+ 0 0 0 -4,-3.4 -2,-0.2 1,-0.2 -3,-0.2 0.947 119.6 33.4 -55.4 -51.1 95.2 72.9 -24.5 70 69 A H H < S+ 0 0 0 -4,-2.4 583,-2.7 -5,-0.2 584,-0.6 0.453 98.9 106.6 -90.2 -0.8 93.1 69.8 -24.0 71 70 A G S < S- 0 0 15 -4,-0.8 219,-0.1 -3,-0.4 2,-0.1 -0.179 81.1 -80.9 -77.9 167.0 94.8 68.5 -20.7 72 71 A Y - 0 0 72 217,-0.1 2,-0.2 581,-0.1 -1,-0.2 -0.407 40.5-152.8 -61.8 138.6 93.5 68.5 -17.2 73 72 A T - 0 0 14 1,-0.3 217,-0.0 215,-0.2 5,-0.0 -0.469 42.6 -74.1 -92.4 178.3 93.9 71.9 -15.4 74 73 A S > - 0 0 51 -2,-0.2 3,-1.0 1,-0.1 -1,-0.3 -0.278 53.7 -98.4 -63.1 165.2 94.2 71.8 -11.6 75 74 A A T 3 S+ 0 0 47 1,-0.2 213,-0.3 212,-0.1 3,-0.1 0.895 126.5 44.3 -52.6 -45.5 91.0 71.0 -9.7 76 75 A Q T 3 S- 0 0 54 1,-0.2 28,-3.1 27,-0.1 -1,-0.2 0.543 122.5-103.5 -79.0 -12.2 90.4 74.7 -9.0 77 76 A G < - 0 0 0 -3,-1.0 -1,-0.2 26,-0.2 -2,-0.1 -0.191 53.4 -38.1 108.9 163.5 91.3 75.8 -12.6 78 77 A D > - 0 0 24 1,-0.1 4,-2.4 -2,-0.1 3,-0.3 -0.279 47.9-133.6 -53.9 137.7 94.2 77.4 -14.4 79 78 A V H > S+ 0 0 71 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.851 107.9 57.3 -63.2 -32.2 95.9 80.1 -12.3 80 79 A E H > S+ 0 0 123 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.839 108.4 45.5 -67.0 -36.6 95.9 82.3 -15.5 81 80 A T H > S+ 0 0 0 -3,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.943 116.8 43.7 -69.4 -51.4 92.1 82.0 -15.8 82 81 A R H X S+ 0 0 9 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.900 113.6 51.9 -60.9 -43.8 91.5 82.7 -12.0 83 82 A A H X S+ 0 0 23 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.910 107.9 52.0 -57.5 -47.1 94.1 85.6 -12.1 84 83 A A H X S+ 0 0 16 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.821 112.8 44.8 -59.6 -38.3 92.3 87.2 -15.1 85 84 A I H X S+ 0 0 1 -4,-1.6 4,-2.6 2,-0.2 5,-0.2 0.914 112.2 51.2 -73.3 -46.5 88.9 87.0 -13.3 86 85 A A H X S+ 0 0 1 -4,-2.7 4,-2.3 1,-0.2 11,-0.3 0.937 114.1 45.1 -54.9 -47.0 90.3 88.3 -10.0 87 86 A E H X S+ 0 0 122 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.831 113.1 49.4 -66.3 -39.9 91.9 91.3 -11.8 88 87 A F H X S+ 0 0 52 -4,-1.5 4,-1.4 -5,-0.2 -1,-0.2 0.890 112.8 47.8 -63.5 -45.9 88.8 92.0 -13.9 89 88 A L H X S+ 0 0 3 -4,-2.6 4,-2.8 2,-0.2 6,-0.6 0.885 112.2 49.4 -63.8 -41.8 86.6 92.0 -10.7 90 89 A N H X S+ 0 0 37 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.917 112.3 47.6 -63.6 -44.8 89.1 94.3 -8.8 91 90 A N H < S+ 0 0 147 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.779 120.2 38.8 -66.5 -28.1 89.1 96.8 -11.8 92 91 A T H < S+ 0 0 78 -4,-1.4 -2,-0.2 -5,-0.1 -1,-0.2 0.832 132.3 20.6 -90.0 -39.4 85.3 96.8 -12.0 93 92 A H H < S- 0 0 32 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.533 96.6-116.2-111.6 -10.4 84.3 96.7 -8.3 94 93 A G < + 0 0 62 -4,-2.0 -4,-0.2 -5,-0.4 -3,-0.1 0.683 66.3 143.1 75.7 20.8 87.3 97.9 -6.3 95 94 A T - 0 0 17 -6,-0.6 -1,-0.2 -9,-0.1 -2,-0.0 -0.140 51.8-133.8 -79.0 178.0 87.7 94.6 -4.6 96 95 A H + 0 0 119 2,-0.0 -9,-0.1 -2,-0.0 -10,-0.1 -0.213 45.3 150.2-134.3 43.2 91.1 93.0 -3.8 97 96 A F - 0 0 13 -11,-0.3 2,-0.3 -12,-0.1 -7,-0.1 -0.312 25.9-161.1 -75.2 157.4 90.8 89.3 -4.9 98 97 A N > - 0 0 74 -2,-0.0 3,-2.0 -12,-0.0 4,-0.2 -0.780 42.4 -86.8-125.4 175.5 93.7 87.2 -6.2 99 98 A A G > S+ 0 0 15 1,-0.3 3,-2.0 -2,-0.3 -14,-0.0 0.872 123.5 62.5 -50.9 -40.3 93.7 84.0 -8.3 100 99 A D G 3 S+ 0 0 80 1,-0.3 -1,-0.3 3,-0.0 -17,-0.0 0.457 88.7 68.2 -71.3 -3.7 93.3 81.8 -5.1 101 100 A N G < S+ 0 0 2 -3,-2.0 161,-3.5 -19,-0.1 2,-0.3 0.518 94.1 77.2 -85.0 -8.4 89.9 83.4 -4.3 102 101 A L E < -B 261 0B 0 -3,-2.0 2,-0.4 -4,-0.2 159,-0.2 -0.759 53.8-172.2-109.0 147.9 88.4 81.6 -7.4 103 102 A Y E -B 260 0B 5 157,-1.6 157,-1.9 -2,-0.3 2,-0.3 -0.956 26.7-133.8-133.8 115.6 87.4 78.0 -8.1 104 103 A X E -B 259 0B 3 -28,-3.1 184,-0.3 -2,-0.4 155,-0.3 -0.559 31.5-177.2 -77.6 131.4 86.5 77.3 -11.8 105 104 A T E -B 258 0B 4 153,-2.4 153,-2.5 -2,-0.3 2,-0.9 -0.702 39.9-104.5-124.8 172.2 83.2 75.3 -12.2 106 105 A X S S- 0 0 3 151,-0.2 151,-0.3 1,-0.2 4,-0.3 -0.485 87.3 -53.8 -96.7 58.6 81.1 73.8 -14.9 107 106 A G S > S- 0 0 0 -2,-0.9 4,-1.8 149,-0.2 3,-0.4 -0.172 74.6 -62.8 93.2 171.6 78.4 76.5 -14.8 108 107 A A H > S+ 0 0 13 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.785 128.5 60.0 -62.5 -35.3 76.2 78.1 -12.1 109 108 A A H > S+ 0 0 12 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.852 108.9 45.5 -61.6 -36.9 74.4 74.8 -11.3 110 109 A A H > S+ 0 0 0 -3,-0.4 4,-2.5 -4,-0.3 -2,-0.2 0.893 112.1 51.4 -71.0 -40.4 77.8 73.3 -10.4 111 110 A S H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.933 113.3 44.1 -62.3 -47.9 78.7 76.5 -8.4 112 111 A L H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 5,-0.3 0.936 112.6 52.0 -62.3 -46.7 75.4 76.4 -6.4 113 112 A S H X S+ 0 0 7 -4,-1.9 4,-2.9 