==== 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 TRANSFERASE 31-JAN-05 1YQ1 . COMPND 2 MOLECULE: GLUTATHIONE S-TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS; . AUTHOR SOUTHEAST COLLABORATORY FOR STRUCTURAL GENOMICS (SECSG) . 402 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19636.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 288 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 4.5 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 . 2 0.5 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 . 20 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 185 46.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 1 0 2 0 1 1 3 1 0 0 2 0 0 0 0 0 1 0 0 1 1 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 1 1 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 1 0 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 X 0 0 214 0, 0.0 57,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 111.8 11.7 24.5 113.6 2 2 A P - 0 0 77 0, 0.0 2,-0.4 0, 0.0 56,-0.0 -0.033 360.0-134.9 -50.2 151.1 13.3 22.4 110.8 3 3 A S - 0 0 54 26,-0.0 55,-1.3 2,-0.0 2,-0.8 -0.894 4.0-136.9-114.1 142.8 12.1 23.1 107.2 4 4 A Y E +A 57 0A 43 24,-0.4 26,-2.3 -2,-0.4 2,-0.3 -0.803 28.4 175.5-103.3 99.3 11.2 20.6 104.5 5 5 A K E -Ab 56 30A 64 51,-2.3 51,-2.9 -2,-0.8 2,-0.4 -0.744 15.9-164.3-102.7 148.5 12.6 21.4 101.1 6 6 A L E -Ab 55 31A 0 24,-1.9 26,-3.2 -2,-0.3 2,-0.5 -0.996 8.1-158.7-128.8 122.2 12.5 19.4 97.9 7 7 A T E +Ab 54 32A 23 47,-2.0 47,-1.6 -2,-0.4 2,-0.3 -0.908 37.7 117.3-104.1 128.2 14.8 20.3 95.1 8 8 A Y E - b 0 33A 12 24,-1.3 26,-2.4 -2,-0.5 -2,-0.1 -0.971 57.6 -65.9-174.8 172.2 13.8 19.1 91.6 9 9 A F E - b 0 34A 35 24,-0.3 26,-0.2 -2,-0.3 24,-0.1 -0.182 45.8-102.6 -76.6 165.2 12.7 20.2 88.1 10 10 A F S S+ 0 0 119 24,-1.0 -1,-0.1 23,-0.0 25,-0.1 0.777 98.9 73.2 -53.1 -31.1 9.7 22.1 86.8 11 11 A F S S- 0 0 98 1,-0.1 4,-0.2 4,-0.0 5,-0.1 -0.299 89.8-110.7 -88.9 171.2 8.1 18.9 85.5 12 12 A R S >> S+ 0 0 54 3,-0.1 4,-2.6 1,-0.1 3,-0.6 0.965 70.0 126.5 -60.0 -59.2 6.5 15.9 87.2 13 13 A G T 34 S- 0 0 32 1,-0.2 -1,-0.1 2,-0.2 152,-0.1 0.068 86.1 -24.9 38.9-133.7 9.2 13.4 86.4 14 14 A L T 34 S+ 0 0 49 1,-0.2 4,-0.3 2,-0.1 -1,-0.2 0.671 135.6 58.0 -82.7 -22.4 10.6 11.4 89.4 15 15 A G T X> S+ 0 0 0 -3,-0.6 4,-1.7 -4,-0.2 3,-1.2 0.759 80.3 85.0 -84.3 -23.4 9.8 14.0 92.0 16 16 A E H 3X S+ 0 0 3 -4,-2.6 4,-3.0 1,-0.3 5,-0.2 0.825 85.9 54.2 -47.6 -45.5 6.0 14.2 91.5 17 17 A P H 3> S+ 0 0 6 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.854 107.2 53.2 -61.3 -30.5 5.1 11.2 93.7 18 18 A I H <> S+ 0 0 0 -3,-1.2 4,-2.1 -4,-0.3 -2,-0.2 0.901 109.4 48.3 -68.3 -40.0 7.1 12.9 96.5 19 19 A R H X S+ 0 0 7 -4,-1.7 4,-1.5 1,-0.2 5,-0.2 0.949 109.0 52.7 -63.6 -48.2 5.0 16.1 96.0 20 20 A L H X S+ 0 0 1 -4,-3.0 4,-2.8 1,-0.2 -1,-0.2 0.821 109.0 53.1 -56.3 -30.9 1.8 14.0 96.0 21 21 A L H X S+ 0 0 0 -4,-1.4 