==== 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 HYDROLASE 21-SEP-07 2RD9 . COMPND 2 MOLECULE: BH0186 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS HALODURANS C-125; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 747 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31525.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 523 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 4.0 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 . 4 0.5 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 . 14 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 106 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 342 45.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.9 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 7 1 0 0 1 1 0 4 0 0 4 0 0 0 0 3 0 0 4 0 0 4 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 1 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 -14 A K 0 0 174 0, 0.0 658,-2.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 116.0 61.5 5.5 97.0 2 -13 A I E -A 658 0A 87 656,-0.2 2,-0.3 657,-0.0 656,-0.2 -0.818 360.0-143.3-118.9 153.5 64.7 7.7 96.9 3 -12 A H E -A 657 0A 43 654,-2.9 654,-2.7 -2,-0.3 2,-0.3 -0.863 20.2-118.5-113.3 156.7 68.2 7.5 98.4 4 -11 A H E -A 656 0A 93 -2,-0.3 2,-0.5 652,-0.2 3,-0.5 -0.663 17.1-124.7 -92.5 148.5 70.4 10.3 99.7 5 -10 A H S S- 0 0 7 650,-0.5 649,-0.2 -2,-0.3 4,-0.2 -0.782 93.0 -13.6 -86.9 126.2 73.9 11.4 98.5 6 -9 A H S > S- 0 0 16 -2,-0.5 3,-1.9 1,-0.1 4,-0.3 0.915 84.1-169.3 47.6 55.5 76.5 11.4 101.2 7 -8 A H T 3 S+ 0 0 96 555,-1.9 3,-0.3 -3,-0.5 -2,-0.1 0.826 74.1 28.0 -51.8 -44.6 73.6 11.1 103.8 8 -7 A H T > S+ 0 0 32 1,-0.2 3,-1.9 2,-0.1 4,-0.3 0.105 76.5 122.5-113.6 23.5 75.6 11.7 107.0 9 -6 A E G X S+ 0 0 4 -3,-1.9 3,-1.9 1,-0.3 -1,-0.2 0.895 74.8 58.1 -40.8 -47.6 78.5 13.9 105.7 10 -5 A N G 3 S+ 0 0 79 -3,-0.3 -1,-0.3 -4,-0.3 3,-0.2 0.576 94.8 64.8 -70.7 -9.5 77.4 16.6 108.2 11 -4 A L G < S+ 0 0 97 -3,-1.9 2,-0.5 1,-0.2 -1,-0.3 0.521 86.5 77.5 -85.7 -6.1 77.8 14.3 111.2 12 -3 A Y < + 0 0 22 -3,-1.9 544,-0.5 -4,-0.3 2,-0.3 -0.390 62.3 96.3-111.1 58.3 81.5 14.0 110.7 13 -2 A F - 0 0 107 -2,-0.5 2,-0.2 -3,-0.2 -1,-0.1 -0.735 56.5-163.0-145.1 89.2 83.0 17.2 112.0 14 -1 A Q - 0 0 46 -2,-0.3 2,-0.1 1,-0.1 3,-0.1 -0.498 0.9-158.0 -85.6 139.8 84.3 16.8 115.6 15 0 A G - 0 0 44 -2,-0.2 346,-0.4 1,-0.1 2,-0.4 -0.114 40.5 -59.4 -95.0-165.3 85.0 19.6 118.0 16 1 A X + 0 0 102 345,-0.1 -1,-0.1 1,-0.1 343,-0.1 -0.677 44.0 171.2 -83.8 129.2 87.2 19.8 121.1 17 2 A N + 0 0 50 -2,-0.4 -1,-0.1 341,-0.3 342,-0.1 0.430 31.5 129.8-116.2 -2.2 86.4 17.5 124.0 18 3 A F + 0 0 19 340,-0.1 2,-0.3 4,-0.0 3,-0.1 -0.330 25.3 171.4 -58.2 125.8 89.4 18.0 126.4 19 4 A Q > - 0 0 92 1,-0.1 4,-2.0 -2,-0.1 5,-0.2 -0.979 32.4-135.3-129.0 141.4 88.5 18.8 130.0 20 5 A X H > S+ 0 0 42 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.905 103.1 46.8 -65.9 -47.4 91.3 18.9 132.5 21 6 A N H > S+ 0 0 97 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.889 114.3 47.9 -58.8 -42.9 89.6 16.8 135.3 22 7 A E H > S+ 0 0 19 