1,-0.2 5,-0.2 0.921 109.5 50.0 -56.0 -48.7 75.7 72.6 -5.8 114 113 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.879 110.5 50.9 -55.7 -45.2 79.3 73.0 -4.5 115 114 A C H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.922 114.5 40.6 -62.6 -47.4 78.2 75.8 -2.1 116 115 A F H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.912 117.2 49.9 -69.3 -40.1 75.3 73.8 -0.5 117 116 A R H < S+ 0 0 34 -4,-2.9 -2,-0.2 -5,-0.3 -1,-0.2 0.909 114.1 45.0 -62.2 -44.4 77.4 70.6 -0.5 118 117 A A H < S+ 0 0 0 -4,-2.7 286,-2.6 -5,-0.2 -2,-0.2 0.858 119.2 42.1 -67.2 -37.7 80.3 72.5 1.2 119 118 A L H < S+ 0 0 0 -4,-2.1 2,-0.6 284,-0.2 -2,-0.2 0.682 90.8 94.9 -87.4 -17.6 78.0 74.2 3.7 120 119 A T < + 0 0 7 -4,-2.1 3,-0.1 1,-0.1 283,-0.1 -0.644 31.7 153.0 -83.9 114.6 75.6 71.3 4.7 121 120 A S + 0 0 51 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.349 63.7 32.8-116.5 4.6 76.7 69.5 7.9 122 121 A D S > S- 0 0 75 50,-0.1 3,-1.7 1,-0.1 -1,-0.2 -0.985 74.1-118.2-163.9 146.6 73.3 68.2 9.1 123 122 A A T 3 S+ 0 0 43 -2,-0.3 -1,-0.1 1,-0.3 22,-0.0 0.721 114.1 55.9 -58.3 -27.3 69.9 66.9 7.9 124 123 A Y T 3 S+ 0 0 40 22,-0.1 -1,-0.3 2,-0.1 22,-0.1 0.436 77.0 125.9 -90.9 0.6 68.2 69.9 9.6 125 124 A D < - 0 0 4 -3,-1.7 22,-2.3 20,-0.2 2,-0.4 -0.320 46.7-152.7 -58.3 136.7 70.3 72.6 7.9 126 125 A E E -cd 147 173B 23 46,-2.7 48,-2.8 20,-0.2 49,-1.0 -0.932 13.8-164.5-119.0 139.0 68.1 75.3 6.2 127 126 A F E -cd 148 175B 0 20,-2.5 22,-2.4 -2,-0.4 2,-0.4 -0.990 19.6-140.4-118.2 133.1 68.8 77.5 3.2 128 127 A I E -cd 149 176B 0 47,-2.5 49,-3.3 -2,-0.4 2,-0.3 -0.789 15.2-170.5 -98.6 132.5 66.5 80.5 2.7 129 128 A T E -c 150 0B 3 20,-2.6 22,-2.7 -2,-0.4 2,-0.6 -0.878 20.6-132.0-117.6 148.2 65.3 81.6 -0.8 130 129 A I E -c 151 0B 5 47,-0.5 49,-0.1 -2,-0.3 23,-0.1 -0.942 44.2 -91.8-104.7 115.6 63.4 84.9 -1.4 131 130 A A S S+ 0 0 3 20,-2.6 23,-0.5 -2,-0.6 235,-0.1 -0.362 106.9 52.7 -69.1 147.2 60.3 84.4 -3.5 132 131 A P S S+ 0 0 5 0, 0.0 53,-0.3 0, 0.0 2,-0.3 0.600 90.5 162.1 -76.1 145.9 59.8 84.6 -6.4 133 132 A Y - 0 0 12 232,-2.9 234,-0.1 -2,-0.1 -2,-0.1 -0.900 50.6 -91.8-138.1 160.6 62.7 82.1 -7.0 134 133 A F > - 0 0 67 49,-0.4 3,-2.2 -2,-0.3 4,-0.3 -0.584 37.8-146.7 -65.9 108.4 64.4 79.7 -9.3 135 134 A P T >> S+ 0 0 53 0, 0.0 3,-1.6 0, 0.0 4,-0.5 0.730 89.4 74.9 -58.4 -23.8 62.7 76.3 -8.3 136 135 A E H 3> S+ 0 0 41 1,-0.3 4,-2.0 2,-0.2 