4,-2.5 -5,-0.2 5,-0.3 0.932 103.3 52.1 -71.4 -50.0 3.0 12.6 99.3 22 22 A F H X>S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 5,-0.8 0.808 118.9 39.7 -57.4 -31.2 3.7 15.8 101.2 23 23 A H H <5S+ 0 0 60 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.941 112.3 52.3 -82.3 -55.4 0.1 16.9 100.2 24 24 A L H <5S+ 0 0 13 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.819 119.2 40.8 -48.6 -32.0 -1.6 13.6 100.7 25 25 A A H <5S- 0 0 36 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.909 105.0-132.5 -84.2 -46.9 0.0 13.7 104.2 26 26 A G T <5 + 0 0 62 -4,-1.8 2,-0.3 1,-0.4 -3,-0.2 0.507 53.7 142.5 105.4 7.0 -0.5 17.3 104.9 27 27 A V < - 0 0 40 -5,-0.8 -1,-0.4 -6,-0.3 2,-0.4 -0.673 53.7-115.6 -85.7 140.0 2.9 18.2 106.0 28 28 A Q + 0 0 184 -2,-0.3 -24,-0.4 -3,-0.1 2,-0.3 -0.590 44.9 158.8 -77.4 125.6 4.2 21.6 105.0 29 29 A F - 0 0 30 -2,-0.4 2,-0.4 -26,-0.1 -24,-0.2 -0.985 31.3-129.7-146.2 155.3 7.2 21.7 102.6 30 30 A E E -b 5 0A 107 -26,-2.3 -24,-1.9 -2,-0.3 2,-0.4 -0.887 19.3-136.0-111.7 138.5 8.8 24.1 100.1 31 31 A E E -b 6 0A 57 -2,-0.4 2,-0.6 -26,-0.2 -24,-0.2 -0.752 10.0-165.2 -97.8 135.7 9.8 23.4 96.5 32 32 A V E -b 7 0A 38 -26,-3.2 -24,-1.3 -2,-0.4 -1,-0.0 -0.650 18.4-159.9-113.6 71.5 13.0 24.4 94.8 33 33 A R E -b 8 0A 116 -2,-0.6 2,-0.3 -26,-0.2 -24,-0.3 -0.287 10.4-150.9 -52.8 132.2 12.2 23.9 91.1 34 34 A X E -b 9 0A 62 -26,-2.4 -24,-1.0 5,-0.0 3,-0.1 -0.837 16.1-114.7-110.0 147.4 15.4 23.6 89.2 35 35 A N >> - 0 0 63 -2,-0.3 3,-1.5 1,-0.2 4,-1.1 -0.687 19.7-168.7 -83.7 111.4 15.9 24.5 85.6 36 36 A P T 34 S+ 0 0 60 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.791 93.7 51.8 -67.6 -23.5 16.8 21.4 83.6 37 37 A D T 34 S+ 0 0 146 1,-0.2 -2,-0.1 -3,-0.1 0, 0.0 -0.056 119.6 32.9-100.0 29.8 17.7 23.7 80.8 38 38 A Q T <4 S+ 0 0 98 -3,-1.5 2,-0.3 2,-0.0 -1,-0.2 0.353 70.4 143.4-162.7 -0.5 20.0 25.8 83.0 39 39 A T < - 0 0 55 -4,-1.1 2,-0.4 1,-0.1 -5,-0.0 -0.331 49.6-131.9 -56.0 112.5 21.7 23.6 85.6 40 40 A W >> - 0 0 176 -2,-0.3 3,-3.8 1,-0.1 4,-1.2 -0.560 17.7-121.8 -72.0 123.2 25.2 25.0 86.0 41 41 A L H 3> S+ 0 0 121 -2,-0.4 4,-1.8 1,-0.3 3,-0.2 0.753 110.9 48.7 -29.1 -52.5 27.6 22.1 85.8 42 42 A D H 3> S+ 0 0 126 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.635 104.0 61.1 -72.3 -13.3 29.1 22.8 89.3 43 43 A I H <4 S+ 0 0 91 -3,-3.8 -1,-0.2 2,-0.2 -2,-0.2 0.893 106.4 46.0 -76.1 -42.9 25.7 23.0 90.8 44 44 A K H >< S+ 0 0 90 -4,-1.2 3,-1.7 1,-0.2 -2,-0.2 0.914 107.7 58.6 -63.7 -44.4 25.0 19.4 89.8 45 45 A D H 3< S+ 0 0 87 -4,-1.8 5,-0.3 1,-0.3 -1,-0.2 0.832 101.7 53.7 -56.7 -37.3 28.4 18.3 91.1 46 46 A S T 3< S+ 0 0 93 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.148 83.5 108.8 -87.8 20.3 27.7 19.5 94.7 47 47 A T S X S- 0 0 22 -3,-1.7 3,-3.5 1,-0.1 5,-0.0 -0.840 88.0-103.5 -98.2 135.6 24.5 17.6 95.0 48 48 A P T 3 S+ 0 0 34 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.663 116.4 