==== 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 LYASE 30-MAR-04 1SVV . COMPND 2 MOLECULE: THREONINE ALDOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LEISHMANIA MAJOR; . AUTHOR W.G.J.HOL,M.A.ROBIEN,STRUCTURAL GENOMICS OF PATHOGENIC PROTO . 682 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26345.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 477 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 55 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 34 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 229 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.8 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 4 2 0 6 0 0 6 0 2 1 4 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 0 5 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 PARALLEL BRIDGES PER LADDER . 2 2 2 1 5 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 2 0 0 0 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 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 15 A P 0 0 131 0, 0.0 301,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 99.1 86.2 74.5 61.6 2 16 A Y E -a 302 0A 24 299,-1.5 301,-1.9 1,-0.1 2,-0.5 -0.461 360.0-131.4 -75.5 134.9 88.8 71.7 61.6 3 17 A S E +a 303 0A 15 299,-0.2 301,-0.1 -2,-0.2 6,-0.1 -0.729 39.6 160.5 -99.4 124.7 87.7 68.5 59.8 4 18 A F + 0 0 0 299,-2.6 316,-2.3 -2,-0.5 301,-0.3 -0.069 50.3 113.3-110.9 25.2 87.9 64.9 61.1 5 19 A V S S- 0 0 36 299,-0.2 2,-0.3 314,-0.2 316,-0.1 0.890 82.9 -20.3 -70.0 -43.0 85.3 63.8 58.6 6 20 A N - 0 0 16 314,-0.2 3,-0.3 -3,-0.1 314,-0.1 -0.918 60.7-102.5-154.7 178.7 87.4 61.5 56.4 7 21 A D S S+ 0 0 0 -2,-0.3 316,-0.2 1,-0.2 317,-0.1 0.003 106.3 62.9-102.2 31.6 91.0 60.6 55.3 8 22 A Y + 0 0 25 361,-0.1 -1,-0.2 567,-0.1 194,-0.1 -0.283 61.6 108.1-149.2 53.3 90.8 62.4 51.9 9 23 A S S S+ 0 0 8 -3,-0.3 360,-1.9 -6,-0.1 2,-0.3 0.487 71.6 61.4-107.9 -10.6 90.3 66.1 52.7 10 24 A V S S- 0 0 12 358,-0.2 194,-0.1 1,-0.1 358,-0.1 -0.903 82.2-126.2-121.1 148.4 93.8 67.4 51.7 11 25 A G - 0 0 2 356,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.978 63.7 -44.9 -63.0 -70.8 95.3 67.0 48.2 12 26 A X - 0 0 0 194,-0.1 193,-0.2 191,-0.0 -1,-0.2 -0.995 59.6 -76.9-165.3 159.9 98.7 65.3 48.5 13 27 A H >> - 0 0 31 191,-2.7 4,-1.8 -2,-0.3 3,-1.3 -0.368 47.2-118.1 -61.9 139.3 102.0 65.0 50.4 14 28 A P H 3> S+ 0 0 68 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.795 112.4 59.7 -50.9 -35.5 104.4 67.8 49.4 15 29 A K H 3> S+ 0 0 120 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.793 106.0 48.2 -68.0 -28.6 107.0 65.3 48.0 16 30 A I H <> S+ 0 0 0 -3,-1.3 4,-2.5 2,-0.2 5,-0.2 0.932 111.4 49.5 -70.9 -46.3 104.4 64.1 45.5 17 31 A L H X S+ 0 0 26 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.886 110.8 52.1 -56.7 -40.6 103.5 67.7 44.5 18 32 A D H X S+ 0 0 84 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.892 109.9 46.0 -65.4 -44.6 107.3 68.4 44.1 19 33 A L H X S+ 0 0 40 -4,-1.6 4,-1.5 1,-0.2 -1,-0.2 0.909 113.5 50.4 -67.7 -38.7 107.9 65.4 41.8 20 34 A X H X S+ 0 0 3 -4,-2.5 4,-0.6 1,-0.2 -2,-0.2 0.876 113.5 46.1 -63.7 -39.0 104.8 66.3 39.7 21 35 A A H >< S+ 0 0 41 -4,-2.1 3,-0.5 -5,-0.2 -2,-0.2 0.910 114.6 45.3 -70.2 -45.2 106.0 69.9 39.5 22 36 A R H 3< S+ 0 0 205 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.706 113.3 51.5 -72.4 -21.5 109.6 69.1 38.5 23 37 A D H >< S+ 0 0 22 -4,-1.5 3,-1.7 -5,-0.2 -1,-0.2 0.599 82.9 118.2 -90.3 -15.5 108.4 66.5 36.0 24 38 A N T << S+ 0 0 23 -4,-0.6 3,-0.1 -3,-0.5 327,-0.1 -0.268 70.9 28.3 -57.5 140.4 106.0 68.8 34.2 25 39 A X T 3 S+ 0 0 104 1,-0.4 -1,-0.2 328,-0.1 2,-0.2 0.231 89.5 119.7 85.7 -8.5 106.8 69.5 30.5 26 40 A T < - 0 0 73 -3,-1.7 -1,-0.4 1,-0.0 326,-0.4 -0.605 67.4-118.3 -75.6 148.3 108.5 66.1 30.0 27 41 A Q + 0 0 57 -2,-0.2 2,-0.3 324,-0.1 324,-0.2 -0.700 36.0 179.1 -93.2 139.3 106.9 63.9 27.3 28 42 A H - 0 0 22 322,-1.5 2,-0.2 -2,-0.3 321,-0.1 -0.981 31.0-113.2-137.6 146.0 105.4 60.5 28.4 29 43 A A - 0 0 56 -2,-0.3 3,-0.3 4,-0.1 208,-0.2 -0.522 44.9-117.6 -73.3 152.6 103.6 57.7 26.7 30 44 A G S > S+ 0 0 8 1,-0.2 3,-1.7 -2,-0.2 205,-0.2 -0.146 78.5 40.0 -88.5 174.9 100.0 57.3 27.9 31 45 A Y T 3 S- 0 0 60 203,-2.1 -1,-0.2 202,-0.4 203,-0.2 0.763 127.3 -55.7 63.7 34.6 97.9 54.7 29.6 32 46 A G T 3 S+ 0 0 21 202,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.515 105.6 119.5 76.1 10.2 100.5 53.5 32.2 33 47 A Q < + 0 0 128 -3,-1.7 -3,-0.1 4,-0.1 -4,-0.1 0.221 53.4 104.6 -90.9 21.4 103.2 52.6 29.6 34 48 A D S > S- 0 0 11 -5,-0.2 4,-1.7 -6,-0.1 5,-0.1 -0.358 84.7-101.2-103.6 175.6 105.6 55.2 31.0 35 49 A S H > S+ 0 0 91 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.743 114.4 55.6 -62.9 -35.1 108.8 55.3 33.2 36 50 A H H > S+ 0 0 19 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.938 108.7 45.7 -70.3 -44.4 107.0 56.3 36.4 37 51 A C H > S+ 0 0 8 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.903 112.4 52.6 -63.4 -41.6 104.6 53.4 36.4 38 52 A A H X S+ 0 0 58 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.914 112.2 44.8 -62.3 -44.7 107.4 51.0 35.6 39 53 A K H X S+ 0 0 52 