3,-0.2 0.664 76.8 78.6 -62.8 -19.2 65.9 74.3 -9.1 137 136 A Y H <> S+ 0 0 3 -3,-2.2 4,-2.7 1,-0.2 -1,-0.3 0.878 88.8 57.0 -54.1 -40.3 67.4 75.7 -5.8 138 137 A K H <> S+ 0 0 103 -3,-1.6 4,-2.7 -4,-0.3 5,-0.2 0.891 105.7 49.5 -58.7 -40.3 65.2 73.1 -4.0 139 138 A V H X S+ 0 0 20 -4,-0.5 4,-2.7 -3,-0.2 -2,-0.2 0.929 113.9 44.4 -65.4 -45.6 66.9 70.3 -5.9 140 139 A F H X S+ 0 0 8 -4,-2.0 4,-1.0 2,-0.2 -2,-0.2 0.903 116.8 45.8 -66.6 -42.7 70.4 71.5 -5.2 141 140 A V H <>S+ 0 0 0 -4,-2.7 5,-2.4 2,-0.2 3,-0.4 0.918 116.9 44.4 -64.7 -47.9 69.6 72.2 -1.5 142 141 A N H ><5S+ 0 0 65 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.890 108.0 59.1 -62.6 -40.1 67.8 68.8 -1.1 143 142 A A H 3<5S+ 0 0 18 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.741 104.7 51.0 -61.3 -26.2 70.7 67.1 -3.1 144 143 A A T 3<5S- 0 0 19 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.463 124.3-105.6 -85.4 -6.5 73.1 68.4 -0.3 145 144 A G T < 5S+ 0 0 34 -3,-1.8 -3,-0.2 1,-0.3 -20,-0.2 0.485 85.0 110.2 93.2 8.9 70.8 66.9 2.4 146 145 A A < - 0 0 2 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.3 -0.319 62.0-114.2-106.2-176.9 69.4 70.2 3.6 147 146 A R E -c 126 0B 53 -22,-2.3 -20,-2.5 -2,-0.1 2,-0.4 -0.907 16.5-126.8-125.8 152.2 66.0 71.9 3.3 148 147 A L E -c 127 0B 31 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.812 16.1-165.2-100.3 136.6 64.7 75.0 1.6 149 148 A V E -c 128 0B 29 -22,-2.4 -20,-2.6 -2,-0.4 2,-0.4 -0.995 13.4-146.9-121.4 122.6 62.8 77.8 3.4 150 149 A E E -c 129 0B 87 -2,-0.4 -20,-0.2 -22,-0.2 -22,-0.1 -0.820 2.2-148.9 -94.8 130.2 60.8 80.3 1.3 151 150 A V E -c 130 0B 0 -22,-2.7 -20,-2.6 -2,-0.4 14,-0.1 -0.857 34.5-111.0 -90.7 125.0 60.4 83.9 2.2 152 151 A P - 0 0 58 0, 0.0 9,-0.4 0, 0.0 13,-0.1 -0.268 44.3 -91.2 -55.2 145.2 57.0 85.2 0.8 153 152 A A - 0 0 21 213,-0.4 2,-1.1 1,-0.1 7,-0.1 -0.162 16.0-133.0 -65.0 145.8 57.3 87.7 -2.0 154 153 A D > + 0 0 23 -23,-0.5 4,-1.9 5,-0.4 -1,-0.1 -0.877 31.3 178.0 -88.6 93.3 57.5 91.5 -1.7 155 154 A T T 4 + 0 0 68 -2,-1.1 -1,-0.1 2,-0.2 -2,-0.0 0.567 69.9 65.4 -78.9 -7.7 54.9 92.0 -4.4 156 155 A E T 4 S- 0 0 162 -3,-0.1 -1,-0.1 1,-0.0 -2,-0.0 0.971 131.2 -8.4 -75.5 -56.6 55.0 95.8 -3.9 157 156 A H T 4 S- 0 0 130 171,-0.0 -2,-0.2 30,-0.0 -1,-0.0 0.475 85.6-122.1-120.9 -5.9 58.6 96.3 -5.1 158 157 A F S < S+ 0 0 6 -4,-1.9 -3,-0.1 29,-0.1 2,-0.1 0.869 77.5 112.7 56.7 