4.6 -20.8 -54.0 24.6 14.6 97.4 49 49 A X T 3 S- 0 0 5 2,-0.4 -3,-0.1 14,-0.1 -4,-0.1 -0.284 112.0-100.0-134.3 43.5 24.8 12.0 94.6 50 50 A K S < S+ 0 0 41 -3,-3.5 2,-0.3 -5,-0.3 -5,-0.1 0.773 93.8 89.5 37.6 46.7 25.0 14.5 91.7 51 51 A Q - 0 0 93 -7,-0.1 -2,-0.4 2,-0.1 -1,-0.1 -0.960 67.3 -88.4-165.9 146.2 21.2 14.2 91.0 52 52 A L S S+ 0 0 22 -2,-0.3 13,-0.2 -4,-0.1 -44,-0.2 -0.619 78.5 60.6 -95.8 161.1 17.8 15.5 91.8 53 53 A P - 0 0 1 0, 0.0 2,-0.4 0, 0.0 -45,-0.2 0.550 61.7-177.8 -79.5 168.2 15.4 15.3 93.6 54 54 A V E -A 7 0A 4 -47,-1.6 -47,-2.0 -2,-0.1 2,-0.3 -0.986 19.2-141.9-137.6 123.6 16.8 16.1 97.0 55 55 A L E -AC 6 62A 0 7,-2.4 7,-1.7 -2,-0.4 2,-0.4 -0.662 18.1-168.2 -83.2 139.8 14.9 16.1 100.3 56 56 A N E +AC 5 61A 13 -51,-2.9 -51,-2.3 -2,-0.3 5,-0.2 -0.999 20.3 169.8-131.4 125.7 16.0 18.7 102.7 57 57 A I E S-A 4 0A 23 3,-1.4 -53,-0.2 -2,-0.4 4,-0.1 -0.661 84.4 -46.7-131.9 68.6 14.9 18.7 106.3 58 58 A D S S- 0 0 91 -55,-1.3 3,-0.1 -2,-0.2 -54,-0.1 0.999 121.5 -27.8 66.5 76.5 17.2 21.5 107.5 59 59 A G S S+ 0 0 80 1,-0.2 2,-0.4 -56,-0.1 -1,-0.1 0.868 111.6 114.6 55.8 35.1 20.6 20.8 106.2 60 60 A F - 0 0 48 2,-0.0 -3,-1.4 -5,-0.0 2,-0.4 -0.990 52.3-159.8-130.3 126.0 19.9 17.0 106.1 61 61 A E E -C 56 0A 86 -2,-0.4 -5,-0.2 -5,-0.2 -7,-0.0 -0.922 19.0-169.9-121.2 144.5 19.8 15.7 102.6 62 62 A L E -C 55 0A 0 -7,-1.7 -7,-2.4 -2,-0.4 6,-0.1 -0.946 7.4-165.4-130.1 109.5 18.3 12.6 101.0 63 63 A P + 0 0 2 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.243 55.1 78.3 -78.2 7.2 19.4 11.9 97.3 64 64 A Q > - 0 0 15 1,-0.2 4,-4.4 226,-0.1 5,-0.4 -0.956 62.0-144.6-128.9 135.2 17.0 9.3 95.9 65 65 A S H > S+ 0 0 4 -2,-0.4 4,-2.8 1,-0.2 -1,-0.2 0.947 111.7 38.2 -49.1 -50.8 13.4 9.5 94.6 66 66 A G H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.879 117.9 48.2 -68.7 -39.7 12.8 6.1 96.2 67 67 A A H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.952 114.3 48.1 -64.5 -47.8 14.9 6.7 99.3 68 68 A I H X S+ 0 0 0 -4,-4.4 4,-2.3 2,-0.2 5,-0.3 0.917 112.3 48.8 -59.2 -47.1 13.1 10.0 99.7 69 69 A L H X S+ 0 0 1 -4,-2.8 4,-3.8 -5,-0.4 5,-0.3 0.990 115.0 41.6 -57.6 -63.6 9.6 8.4 99.2 70 70 A R H X S+ 0 0 3 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.885 114.1 55.0 -51.0 -44.2 10.1 5.5 101.7 71 71 A Y H X S+ 0 0 14 -4,-2.9 4,-1.9 -5,-0.3 -1,-0.2 0.972 118.8 30.9 -53.8 -60.2 11.8 7.8 104.1 72 72 A L H X S+ 0 0 0 -4,-2.3 4,-4.1 1,-0.2 5,-0.4 0.970 115.4 59.2 -62.9 -56.5 8.9 10.3 104.3 73 73 A A H X>S+ 0 0 0 -4,-3.8 5,-2.9 -5,-0.3 4,-1.0 0.820 108.4 47.2 -43.3 -39.4 6.3 7.8 103.6 74 74 A R H ><5S+ 0 0 59 -4,-2.4 3,-0.5 -5,-0.3 -1,-0.3 0.960 116.2 43.1 -68.0 -50.5 7.4 6.0 106.8 75 75 A K H 3<5S+ 0 0 97 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.866 120.3 43.9 -60.5 -39.0 7.5 9.2 108.8 76 76 A F H 3<5S- 0 0 35 -4,-4.1 -1,-0.2 -5,-0.1 -2,-0.2 0.558 114.6-113.8 -85.7 -10.7 4.2 10.3 107.3 77 77 A G T <<5S+ 0 0 