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.935 114.3 48.2 -65.8 -45.4 109.6 52.2 38.5 40 54 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.944 111.8 50.1 -60.8 -44.9 106.7 52.3 41.0 41 55 A A H X S+ 0 0 28 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.907 110.9 49.6 -62.1 -42.7 105.6 48.7 39.9 42 56 A R H X S+ 0 0 180 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.920 111.1 49.1 -58.8 -48.0 109.2 47.5 40.4 43 57 A L H X S+ 0 0 46 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.900 111.9 49.2 -57.8 -42.8 109.4 49.1 43.8 44 58 A I H X S+ 0 0 1 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.903 107.4 54.3 -67.5 -38.9 106.1 47.5 44.8 45 59 A G H X>S+ 0 0 6 -4,-2.3 5,-1.7 1,-0.2 4,-0.8 0.909 109.3 49.0 -60.6 -41.0 107.2 44.0 43.6 46 60 A E H ><5S+ 0 0 119 -4,-1.9 3,-0.7 2,-0.2 -1,-0.2 0.925 109.5 50.1 -66.3 -44.1 110.3 44.3 45.8 47 61 A L H 3<5S+ 0 0 71 -4,-2.0 140,-0.3 1,-0.2 -2,-0.2 0.892 114.5 45.5 -62.8 -35.9 108.3 45.3 48.9 48 62 A L H 3<5S- 0 0 2 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.608 102.6-132.9 -78.2 -13.8 105.9 42.4 48.3 49 63 A E T <<5S+ 0 0 147 -4,-0.8 -3,-0.2 -3,-0.7 -4,-0.1 0.836 83.4 101.9 54.9 33.5 108.8 39.9 47.6 50 64 A R > < + 0 0 77 -5,-1.7 3,-1.9 -6,-0.2 -4,-0.1 -0.545 36.4 163.1-139.0 70.9 106.7 38.9 44.6 51 65 A P T 3 S+ 0 0 108 0, 0.0 -6,-0.1 0, 0.0 -5,-0.1 0.632 73.2 71.5 -66.8 -7.4 108.2 40.5 41.6 52 66 A D T 3 S+ 0 0 78 -7,-0.1 -7,-0.0 2,-0.1 2,-0.0 0.637 78.4 102.7 -75.8 -14.6 106.2 38.0 39.5 53 67 A A S < S- 0 0 13 -3,-1.9 2,-0.4 -8,-0.1 161,-0.2 -0.336 74.2-123.4 -71.0 151.0 103.0 39.9 40.4 54 68 A D E -B 213 0B 63 159,-2.4 159,-2.9 -9,-0.0 2,-0.5 -0.840 24.0-159.4 -92.8 133.8 101.2 42.2 37.9 55 69 A V E -B 212 0B 26 -2,-0.4 2,-0.4 157,-0.2 157,-0.2 -0.962 9.8-177.4-116.6 124.6 100.7 45.8 39.2 56 70 A H E -B 211 0B 26 155,-2.5 155,-2.6 -2,-0.5 2,-0.5 -0.978 18.9-140.3-123.4 132.3 98.0 48.0 37.6 57 71 A F E +B 210 0B 25 -2,-0.4 2,-0.3 153,-0.2 176,-0.3 -0.825 26.1 174.3 -96.1 129.3 97.5 51.7 38.7 58 72 A I E -B 209 0B 0 151,-2.2 151,-2.5 -2,-0.5 174,-0.1 -0.920 32.8-127.4-136.4 150.0 93.9 52.8 38.8 59 73 A S S S+ 0 0 13 172,-0.3 149,-2.7 -2,-0.3 2,-0.3 0.892 77.7 28.1 -77.8 -37.0 92.5 56.1 40.1 60 74 A G > - 0 0 17 147,-0.2 4,-1.8 511,-0.1 149,-0.1 -0.803 63.8-123.4-131.0 167.7 89.8 55.1 42.7 61 75 A G H > S+ 0 0 15 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.904 111.0 46.4 -73.3 -47.3 88.7 52.5 45.2 62 76 A T H > S+ 0 0 16 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.903 113.6 