42.2 60.2 92.8 -5.5 159 158 A Q S S- 0 0 34 -5,-0.1 -5,-0.4 28,-0.1 2,-0.4 0.180 79.3 -58.2-105.8-132.0 62.9 93.5 -3.0 160 159 A I - 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0 0 16 -6,-0.5 -1,-0.2 -9,-0.1 -2,-0.0 -0.154 51.6-136.0 -79.4 176.3 75.3 45.2 -30.1 495 95 B H + 0 0 112 2,-0.0 -9,-0.1 -7,-0.0 -1,-0.1 -0.151 46.0 148.2-129.4 35.3 71.8 46.6 -30.7 496 96 B F - 0 0 11 -11,-0.3 2,-0.2 -12,-0.1 -7,-0.1 -0.329 25.2-166.2 -73.5 153.3 71.9 50.0 -28.9 497 97 B N > - 0 0 78 -2,-0.0 3,-2.2 -8,-0.0 4,-0.2 -0.768 44.3 -85.4-124.6 176.8 70.0 53.2 -30.0 498 98 B A G > S+ 0 0 12 1,-0.3 3,-2.1 -2,-0.2 -2,-0.0 0.853 123.0 63.7 -50.5 -41.7 70.4 56.8 -28.8 499 99 B D G 3 S+ 0 0 82 1,-0.3 -1,-0.3 161,-0.0 -17,-0.0 0.485 89.0 67.9 -69.1 -5.2 68.2 56.3 -25.8 500 100 B N G < S+ 0 0 0 -3,-2.2 161,-3.6 -19,-0.1 2,-0.3 0.523 95.9 73.6 -83.7 -6.7 70.6 53.8 -24.3 501 101 B L E < -M 660 0F 0 -3,-2.1 2,-0.4 159,-0.2 159,-0.2 -0.799 53.4-173.2-115.6 150.2 73.1 56.7 -23.8 502 102 B Y E -M 659 0F 6 157,-1.9 157,-2.3 -2,-0.3 2,-0.3 -0.976 27.6-131.3-137.7 122.2 73.4 59.6 -21.4 503 103 B X E -M 658 0F 2 -28,-2.7 155,-0.3 -2,-0.4 2,-0.2 -0.610 31.1-176.9 -84.5 133.6 76.2 62.1 -22.1 504 104 B T E -M 657 0F 5 153,-2.1 153,-2.4 -2,-0.3 2,-1.0 -0.719 38.7-104.4-124.4 171.1 78.4 63.1 -19.1 505 105 B X S S- 0 0 5 151,-0.2 4,-0.4 -2,-0.2 151,-0.3 -0.545 88.3 -47.1 -97.3 65.2 81.3 65.4 -18.2 506 106 B G S > S- 0 0 0 -2,-1.0 4,-1.9 1,-0.2 151,-0.2 -0.182 74.6 -70.4 94.7 169.9 83.9 62.7 -18.1 507 107 B A H > S+ 0 0 9 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.769 128.2 62.7 -69.1 -30.6 84.2 59.2 -16.5 508 108 B A H > S+ 0 0 11 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.901 108.4 43.4 -58.2 -43.7 84.3 60.7 -13.0 509 109 B A H > S+ 0 0 0 -4,-0.4 4,-2.7 2,-0.2 -2,-0.2 0.928 113.5 51.4 -65.4 -45.8 80.8 62.1 -13.7 510 110 B S H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.930 113.9 43.5 -57.1 -51.4 79.7 58.8 -15.3 511 111 B L H X S+ 0 0 2 -4,-3.2 4,-2.1 2,-0.2 -1,-0.2 0.915 113.7 51.8 -58.7 -46.8 81.0 56.8 -12.2 512 112 B S H X S+ 0 0 4 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.889 110.1 48.5 -56.8 -47.2 79.4 59.3 -9.8 513 113 B I H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.880 108.9 53.7 -58.9 -46.7 76.1 59.1 -11.5 514 114 B C H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.923 