59 -4,-1.0 -3,-0.2 -3,-0.5 -4,-0.1 0.828 86.2 102.5 85.0 33.2 2.4 6.9 107.6 78 78 A F < + 0 0 32 -5,-2.9 76,-2.9 -6,-0.1 77,-0.3 -0.100 48.1 96.5-136.6 35.8 1.9 5.7 104.0 79 79 A A S S- 0 0 5 -6,-0.6 10,-0.2 1,-0.4 11,-0.2 0.582 101.9 -78.6 -97.7 -14.4 4.6 3.2 103.6 80 80 A G - 0 0 18 -7,-0.2 -1,-0.4 72,-0.2 6,-0.1 -0.359 38.3-107.3 126.1 153.1 2.4 0.2 104.4 81 81 A K S S+ 0 0 117 -2,-0.2 -2,-0.1 -3,-0.1 -1,-0.0 0.979 92.5 33.9 -74.7 -82.7 1.0 -1.1 107.7 82 82 A T S > S- 0 0 66 1,-0.1 4,-2.7 4,-0.0 3,-0.2 -0.317 88.8-108.7 -72.6 158.4 2.6 -4.4 108.7 83 83 A P H > S+ 0 0 62 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.830 122.9 52.0 -57.3 -31.6 6.3 -5.0 107.9 84 84 A E H > S+ 0 0 65 2,-0.2 4,-1.1 1,-0.2 5,-0.1 0.868 108.9 49.1 -72.8 -37.1 5.1 -7.5 105.3 85 85 A E H > S+ 0 0 46 -3,-0.2 4,-2.0 2,-0.2 3,-0.5 0.930 110.4 51.0 -67.4 -44.8 2.8 -5.0 103.8 86 86 A E H X S+ 0 0 19 -4,-2.7 4,-2.9 1,-0.3 5,-0.2 0.914 105.3 56.4 -55.7 -47.0 5.6 -2.4 103.6 87 87 A A H X S+ 0 0 3 -4,-1.9 4,-1.6 1,-0.2 -1,-0.3 0.816 107.9 49.4 -57.1 -31.6 7.9 -5.0 101.9 88 88 A W H X S+ 0 0 31 -4,-1.1 4,-3.3 -3,-0.5 5,-0.3 0.882 107.3 51.9 -77.5 -36.6 5.3 -5.3 99.2 89 89 A V H X S+ 0 0 0 -4,-2.0 4,-2.4 -10,-0.2 -2,-0.2 0.944 111.3 49.6 -60.3 -44.9 4.9 -1.6 98.8 90 90 A D H X S+ 0 0 5 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.878 112.9 48.0 -58.6 -39.5 8.7 -1.6 98.3 91 91 A A H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.910 109.5 48.9 -70.2 -44.9 8.3 -4.4 95.9 92 92 A V H X S+ 0 0 1 -4,-3.3 4,-2.3 1,-0.2 -2,-0.2 0.890 111.5 53.9 -64.2 -33.5 5.6 -2.8 93.8 93 93 A H H X S+ 0 0 2 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.930 106.8 49.2 -63.9 -46.4 7.8 0.3 93.8 94 94 A D H X S+ 0 0 15 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.891 109.9 53.4 -58.3 -40.6 10.8 -1.7 92.4 95 95 A L H X S+ 0 0 16 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.956 106.4 50.9 -59.7 -52.0 8.5 -3.1 89.8 96 96 A F H X S+ 0 0 16 -4,-2.3 4,-4.3 1,-0.2 -1,-0.2 0.915 111.1 50.4 -49.9 -47.1 7.4 0.3 88.7 97 97 A K H X S+ 0 0 45 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.927 108.1 50.2 -60.3 -48.5 11.1 1.3 88.4 98 98 A D H X S+ 0 0 78 -4,-2.8 4,-0.7 1,-0.2 -1,-0.2 0.932 116.4 44.5 -56.2 -44.1 11.9 -1.8 86.3 99 99 A F H >X S+ 0 0 6 -4,-3.0 3,-2.2 2,-0.2 4,-2.1 0.954 106.7 57.5 -64.3 -52.8 9.0 -0.8 84.1 100 100 A L H 3X S+ 0 0 20 -4,-4.3 4,-2.3 1,-0.3 5,-0.3 0.930 101.6 57.8 -43.0 -53.2 9.9 2.9 84.1 101 101 A A H 3X S+ 0 0 49 -4,-2.6 4,-1.6 1,-0.2 -1,-0.3 0.791 107.3 48.5 -49.9 -29.7 13.3 1.9 82.6 102 102 A E H X S+ 0 0 10 -4,-2.1 4,-2.8 1,-0.2 3,-1.0 0.882 109.7 47.0 -52.3 -44.4 9.2 3.2 79.1 104 104 A K H 3X S+ 0 0 110 -4,-2.3 4,-2.6 1,-0.3 5,-0.3 0.974 105.8 59.7 -61.3 -51.2 12.2 5.5 78.7 105 105 A K H 3X S+ 0 0 87 -4,-1.6 4,-0.5 -5,-0.3 -1,-0.3 0.643 115.0 38.0 -49.9 -16.6 13.7 2.8 76.5 106 106 A F H < S+ 0 0 64 -4,-2.6 3,-1.4 -5,-0.3 -1,-0.3 0.975 114.2 36.5 -60.3 -59.2 13.6 7.4 73.3 109 109 A E H >< S+ 0 0 74 -4,-0.5 3,-0.6 -5,-0.3 -2,-0.2 0.637 102.2 79.1 -69.7 -14.9 13.2 5.2 70.3 110 110 A R T 3< S+ 0 0 128 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.560 112.1 18.4 -71.6 -8.5 9.7 6.6 69.8 111 111 A R T < S+ 0 0 189 -3,-1.4 2,-0.6 -5,-0.3 -1,-0.2 0.119 95.1 111.0-150.3 26.7 11.3 9.7 68.2 112 112 A S < 0 0 59 -3,-0.6 -4,-0.0 1,-0.1 0, 0.0 -0.926 360.0 360.0-107.3 116.1 14.8 8.7 67.2 113 113 A G 0 0 90 -2,-0.6 -1,-0.1 -3,-0.0 0, 0.0 0.459 360.0 360.0 80.3 360.0 15.3 8.5 63.4 114 ! 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 0.0 115 118 A E 0 0 145 0, 0.0 2,-1.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 69.9 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B L S S+ 0 0 14 -2,-0.3 13,-0.2 11,-0.1 2,-0.2 -0.555 78.9 65.7 -95.4 166.1 13.0 -14.3 90.8 256 53 B P + 0 0 1 0, 0.0 11,-0.9 0, 0.0 2,-0.3 0.623 59.7 174.0 -79.2 174.1 14.3 -14.0 93.4 257 54 B V E -EF 210 266B 6 -47,-1.3 -47,-2.5 9,-0.2 2,-0.3 -0.971 20.0-144.0-147.0 130.2 11.5 -14.6 95.8 258 55 B L E -EF 209 265B 0 7,-3.3 7,-2.6 -2,-0.3 2,-0.4 -0.713 12.0-169.2 -95.1 146.0 11.6 -15.0 99.5 259 56 B N E +EF 208 264B 33 -51,-2.5 -51,-3.1 -2,-0.3 2,-0.4 -0.993 8.3 174.5-136.9 123.3 9.4 -17.3 101.5 260 57 B I E > S-EF 207 263B 10 3,-2.0 3,-1.4 -2,-0.4 -53,-0.2 -0.874 74.9 -40.0-135.1 102.0 9.1 -17.2 105.3 261 58 B D T 3 S- 0 0 105 -55,-1.2 2,-1.2 -2,-0.4 3,-0.1 0.955 127.2 -36.3 43.9 67.5 6.6 -19.5 106.8 262 59 B G T 3 S+ 0 0 60 1,-0.2 -1,-0.3 0, 0.0 0, 0.0 -0.299 109.8 118.2 88.6 -54.8 4.1 -18.8 104.1 263 60 B F E < -F 260 0B 44 -3,-1.4 -3,-2.0 -2,-1.2 2,-0.4 -0.201 50.1-154.7 -50.8 134.6 4.8 -15.1 103.4 264 61 B E E +F 259 0B 92 -5,-0.2 -5,-0.2 -3,-0.1 -1,-0.1 -0.965 14.6 178.9-119.8 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104.6 275 72 B L H X S+ 0 0 0 -4,-2.1 4,-3.5 2,-0.2 5,-0.4 0.946 116.2 53.4 -76.3 -54.7 15.7 -9.2 105.9 276 73 B A H <>S+ 0 0 0 -4,-2.9 5,-4.7 -5,-0.3 6,-0.8 0.855 110.3 53.5 -48.9 -34.5 18.3 -6.5 106.5 277 74 B R H <5S+ 0 0 78 -4,-2.3 3,-0.4 -5,-0.3 -1,-0.3 0.931 113.6 38.5 -67.5 -48.2 15.5 -4.8 108.5 278 75 B K H <5S+ 0 0 96 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.1 0.961 119.9 45.9 -68.1 -50.7 14.8 -7.8 110.7 279 76 B F T <5S- 0 0 37 -4,-3.5 -1,-0.2 -5,-0.1 -2,-0.2 0.447 116.6-115.8 -73.3 1.2 18.5 -8.8 111.0 280 77 B G T 5S+ 0 0 48 -3,-0.4 -3,-0.2 -5,-0.4 -4,-0.1 0.923 84.6 113.4 67.1 44.6 19.3 -5.2 111.7 281 78 B F < + 0 0 35 -5,-4.7 76,-2.3 -6,-0.2 -4,-0.2 -0.048 51.4 87.1-133.1 29.6 21.5 -4.5 108.7 282 79 B A S S- 0 0 5 -6,-0.8 11,-0.2 1,-0.3 10,-0.2 0.635 105.5 -49.1-100.0 -23.6 19.1 -2.0 107.1 283 80 B G - 0 0 23 -7,-0.3 -1,-0.3 72,-0.1 69,-0.1 -0.607 37.6-117.1 154.4 145.1 20.4 1.1 108.9 284 81 B K S S+ 0 0 124 -2,-0.2 -1,-0.1 -3,-0.1 68,-0.0 0.593 97.6 9.9 -78.5 -11.0 21.3 2.4 112.4 