52.3 -60.6 -45.1 85.2 51.7 43.9 63 77 A Q H > S+ 0 0 5 508,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.919 110.9 47.1 -50.6 -51.4 86.7 51.5 40.4 64 78 A T H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.906 111.5 49.9 -64.9 -43.2 89.3 49.0 41.7 65 79 A N H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.906 112.3 46.2 -63.1 -42.0 86.7 46.8 43.5 66 80 A L H X S+ 0 0 8 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.850 113.6 49.6 -75.5 -29.2 84.4 46.5 40.6 67 81 A I H X S+ 0 0 2 -4,-1.9 4,-2.0 -5,-0.2 -2,-0.2 0.939 110.6 50.8 -68.9 -47.3 87.3 45.7 38.3 68 82 A A H X S+ 0 0 0 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.914 113.4 44.0 -55.9 -46.5 88.6 43.0 40.7 69 83 A C H X S+ 0 0 0 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.868 112.4 52.0 -67.7 -38.3 85.3 41.3 41.0 70 84 A S H < S+ 0 0 25 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.817 111.2 48.8 -71.2 -26.6 84.6 41.5 37.2 71 85 A L H < S+ 0 0 37 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.846 116.8 40.8 -76.1 -34.4 88.1 39.9 36.6 72 86 A A H < S+ 0 0 7 -4,-1.6 2,-0.4 -5,-0.2 -2,-0.2 0.586 104.7 74.8 -92.6 -11.5 87.5 37.1 39.1 73 87 A L < - 0 0 15 -4,-1.2 -1,-0.1 -5,-0.1 6,-0.0 -0.892 58.2-150.2-120.3 130.9 83.9 36.1 38.4 74 88 A R > - 0 0 144 -2,-0.4 3,-2.0 4,-0.1 59,-0.1 -0.405 49.8 -91.7 -77.6 165.7 81.9 34.3 35.8 75 89 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.790 126.8 43.4 -55.8 -29.1 78.2 35.4 35.3 76 90 A W T 3 S+ 0 0 129 24,-0.1 55,-2.4 54,-0.1 2,-0.3 0.296 97.7 97.2-100.2 8.0 76.8 32.9 37.8 77 91 A E E < -c 131 0B 25 -3,-2.0 24,-0.3 53,-0.2 2,-0.3 -0.708 55.1-162.1-101.6 154.5 79.5 33.5 40.4 78 92 A A E -c 132 0B 0 53,-2.0 55,-2.8 -2,-0.3 56,-1.4 -0.800 15.9-118.9-133.6 163.3 79.2 35.8 43.4 79 93 A V E -cd 134 102B 0 22,-2.3 24,-2.9 -2,-0.3 2,-0.4 -0.885 19.6-140.0-110.2 135.6 81.4 37.5 46.0 80 94 A I E +cd 135 103B 0 54,-3.0 56,-3.0 -2,-0.4 2,-0.3 -0.824 35.7 148.2 -93.5 136.2 81.3 36.9 49.7 81 95 A A E - d 0 104B 0 22,-2.0 24,-1.4 -2,-0.4 2,-0.1 -0.967 48.3 -91.8-154.5 161.8 81.6 39.9 52.0 82 96 A T E > - d 0 105B 7 54,-0.4 3,-1.7 -2,-0.3 6,-0.2 -0.470 41.7-111.1 -68.2 155.1 80.5 41.2 55.4 83 97 A Q T 3 S+ 0 0 106 22,-1.8 -1,-0.1 1,-0.3 21,-0.1 0.695 121.1 52.6 -55.7 -26.3 77.3 43.3 55.5 84 98 A L T 3 S+ 0 0 61 21,-0.3 -1,-0.3 23,-0.2 58,-0.1 0.394 82.3 123.0 -91.2 0.1 79.6 46.3 56.4 85 99 A G S X> S- 0 0 0 -3,-1.7 3,-1.3 1,-0.1 4,-0.8 -0.289 73.8-119.8 -61.8 149.5 81.9 45.7 53.5 86 100 A H H >> S+ 0 0 43 1,-0.3 4,-1.6 2,-0.2 3,-0.9 0.896 