113.0 42.3 -57.9 -45.9 76.1 55.3 -11.5 515 115 B F H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.884 115.6 48.2 -70.8 -41.7 76.7 55.1 -7.7 516 116 B R H < S+ 0 0 31 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.863 111.6 51.6 -65.8 -39.6 74.3 57.9 -6.8 517 117 B A H < S+ 0 0 0 -4,-2.5 -512,-2.9 -5,-0.2 -2,-0.2 0.899 117.6 36.9 -60.4 -45.3 71.6 56.3 -9.0 518 118 B L H < S+ 0 0 0 -4,-1.7 2,-0.2 -514,-0.2 -2,-0.2 0.862 90.3 98.2 -81.3 -39.8 71.9 52.9 -7.4 519 119 B T < + 0 0 6 -4,-2.5 3,-0.1 -5,-0.2 -515,-0.1 -0.319 31.1 156.0 -65.0 121.1 72.6 53.6 -3.7 520 120 B S + 0 0 57 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.301 62.8 37.0-122.5 1.5 69.4 53.4 -1.4 521 121 B D S > S- 0 0 80 50,-0.1 3,-1.6 1,-0.1 -1,-0.2 -0.981 75.4-120.8-155.0 149.9 70.9 52.7 2.0 522 122 B A T 3 S+ 0 0 35 -2,-0.3 -1,-0.1 1,-0.3 22,-0.0 0.762 111.8 56.1 -58.3 -33.2 74.0 53.8 4.0 523 123 B Y T 3 S+ 0 0 47 22,-0.1 -1,-0.3 2,-0.1 22,-0.1 0.330 77.2 128.0 -89.5 7.3 75.2 50.1 4.3 524 124 B D < - 0 0 3 -3,-1.6 22,-2.9 20,-0.3 2,-0.4 -0.308 47.1-149.2 -59.2 144.3 75.2 49.5 0.6 525 125 B E E -no 546 572F 29 46,-2.4 48,-3.2 20,-0.2 49,-0.9 -0.972 16.0-166.3-124.7 135.8 78.4 48.1 -0.7 526 126 B F E -no 547 574F 0 20,-2.5 22,-2.5 -2,-0.4 2,-0.3 -0.994 22.7-140.1-114.3 127.8 80.2 48.5 -4.0 527 127 B I E -no 548 575F 0 47,-2.9 49,-3.1 -2,-0.4 2,-0.3 -0.694 14.8-166.7 -91.9 137.7 83.1 46.0 -4.6 528 128 B T E -no 549 576F 2 20,-2.9 22,-2.5 -2,-0.3 2,-0.7 -0.948 19.3-130.7-120.7 146.0 86.4 47.0 -6.2 529 129 B I E -n 550 0F 6 47,-0.6 49,-0.1 -2,-0.3 23,-0.1 -0.874 44.6 -96.5 -97.6 111.0 89.0 44.5 -7.5 530 130 B A S S+ 0 0 3 20,-2.5 23,-0.5 -2,-0.7 235,-0.1 -0.431 105.5 53.5 -69.0 145.8 92.5 45.4 -6.2 531 131 B P S S+ 0 0 5 0, 0.0 2,-0.3 0, 0.0 53,-0.3 0.589 89.4 160.3 -74.9 145.1 94.7 47.0 -7.5 532 132 B Y - 0 0 14 232,-2.3 -2,-0.1 -2,-0.1 234,-0.1 -0.931 52.0 -90.5-139.4 161.2 92.3 49.8 -8.2 533 133 B F > - 0 0 69 49,-0.4 3,-2.0 -2,-0.3 4,-0.2 -0.548 39.8-144.6 -65.6 111.1 91.9 53.6 -9.0 534 134 B P T > S+ 0 0 49 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.709 90.2 75.9 -59.5 -21.8 91.7 55.0 -5.4 535 135 B E T >> S+ 0 0 46 1,-0.3 4,-1.9 2,-0.2 3,-0.7 0.666 75.9 79.3 -63.5 -16.9 89.1 57.8 -6.4 536 136 B Y H <> S+ 0 0 3 -3,-2.0 4,-2.4 1,-0.3 -1,-0.3 0.848 87.6 57.8 -56.4 -36.8 86.4 55.0 -6.5 537 137 B K H <> S+ 0 0 103 -3,-1.5 4,-2.4 -4,-0.2 -1,-0.3 0.852 105.7 50.1 -60.2 -36.8 86.3 55.3 -2.7 538 138 B V H <> S+ 0 0 16 -3,-0.7 4,-2.5 -4,-0.4 -2,-0.2 0.942 113.6 42.7 -69.4 -49.1 85.5 59.0 -3.1 539 139 B F H X S+ 0 0 7 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.848 117.0 47.5 -63.9 -40.7 82.6 58.5 -5.7 540 140 B V H <>S+ 0 0 0 -4,-2.4 5,-2.1 -5,-0.2 3,-0.3 0.942 115.1 44.7 -66.0 -50.5 81.2 55.5 -3.7 541 141 B N H ><5S+ 0 0 59 -4,-2.4 3,-1.6 1,-0.2 -2,-0.2 0.880 110.5 55.0 -61.9 -38.5 81.3 57.4 -0.3 542 142 B A H 3<5S+ 0 0 19 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.795 103.7 55.4 -66.9 -30.3 79.9 60.6 -1.9 543 143 B A T 3<5S- 0 0 13 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.483 125.6-105.4 -75.8 -7.3 76.9 58.5 -3.1 544 144 B G T < 5S+ 0 0 30 -3,-1.6 -20,-0.3 1,-0.3 -3,-0.2 0.685 83.8 112.8 88.0 25.1 76.3 57.4 0.5 545 145 B A < - 0 0 1 -5,-2.1 2,-0.3 -6,-0.1 -1,-0.3 -0.613 63.4-112.6-121.4 174.5 77.7 53.9 0.1 546 146 B R E -n 525 0F 50 -22,-2.9 -20,-2.5 -2,-0.2 2,-0.5 -0.846 20.2-134.1-113.9 145.3 80.7 51.8 1.3 547 147 B L E -n 526 0F 26 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.887 16.6-163.3 -99.4 130.5 83.6 50.5 -0.8 548 148 B V E -n 527 0F 30 -22,-2.5 -20,-2.9 -2,-0.5 2,-0.4 -0.964 10.4-144.6-115.4 131.2 84.7 46.8 -0.3 549 149 B E E -n 528 0F 91 -2,-0.4 -20,-0.2 -22,-0.2 -22,-0.1 -0.828 3.3-153.9 -99.6 133.9 88.1 45.6 -1.7 550 150 B V E -n 529 0F 0 -22,-2.5 -20,-2.5 -2,-0.4 14,-0.1 -0.899 34.8-110.5 -99.4 127.7 88.9 42.2 -3.1 551 151 B P - 0 0 61 0, 0.0 9,-0.4 0, 0.0 12,-0.1 -0.300 43.8 -93.1 -62.9 143.5 92.6 41.3 -2.7 552 152 B A - 0 0 19 213,-0.5 2,-1.1 1,-0.1 7,-0.1 -0.117 17.1-127.5 -61.6 146.8 94.6 41.3 -5.9 553 153 B D > - 0 0 31 -23,-0.5 4,-1.9 5,-0.4 -1,-0.1 -0.861 31.6-177.7 -87.4 97.3 95.4 38.3 -8.1 554 154 B T T 4 S+ 0 0 68 -2,-1.1 -1,-0.1 1,-0.2 -2,-0.1 0.366 72.1 62.3 -84.2 5.5 99.1 38.9 -8.0 555 155 B E T 4 S- 0 0 148 172,-0.0 -1,-0.2 -3,-0.0 -2,-0.0 0.834 132.2 -8.1 -92.5 -41.9 99.8 35.9 -10.4 556 156 B H T 4 S- 0 0 121 -3,-0.1 -2,-0.2 171,-0.0 3,-0.0 0.415 82.5-122.7-134.9 -2.3 97.8 37.3 -13.5 557 157 B F S < S+ 0 0 5 -4,-1.9 -3,-0.1 29,-0.1 2,-0.1 0.831 77.1 116.7 51.0 37.5 95.9 40.4 -12.4 558 158 B Q S S- 0 0 37 -5,-0.1 -5,-0.4 30,-0.1 2,-0.4 0.291 78.6 -61.7 -95.0-131.3 92.6 38.8 -13.4 559 159 B I - 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