285 82 B T S > S- 0 0 47 -3,-0.1 4,-2.9 1,-0.0 5,-0.2 -0.964 87.0 -94.5-157.9 164.2 18.6 5.1 112.4 286 83 B P H > S+ 0 0 74 0, 0.0 4,-1.1 0, 0.0 -212,-0.1 0.817 125.8 45.6 -53.7 -31.9 15.6 6.2 110.3 287 84 B E H > S+ 0 0 67 2,-0.2 4,-1.1 1,-0.1 5,-0.1 0.828 112.1 47.4 -84.1 -34.4 17.9 8.6 108.4 288 85 B E H > S+ 0 0 65 2,-0.2 4,-2.6 1,-0.2 3,-0.4 0.910 107.7 58.9 -71.4 -41.3 20.8 6.3 107.9 289 86 B E H X S+ 0 0 34 -4,-2.9 4,-3.1 1,-0.3 5,-0.2 0.927 103.3 51.6 -50.8 -47.4 18.4 3.7 106.7 290 87 B A H X S+ 0 0 2 -4,-1.1 4,-1.1 1,-0.2 -1,-0.3 0.851 108.6 50.8 -62.1 -33.0 17.2 6.1 103.9 291 88 B W H X S+ 0 0 48 -4,-1.1 4,-3.5 -3,-0.4 5,-0.3 0.879 107.4 53.2 -71.6 -36.3 20.9 6.6 102.9 292 89 B V H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.3 5,-0.3 0.998 111.1 45.8 -57.6 -58.4 21.3 2.8 102.7 293 90 B D H X S+ 0 0 7 -4,-3.1 4,-1.7 -11,-0.2 -1,-0.3 0.797 113.5 54.8 -51.5 -26.3 18.2 2.9 100.5 294 91 B A H X S+ 0 0 0 -4,-1.1 4,-2.3 -5,-0.2 -2,-0.2 0.973 108.3 41.7 -73.5 -58.0 20.0 5.8 98.7 295 92 B V H X S+ 0 0 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2,-1.4 1,-0.3 3,-0.7 0.850 111.9 53.2 -39.4 -47.3 28.1 -5.5 79.1 311 108 B A T 3< S+ 0 0 79 -4,-2.8 -1,-0.3 -5,-0.3 -4,-0.0 -0.597 114.7 38.3 -92.8 72.7 25.2 -6.3 76.8 312 109 B E T >4 S+ 0 0 64 -2,-1.4 3,-0.7 -3,-0.2 4,-0.4 0.232 89.4 83.6 168.7 -9.7 26.5 -4.3 73.8 313 110 B R T << S+ 0 0 82 -4,-0.8 -2,-0.1 -3,-0.7 -3,-0.1 0.356 96.6 49.1 -91.7 3.6 30.3 -5.0 73.8 314 111 B R T 3 S+ 0 0 182 -4,-0.1 -1,-0.2 1,-0.0 -4,-0.0 -0.072 88.5 90.9-128.6 27.7 29.5 -8.3 71.9 315 112 B S < 0 0 94 -3,-0.7 -2,-0.1 1,-0.3 -4,-0.0 0.918 360.0 360.0 -88.5 -57.2 27.3 -6.7 69.3 316 113 B G 0 0 65 -4,-0.4 -1,-0.3 2,-0.1 4,-0.1 -0.933 360.0 360.0-140.2 360.0 29.7 -5.8 66.5 317 ! 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 0.0 318 118 B E 0 0 168 0, 0.0 2,-0.7 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 88.1 35.8 -3.0 65.2 319 119 B V + 0 0 124 1,-0.1 3,-0.1 2,-0.1 0, 0.0 -0.764 360.0 159.8 -88.4 117.5 36.8 -0.4 67.7 320 120 B E > + 0 0 83 -2,-0.7 3,-0.8 1,-0.1 4,-0.2 -0.223 28.9 124.7-132.2 44.5 33.8 0.5 69.8 321 121 B K T 3 + 0 0 131 1,-0.2 -1,-0.1 2,-0.2 -2,-0.1 0.379 64.0 84.8 -80.8 4.8 35.4 2.1 72.9 322 122 B F T > S+ 0 0 128 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.898 91.0 41.5 -69.9 -44.1 33.1 4.8 71.8 323 123 B R T X> S+ 0 0 32 -3,-0.8 4,-0.8 1,-0.3 3,-0.5 0.557 102.3 71.2 -79.3 -7.3 30.2 3.2 73.7 324 124 B S H 3> S+ 0 0 10 1,-0.2 4,-0.7 -4,-0.2 -1,-0.3 0.196 87.9 69.7 -88.1 12.8 32.9 2.6 76.3 325 125 B E H <4 S+ 0 0 90 -3,-1.2 -1,-0.2 2,-0.1 -2,-0.1 -0.259 94.4 47.7-124.9 40.0 32.4 6.4 76.7 326 126 B F H <> S+ 0 0 87 -3,-0.5 4,-1.7 -21,-0.1 -2,-0.2 0.248 118.2 43.3-138.7 -40.4 29.0 6.4 78.2 327 127 B F H X S+ 0 0 1 -4,-0.8 4,-4.8 2,-0.2 5,-0.4 0.949 110.9 49.4 -76.6 -58.0 30.0 3.8 80.7 328 128 B L H X S+ 0 0 47 -4,-0.7 4,-2.7 1,-0.2 5,-0.2 