113.8 53.3 -60.7 -39.5 82.3 48.7 51.2 87 101 A I H 34 S+ 0 0 4 1,-0.2 8,-0.3 2,-0.2 -1,-0.3 0.636 107.8 51.9 -69.0 -18.2 80.9 46.7 48.2 88 102 A S H <4 S+ 0 0 36 -3,-1.3 -1,-0.2 -6,-0.2 -2,-0.2 0.575 128.4 10.5 -85.5 -16.5 77.8 45.7 50.2 89 103 A T H << S+ 0 0 64 -3,-0.9 3,-0.3 -4,-0.8 -2,-0.2 0.729 122.5 37.9-125.7 -53.2 76.8 49.2 51.2 90 104 A H S < S+ 0 0 110 -4,-1.6 -3,-0.1 -5,-0.3 -4,-0.1 -0.127 89.6 75.9-122.0 32.2 78.5 52.2 49.7 91 105 A E S > S- 0 0 3 -5,-0.2 3,-0.9 -4,-0.1 -1,-0.2 0.078 95.9-117.6-124.1 20.5 79.3 51.7 46.0 92 106 A T T 3 S- 0 0 52 -3,-0.3 477,-0.1 1,-0.2 -2,-0.1 0.825 76.3 -48.3 35.0 51.3 75.7 52.3 44.8 93 107 A G T 3> S+ 0 0 27 -6,-0.1 4,-2.2 3,-0.1 -1,-0.2 0.767 90.2 151.6 76.7 27.5 75.3 48.8 43.4 94 108 A A H <> S+ 0 0 1 -3,-0.9 4,-0.8 1,-0.2 -2,-0.1 0.880 72.7 44.8 -59.5 -43.6 78.6 48.9 41.5 95 109 A I H >4>S+ 0 0 0 -8,-0.3 5,-1.6 1,-0.2 3,-0.6 0.891 113.0 50.4 -69.3 -40.2 79.2 45.1 41.7 96 110 A E H >45S+ 0 0 92 1,-0.2 3,-1.6 3,-0.2 -1,-0.2 0.826 102.7 61.8 -67.8 -29.8 75.6 44.3 40.8 97 111 A A H 3<5S+ 0 0 30 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.784 99.1 55.8 -66.6 -27.5 76.0 46.7 37.9 98 112 A T T <<5S- 0 0 21 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.481 129.2-101.8 -77.1 -4.1 78.8 44.3 36.6 99 113 A G T < 5S+ 0 0 54 -3,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.547 82.9 114.9 99.2 9.5 76.2 41.5 36.8 100 114 A H < - 0 0 16 -5,-1.6 -1,-0.2 -24,-0.1 2,-0.2 -0.906 57.7-126.0-121.0 146.7 77.1 39.8 40.1 101 115 A K - 0 0 117 -2,-0.3 -22,-2.3 -24,-0.3 2,-0.6 -0.534 12.8-141.6 -83.2 142.4 75.6 39.2 43.5 102 116 A V E -d 79 0B 13 -2,-0.2 2,-0.6 -24,-0.2 -22,-0.2 -0.962 15.1-154.5 -96.7 115.0 77.3 40.1 46.8 103 117 A V E -d 80 0B 16 -24,-2.9 -22,-2.0 -2,-0.6 2,-0.2 -0.850 18.4-154.1 -88.5 118.8 76.5 37.4 49.3 104 118 A T E -d 81 0B 64 -2,-0.6 -22,-0.2 -24,-0.2 -24,-0.0 -0.634 12.7-157.2-100.5 155.0 76.7 39.0 52.8 105 119 A A E -d 82 0B 7 -24,-1.4 -22,-1.8 -2,-0.2 2,-1.3 -0.987 27.9-117.1-126.3 136.1 77.5 37.5 56.2 106 120 A P + 0 0 93 0, 0.0 -24,-0.1 0, 0.0 -2,-0.0 -0.602 46.7 159.1 -77.9 94.5 76.4 39.2 59.4 107 121 A C > - 0 0 8 -2,-1.3 3,-2.1 1,-0.1 -23,-0.2 -0.890 23.7-165.6-117.8 96.5 79.7 40.0 61.1 108 122 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -26,-0.0 0.735 86.9 54.1 -55.3 -28.3 79.2 42.8 63.7 109 123 A D T 3 S- 0 0 47 2,-0.2 36,-0.2 170,-0.0 34,-0.1 0.306 113.9-114.7 -93.2 9.2 82.9 43.5 64.1 110 124 A G S < S+ 0 0 2 -3,-2.1 2,-0.4 1,-0.2 28,-0.3 0.453 79.9 113.3 78.6 2.1 83.4 44.0 60.4 111 