0.918 115.4 46.9 -52.4 -44.0 33.4 5.0 81.8 329 129 B P H > S+ 0 0 61 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.975 118.5 41.0 -62.0 -51.2 31.9 8.4 82.4 330 130 B A H X S+ 0 0 27 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.938 115.5 49.6 -60.1 -51.3 28.9 6.9 84.3 331 131 B R H X S+ 0 0 22 -4,-4.8 4,-2.9 1,-0.2 -1,-0.2 0.931 111.6 51.8 -53.5 -46.1 31.0 4.4 86.1 332 132 B N H X S+ 0 0 72 -4,-2.7 4,-2.0 -5,-0.4 -2,-0.2 0.930 110.1 45.1 -57.5 -52.9 33.4 7.2 87.1 333 133 B T H >X S+ 0 0 59 -4,-2.5 4,-2.3 1,-0.2 3,-0.9 0.980 113.0 53.1 -55.7 -55.1 30.7 9.5 88.5 334 134 B Y H 3X S+ 0 0 8 -4,-2.9 4,-1.9 1,-0.3 -2,-0.2 0.892 109.7 48.3 -43.6 -50.5 29.2 6.4 90.3 335 135 B F H 3X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 -1,-0.3 0.806 108.4 54.7 -63.3 -32.3 32.7 5.7 91.8 336 136 B N H > - 0 0 7 -2,-0.2 3,-2.2 -74,-0.1 4,-1.1 -0.885 47.0 -95.0-130.8 163.0 24.6 -2.7 105.8 357 157 B F H 3> S+ 0 0 0 -76,-2.3 4,-1.4 -2,-0.3 -75,-0.1 0.499 119.9 69.5 -59.6 3.0 23.1 -4.3 102.8 358 158 B A H 3> S+ 0 0 0 -77,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.822 94.8 51.5 -87.4 -33.5 24.5 -1.4 100.8 359 159 B D H <> S+ 0 0 0 -3,-2.2 4,-2.1 2,-0.2 5,-0.2 0.902 113.6 45.6 -67.0 -43.0 28.1 -2.5 101.3 360 160 B L H >X S+ 0 0 2 -4,-1.1 4,-2.4 2,-0.2 3,-0.8 1.000 111.4 50.0 -60.5 -70.9 27.1 -6.0 100.0 361 161 B V H 3< S+ 0 0 3 -4,-1.4 4,-0.4 1,-0.3 -1,-0.2 0.758 115.4 45.5 -36.9 -38.4 25.1 -4.8 97.0 362 162 B V H 3X S+ 0 0 1 -4,-1.7 4,-0.6 2,-0.1 -1,-0.3 0.871 116.0 41.5 -80.3 -39.6 28.0 -2.5 96.0 363 163 B V H XX S+ 0 0 4 -4,-2.1 4,-2.1 -3,-0.8 3,-1.4 0.933 104.7 61.0 -76.8 -46.3 30.9 -4.9 96.4 364 164 B D H 3X S+ 0 0 8 -4,-2.4 4,-1.5 1,-0.3 -1,-0.2 0.831 110.5 47.9 -48.0 -28.7 29.3 -8.0 94.9 365 165 B N H 3> S+ 0 0 5 -5,-0.4 4,-2.5 -4,-0.4 -1,-0.3 0.730 101.2 60.0 -83.4 -26.5 29.1 -5.7 91.9 366 166 B L H <>S+ 0 0 0 -4,-2.5 5,-2.2 2,-0.2 3,-0.9 0.970 108.9 48.9 -60.8 -50.8 32.8 -5.4 87.5 370 170 B K H ><5S+ 0 0 81 -4,-2.6 3,-2.6 1,-0.3 5,-0.3 0.938 108.6 53.0 -50.5 -55.1 36.3 -6.8 88.2 371 171 B N H 3<5S+ 0 0 112 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.727 105.7 52.9 -57.6 -25.7 35.6 -9.9 86.1 372 172 B Y T <<5S- 0 0 100 -4,-1.4 -1,-0.3 -3,-0.9 -2,-0.2 0.261 119.6-114.2 -92.0 12.9 34.5 -7.8 83.1 373 173 B G T < 5S+ 0 0 63 -3,-2.6 -3,-0.2 2,-0.1 -2,-0.2 0.895 87.7 116.5 57.1 43.4 37.8 -6.1 83.5 374 174 B L < + 0 0 21 -5,-2.2 2,-0.3 1,-0.2 -4,-0.2 0.251 63.2 61.1-120.7 5.5 36.1 -2.8 84.4 375 175 B F - 0 0 9 -6,-0.4 2,-0.9 -5,-0.3 -1,-0.2 -0.838 59.8-169.0-139.6 101.9 37.5 -2.5 88.0 376 176 B D > - 0 0 90 -2,-0.3 4,-1.4 1,-0.2 8,-0.1 -0.797 13.5-153.9 -90.1 106.9 41.2 -2.2 88.6 377 177 B E T 4 S+ 0 0 58 -2,-0.9 7,-0.3 1,-0.2 -1,-0.2 0.806 90.6 62.8 -49.0 -31.3 41.7 -2.7 92.4 378 178 B S T 4 S+ 0 0 89 1,-0.2 -1,-0.2 -3,-0.1 6,-0.1 0.990 101.5 43.0 -55.9 -74.7 44.9 -0.6 91.9 379 179 B E T 4 S+ 