125 A K - 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0 0 19 147,-0.2 4,-1.8 -171,-0.1 149,-0.1 -0.864 65.2-120.5-136.6 165.8 88.2 60.6 31.6 402 75 B G H > S+ 0 0 15 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.855 111.8 49.7 -76.1 -38.1 86.5 60.5 28.2 403 76 B T H > S+ 0 0 16 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.902 112.2 51.6 -64.8 -40.9 85.6 56.8 28.1 404 77 B Q H > S+ 0 0 7 -174,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.896 111.1 47.1 -57.8 -47.4 84.1 57.2 31.5 405 78 B T H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.914 111.0 50.2 -66.8 -42.9 82.1 60.2 30.4 406 79 B N H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.912 111.7 47.8 -63.2 -42.5 80.8 58.5 27.2 407 80 B L H X S+ 0 0 5 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.885 112.6 48.6 -71.2 -35.6 79.7 55.3 29.1 408 81 B I H X S+ 0 0 1 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.908 111.1 51.1 -64.8 -45.8 77.9 57.4 31.8 409 82 B A H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.917 111.3 46.2 -60.7 -46.0 76.1 59.5 29.2 410 83 B C H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.929 112.5 51.9 -61.0 -40.9 74.8 56.5 27.3 411 84 B S H < S+ 0 0 24 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.824 110.3 48.7 -67.4 -31.6 73.7 54.9 30.5 412 85 B L H < S+ 0 0 39 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.838 117.3 40.0 -71.7 -37.4 71.8 58.0 31.6 413 86 B A H < S+ 0 0 8 -4,-1.7 2,-0.4 -5,-0.2 -2,-0.2 0.687 104.3 72.6 -92.0 -19.1 70.0 58.4 28.3 414 87 B L < - 0 0 13 -4,-1.8 6,-0.0 -5,-0.1 -1,-0.0 -0.830 57.9-148.8-115.6 135.9 69.1 54.8 27.3 415 88 B R > - 0 0 146 -2,-0.4 3,-1.9 4,-0.1 59,-0.1 -0.436 49.9 -91.9 -79.7 166.0 66.6 52.1 28.4 416 89 B P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.754 126.2 44.5 -58.9 -29.2 67.8 48.5 28.0 417 90 B W T 3 S+ 0 0 134 24,-0.1 55,-2.1 54,-0.1 2,-0.2 0.321 98.3 95.9 -96.8 5.6 66.3 48.0 24.5 418 91 B E E < -n 472 0G 20 -3,-1.9 24,-0.5 53,-0.2 2,-0.3 -0.609 55.8-160.5 -97.3 160.4 67.5 51.4 23.2 419 92 B A E -n 473 0G 0 53,-2.1 55,-2.7 -2,-0.2 56,-1.6 -0.850 16.1-118.3-139.7 164.5 70.7 52.2 21.3 420 93 B V E -no 475 443G 0 22,-2.0 24,-2.8 -2,-0.3 2,-0.4 -0.888 20.9-141.2-110.0 136.9 73.1 54.9 20.3 421 94 B I E +no 476 444G 1 54,-2.8 56,-2.9 -2,-0.4 2,-0.3 -0.846 35.6 149.2 -96.9 134.5 73.8 56.0 16.7 422 95 B A E - o 0 445G 0 22,-2.1 24,-1.4 -2,-0.4 2,-0.1 -0.954 46.5 -91.8-153.6 165.5 77.4 56.9 15.8 423 96 B T E > - o 0 446G 6 54,-0.4 3,-1.2 -2,-0.3 6,-0.2 -0.455 40.1-111.4 -76.7 163.6 79.8 56.8 12.9 424 97 B Q T 3 S+ 0 0 109 22,-1.8 -1,-0.1 1,-0.2 21,-0.1 0.739 120.5 51.2 -64.7 -24.1 82.0 53.8 12.3 425 98 B L T 3 S+ 0 0 59 21,-0.3 -1,-0.2 23,-0.2 58,-0.1 0.448 83.5 122.6 -92.5 -4.6 85.0 56.1 13.3 426 99 B G S X> S- 0 0 0 -3,-1.2 3,-1.0 1,-0.1 4,-0.7 -0.186 72.5-119.6 -58.2 151.5 83.4 57.3 16.5 427 100 B H H >> S+ 0 0 38 1,-0.3 4,-1.6 2,-0.2 3,-1.0 0.911 113.5 52.4 -61.5 -43.5 85.3 56.7 19.8 428 101 B I H 34 S+ 0 0 4 1,-0.2 8,-0.3 2,-0.2 -1,-0.3 0.624 108.8 51.6 -69.1 -13.8 82.5 54.6 21.3 429 102 B S H <4 S+ 0 0 36 -3,-1.0 -1,-0.2 -6,-0.2 -2,-0.2 0.569 128.5 9.6 -92.6 -13.0 82.4 52.4 18.2 430 103 B T H << S+ 0 0 61 -3,-1.0 3,-0.4 -4,-0.7 -2,-0.2 0.720 121.9 40.1-131.0 -54.4 86.1 51.6 18.1 431 104 B H S < S+ 0 0 114 -4,-1.6 -3,-0.1 -5,-0.3 -4,-0.1 -0.204 90.1 77.5-119.3 36.1 88.5 52.5 20.9 432 105 B E S > S- 0 0 1 -4,-0.1 3,-0.7 -5,-0.1 -1,-0.2 0.205 95.6-115.4-127.8 14.3 86.6 51.9 24.2 433 106 B T T 3 S- 0 0 52 -3,-0.4 -205,-0.1 1,-0.2 -2,-0.1 0.856 76.6 -56.3 49.0 40.2 86.9 48.1 24.5 434 107 B G T 3> S+ 0 0 28 -6,-0.1 4,-2.0 3,-0.1 -1,-0.2 0.827 87.4 155.7 68.2 33.7 83.2 47.8 24.2 435 108 B A H <> S+ 0 0 2 -3,-0.7 4,-0.9 2,-0.2 -2,-0.1 0.887 72.8 47.6 -59.3 -42.2 82.5 50.1 27.1 436 109 B I H >4>S+ 0 0 1 -8,-0.3 5,-1.6 1,-0.2 3,-0.9 0.933 111.5 50.5 -67.4 -44.2 79.0 51.0 25.8 437 110 B E H >45S+ 0 0 91 1,-0.2 3,-1.5 3,-0.2 -1,-0.2 0.839 103.6 60.6 -58.9 -33.0 78.1 47.3 25.2 438 111 B A H 3<5S+ 0 0 31 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.743 99.7 55.8 -71.8 -19.3 79.3 46.5 28.8 439 112 B T T <<5S- 0 0 21 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.483 128.8-100.4 -84.0 -3.4 76.6 48.9 30.0 440 113 B G T < 5S+ 0 0 55 -3,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.512 83.4 115.8 102.3 9.4 74.0 46.8 28.1 441 114 B H < - 0 0 16 -5,-1.6 -1,-0.3 -24,-0.0 2,-0.3 -0.865 56.7-128.0-121.3 150.6 73.5 48.9 24.9 442 115 B K - 0 0 117 -24,-0.5 -22,-2.0 -2,-0.3 2,-0.6 -0.635 12.2-141.9 -92.1 144.1 74.2 48.5 21.2 443 116 B V E -o 420 0G 15 -2,-0.3 2,-0.6 -24,-0.2 -22,-0.2 -0.955 14.9-156.8-101.4 111.9 76.1 51.1 19.1 444 117 B V E -o 421 0G 17 -24,-2.8 -22,-2.1 -2,-0.6 2,-0.2 -0.831 18.6-154.9 -91.0 121.1 74.4 51.3 15.7 445 118 B T E -o 422 0G 62 -2,-0.6 -22,-0.2 -24,-0.2 -24,-0.0 -0.604 15.5-156.2-103.7 158.8 77.0 52.6 13.2 446 119 B A E -o 423 0G 8 -24,-1.4 -22,-1.8 -2,-0.2 2,-0.9 -0.999 27.7-119.3-129.8 134.7 76.9 54.5 9.9 447 120 B P + 0 0 89 0, 0.0 -24,-0.1 0, 0.0 -2,-0.0 -0.641 44.6 160.9 -77.0 103.2 79.7 54.4 7.3 448 121 