0 0 141 1,-0.2 2,-0.8 2,-0.1 -1,-0.2 0.721 113.4 56.8 -46.2 -31.8 43.5 2.7 90.7 380 180 B F X + 0 0 29 -4,-1.4 4,-1.6 1,-0.2 -1,-0.2 -0.744 59.9 162.8-109.7 84.0 40.7 2.6 93.3 381 181 B T H > S+ 0 0 102 -2,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.952 73.9 51.5 -62.5 -51.0 42.4 2.2 96.6 382 182 B K H > S+ 0 0 83 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.915 112.6 40.9 -55.4 -55.3 39.3 3.3 98.6 383 183 B L H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.893 110.8 60.9 -62.4 -37.9 36.7 0.9 97.1 384 184 B A H X S+ 0 0 16 -4,-1.6 4,-2.3 -7,-0.3 -1,-0.2 0.948 102.9 50.9 -50.6 -52.2 39.4 -1.8 97.2 385 185 B A H X S+ 0 0 56 -4,-2.3 4,-3.2 1,-0.2 -1,-0.2 0.881 109.8 49.5 -53.0 -46.5 39.5 -1.4 100.9 386 186 B L H X S+ 0 0 4 -4,-1.6 4,-2.9 2,-0.2 5,-0.3 0.924 108.3 51.2 -59.6 -51.4 35.7 -1.7 101.3 387 187 B R H X S+ 0 0 43 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.905 114.5 46.4 -52.4 -44.0 35.5 -4.9 99.2 388 188 B E H X S+ 0 0 121 -4,-2.3 4,-2.1 -5,-0.3 5,-0.3 0.959 110.3 53.1 -63.5 -50.7 38.2 -6.2 101.4 389 189 B K H < S+ 0 0 87 -4,-3.2 4,-0.5 1,-0.2 -2,-0.2 0.864 114.6 39.7 -55.3 -41.8 36.4 -5.1 104.5 390 190 B V H < S+ 0 0 3 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.756 112.6 54.4 -82.3 -25.8 33.2 -6.8 103.7 391 191 B N H < S+ 0 0 40 -4,-1.8 -2,-0.2 -5,-0.3 9,-0.2 0.860 112.0 43.9 -74.5 -38.7 34.6 -10.0 102.2 392 192 B S S < S+ 0 0 39 -4,-2.1 -1,-0.2 -5,-0.2 5,-0.2 0.627 87.2 119.8 -80.3 -15.8 36.7 -10.7 105.4 393 193 B Y S >> S- 0 0 47 -4,-0.5 4,-1.7 -5,-0.3 3,-1.6 -0.292 79.0 -97.0 -54.6 126.9 33.7 -9.8 107.6 394 194 B P T 34 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.116 110.0 26.5 -48.9 137.0 32.7 -12.8 109.7 395 195 B G T 3> S+ 0 0 20 -3,-0.1 4,-1.0 -167,-0.1 -168,-0.1 -0.298 122.4 56.4 101.7 -44.9 29.9 -14.9 108.3 396 196 B I H <> S+ 0 0 3 -3,-1.6 4,-3.4 2,-0.2 5,-0.4 0.819 97.6 59.0 -86.6 -36.4 30.8 -13.8 104.8 397 197 B K H X S+ 0 0 114 -4,-1.7 4,-1.0 1,-0.2 -1,-0.1 0.952 110.5 43.6 -58.2 -47.8 34.4 -15.0 104.9 398 198 B E H > S+ 0 0 112 2,-0.2 4,-1.5 -5,-0.2 -1,-0.2 0.909 118.7 45.6 -62.0 -43.6 33.2 -18.5 105.6 399 199 B Y H X S+ 0 0 30 -4,-1.0 4,-1.0 1,-0.2 -2,-0.2 0.995 110.5 48.6 -63.4 -64.4 30.5 -18.2 103.0 400 200 B I H < S+ 0 0 44 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.759 107.5 67.5 -48.5 -21.8 32.5 -16.6 100.2 401 201 B A H < S+ 0 0 68 -4,-1.0 -2,-0.2 -5,-0.4 -1,-0.2 0.998 109.0 26.3 -61.6 -72.9 34.9 -19.5 101.1 402 202 B K H < S+ 0 0 190 -4,-1.5 -1,-0.2 -3,-0.1 -2,-0.2 0.339 95.0 129.4 -75.4 7.5 32.8 -22.5 100.0 403 203 B R S < S- 0 0 29 -4,-1.0 2,-1.1 -5,-0.1 -3,-0.0 -0.483 74.2-108.0 -69.2 123.2 31.0 -20.3 97.4 404 204 B P 0 0 116 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.336 360.0 360.0 -56.5 92.6 31.0 -21.8 93.9 405 205 B V 0 0 176 -2,-1.1 -2,-0.0 -4,-0.2 -5,-0.0 -0.135 360.0 360.0 -45.9 360.0 33.5 -19.4 92.4