B C > - 0 0 9 -2,-0.9 3,-2.2 1,-0.1 -23,-0.2 -0.900 25.3-161.3-127.2 95.7 80.8 58.0 7.1 449 122 B P T 3 S+ 0 0 112 0, 0.0 -1,-0.1 0, 0.0 -26,-0.0 0.678 88.6 49.4 -58.5 -23.3 84.2 58.2 5.5 450 123 B D T 3 S- 0 0 46 2,-0.2 36,-0.2 170,-0.0 34,-0.2 0.158 113.7-112.5-102.2 15.4 85.0 61.8 6.8 451 124 B G S < S+ 0 0 2 -3,-2.2 2,-0.4 1,-0.2 28,-0.3 0.486 78.8 117.9 75.2 4.3 84.0 61.0 10.4 452 125 B K - 0 0 26 30,-0.1 -2,-0.2 26,-0.1 2,-0.2 -0.898 58.2-135.3-110.1 130.2 80.9 63.3 10.4 453 126 B L - 0 0 3 -2,-0.4 2,-0.3 -3,-0.1 43,-0.1 -0.551 22.7-164.2 -72.5 147.0 77.3 62.1 10.9 454 127 B R > - 0 0 100 -2,-0.2 4,-1.5 1,-0.1 3,-0.5 -0.840 33.8-106.8-125.0 169.1 74.7 63.5 8.5 455 128 B V H > S+ 0 0 57 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.885 118.0 59.4 -63.3 -40.2 70.9 63.6 8.7 456 129 B A H > S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.841 104.5 51.9 -57.7 -35.1 70.6 60.9 6.0 457 130 B D H > S+ 0 0 32 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.892 109.7 47.4 -67.2 -42.9 72.6 58.6 8.2 458 131 B I H X S+ 0 0 0 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.955 113.8 48.0 -62.3 -52.2 70.3 59.1 11.2 459 132 B E H X S+ 0 0 44 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.876 111.3 50.2 -53.6 -43.5 67.2 58.6 9.1 460 133 B S H X S+ 0 0 76 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.839 108.3 52.9 -71.5 -32.0 68.6 55.5 7.5 461 134 B A H X S+ 0 0 8 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.871 109.7 49.4 -67.2 -34.6 69.5 54.1 11.0 462 135 B L H < S+ 0 0 43 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.799 111.5 48.5 -75.6 -29.4 65.8 54.7 12.1 463 136 B H H < S+ 0 0 138 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.899 110.8 49.3 -75.2 -42.1 64.5 52.9 9.0 464 137 B E H < S+ 0 0 48 -4,-2.0 2,-0.9 1,-0.2 -2,-0.2 0.793 104.9 64.0 -70.1 -26.1 66.7 49.8 9.3 465 138 B N S < S+ 0 0 20 -4,-1.2 2,-0.3 -5,-0.1 -1,-0.2 -0.795 72.7 135.2-108.1 92.3 65.8 49.4 13.0 466 139 B R + 0 0 154 -2,-0.9 3,-0.3 6,-0.1 -3,-0.1 -0.925 34.0 31.7-138.0 157.5 62.1 48.6 13.3 467 140 B S S > S- 0 0 66 -2,-0.3 3,-1.5 1,-0.2 0, 0.0 0.087 93.0 -71.5 83.5 167.6 59.7 46.2 15.2 468 141 B E T 3 S+ 0 0 167 1,-0.3 -1,-0.2 4,-0.0 4,-0.1 0.527 125.9 69.8 -68.4 -8.8 60.0 44.6 18.6 469 142 B H T 3 S+ 0 0 155 -3,-0.3 2,-0.3 2,-0.1 -1,-0.3 0.376 97.7 55.2 -90.8 -2.0 62.8 42.4 17.2 470 143 B X S < S- 0 0 84 -3,-1.5 -5,-0.1 -5,-0.0 -53,-0.0 -0.925 90.5 -97.0-130.8 155.5 65.3 45.2 16.9 471 144 B V - 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