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.826 110.6 52.3 -70.2 -34.6 88.5 14.2 132.8 23 8 A A H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.927 110.1 48.1 -64.5 -46.2 92.0 14.0 131.3 24 9 A I H X S+ 0 0 20 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.793 102.5 63.1 -67.6 -34.7 93.5 13.4 134.7 25 10 A Q H X S+ 0 0 31 -4,-1.7 4,-0.7 2,-0.2 -1,-0.2 0.920 110.2 39.8 -51.4 -50.4 91.0 10.7 135.6 26 11 A L H >X S+ 0 0 4 -4,-1.3 4,-1.2 2,-0.2 3,-1.0 0.943 114.4 50.8 -66.7 -50.1 92.3 8.6 132.7 27 12 A L H 3< S+ 0 0 1 -4,-2.2 3,-0.2 1,-0.3 -2,-0.2 0.839 109.5 52.4 -60.2 -32.7 96.0 9.4 133.2 28 13 A E H 3< S+ 0 0 79 -4,-2.1 4,-0.3 1,-0.2 -1,-0.3 0.746 111.2 47.7 -75.0 -19.8 95.8 8.5 136.9 29 14 A R H S+ 0 0 3 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.947 115.3 43.7 -59.5 -48.8 99.2 2.2 135.7 32 17 A K H > S+ 0 0 90 -4,-0.3 4,-2.5 1,-0.2 5,-0.2 0.872 112.9 53.4 -65.8 -36.9 96.8 0.4 138.0 33 18 A T H X S+ 0 0 5 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.915 111.1 45.7 -59.6 -46.1 94.7 -0.8 134.9 34 19 A L H X S+ 0 0 2 -4,-2.5 4,-2.6 -5,-0.2 5,-0.3 0.921 114.2 49.3 -68.2 -39.6 97.8 -2.2 133.2 35 20 A E H X S+ 0 0 55 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.921 111.9 45.5 -63.5 -45.4 99.0 -3.9 136.4 36 21 A V H < S+ 0 0 20 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.867 118.5 46.2 -69.2 -29.9 95.6 -5.5 137.3 37 22 A F H < S+ 0 0 5 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.900 127.7 21.7 -73.1 -44.2 95.4 -6.7 133.6 38 23 A L H >< S+ 0 0 0 -4,-2.6 3,-1.4 -5,-0.2 2,-0.3 0.613 88.8 109.9-108.3 -19.3 98.9 -8.0 133.2 39 24 A E T 3< S+ 0 0 65 -4,-2.3 3,-0.1 -5,-0.3 -4,-0.0 -0.495 92.9 7.0 -69.0 124.9 100.3 -8.9 136.6 40 25 A G T 3 S+ 0 0 50 1,-0.3 -1,-0.3 -2,-0.3 2,-0.1 0.412 92.8 133.3 82.2 -0.0 100.7 -12.6 137.2 41 26 A L S < S- 0 0 9 -3,-1.4 -1,-0.3 1,-0.1 172,-0.1 -0.437 71.1 -84.1 -65.4 156.4 99.8 -13.6 133.6 42 27 A S >> - 0 0 29 1,-0.1 3,-1.4 171,-0.1 4,-1.1 -0.247 36.7-113.3 -54.8 150.4 102.1 -16.1 132.0 43 28 A D H 3> S+ 0 0 96 1,-0.3 4,-1.7 2,-0.2 5,-0.2 0.777 114.4 71.5 -60.0 -26.5 105.3 -14.7 130.5 44 29 A S H 34 S+ 0 0 42 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.811 96.6 48.2 -54.4 -40.8 103.8 -15.9 127.1 45 30 A W H X4 S+ 0 0 0 -3,-1.4 3,-0.8 1,-0.2 12,-0.3 0.864 110.7 51.4 -69.8 -36.4 101.2 -13.1 127.3 46 31 A H H 3< S+ 0 0 10 -4,-1.1 12,-2.4 1,-0.2 13,-0.3 0.761 110.6 48.8 -72.3 -27.8 103.9 -10.5 128.1 47 32 A Q T 3< S+ 0 0 68 -4,-1.7 -1,-0.2 10,-0.2 2,-0.2 0.352 86.0 111.4 -93.8 4.1 106.1 -11.6 125.1 48 33 A C < + 0 0 13 -3,-0.8 9,-1.6 -4,-0.2 2,-0.2 -0.560 40.7 172.8 -84.2 150.1 103.4 -11.5 122.5 49 34 A N - 0 0 52 119,-0.3 7,-0.1 7,-0.2 3,-0.1 -0.646 47.7 -96.3-134.8-173.4 103.4 -8.9 119.8 50 35 A E S S- 0 0 52 1,-0.4 2,-0.2 5,-0.3 5,-0.1 0.062 83.7 -76.5 -99.1 20.7 101.5 -8.1 116.6 51 36 A G S > S+ 0 0 15 3,-0.2 3,-1.7 4,-0.1 -1,-0.4 -0.569 87.3 3.3 116.4-176.0 104.1 -9.8 114.4 52 37 A Y T 3 S+ 0 0 91 1,-0.3 3,-0.1 -2,-0.2 147,-0.0 -0.098 126.5 3.6 -48.3 133.6 107.6 -9.3 113.0 53 38 A E T 3 S+ 0 0 149 1,-0.2 2,-0.3 -4,-0.0 -1,-0.3 0.649 100.9 117.8 58.6 25.9 109.3 -6.1 114.1 54 39 A T < - 0 0 28 -3,-1.7 -1,-0.2 1,-0.0 -3,-0.2 -0.854 69.1 -97.1-114.0 158.2 106.5 -5.0 116.5 55 40 A W - 0 0 57 -2,-0.3 -5,-0.3 -3,-0.1 2,-0.1 -0.390 29.9-120.6 -77.8 147.7 107.0 -4.6 120.2 56 41 A T > - 0 0 18 -7,-0.1 4,-1.9 -2,-0.1 -7,-0.2 -0.364 31.9-106.0 -74.2 160.7 106.1 -7.1 122.9 57 42 A V H > S+ 0 0 0 -9,-1.6 4,-2.0 -12,-0.3 3,-0.4 0.942 124.9 53.0 -50.8 -47.9 103.6 -6.3 125.6 58 43 A Y H > S+ 0 0 8 -12,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.915 107.3 50.8 -51.6 -52.3 106.6 -6.0 128.0 59 44 A E H > S+ 0 0 88 -13,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.775 106.3 54.9 -61.5 -31.5 108.3 -3.5 125.6 60 45 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 -3,-0.4 -1,-0.2 0.920 109.2 47.4 -68.3 -43.1 105.2 -1.4 125.4 61 46 A V H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.936 111.3 50.9 -61.3 -45.9 105.2 -1.1 129.2 62 47 A V H X S+ 0 0 20 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.927 111.3 50.3 -55.9 -42.9 109.0 -0.3 129.2 63 48 A H H X S+ 0 0 9 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.869 105.2 54.2 -65.8 -39.0 108.2 2.5 126.5 64 49 A L H X S+ 0 0 0 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.870 107.5 52.2 -64.5 -35.8 105.4 4.0 128.6 65 50 A I H X S+ 0 0 0 -4,-1.8 4,-1.0 2,-0.2 3,-0.5 0.943 108.3 50.8 -61.0 -46.8 107.9 4.3 131.4 66 51 A E H >X S+ 0 0 17 -4,-1.9 4,-2.6 1,-0.2 3,-0.7 0.877 105.1 56.0 -58.7 -41.8 110.3 6.1 129.1 67 52 A A H 3X>S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.3 5,-1.0 0.824 103.8 55.8 -59.7 -34.0 107.6 8.5 128.0 68 53 A E H 3<5S+ 0 0 6 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.771 116.1 36.1 -68.7 -28.2 107.1 9.4 131.7 69 54 A K H <<5S+ 0 0 106 -4,-1.0 -2,-0.2 -3,-0.7 -1,-0.2 0.802 132.7 21.7 -88.1 -34.1 110.9 10.3 131.9 70 55 A T H <5S+ 0 0 29 -4,-2.6 -3,-0.2 -5,-0.1 -2,-0.2 0.651 119.1 34.3-115.8 -21.0 111.5 11.9 128.5 71 56 A N T X5S+ 0 0 0 -4,-1.7 4,-1.9 -5,-0.3 5,-0.2 0.870 101.9 33.0-112.1 -80.8 108.3 13.1 126.8 72 57 A W H > S+ 0 0 8 -6,-0.3 4,-2.9 2,-0.2 5,-0.2 0.907 116.5 53.4 -72.7 -44.9 106.3 16.7 131.4 74 59 A P H > S+ 0 0 52 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.863 113.8 45.3 -57.8 -34.7 109.7 17.8 130.0 75 60 A R H X S+ 0 0 8 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.876 110.5 53.3 -73.6 -39.8 107.8 19.2 126.9 76 61 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 5,-0.2 0.944 109.4 48.7 -56.2 -50.6 105.2 20.8 129.1 77 62 A R H X S+ 0 0 123 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.897 111.7 49.7 -54.3 -44.7 107.9 22.6 131.2 78 63 A F H X>S+ 0 0 48 -4,-1.4 4,-3.1 -5,-0.2 5,-0.6 0.892 110.4 49.9 -63.4 -41.8 109.6 23.8 128.0 79 64 A I H X5S+ 0 0 1 -4,-2.5 4,-1.8 3,-0.2 -2,-0.2 0.945 114.1 44.3 -63.1 -47.6 106.3 25.1 126.5 80 65 A L H <5S+ 0 0 23 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.868 123.1 36.2 -69.5 -36.2 105.5 27.0 129.7 81 66 A Q H <5S+ 0 0 158 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.897 130.2 26.0 -80.9 -46.9 109.0 28.4 130.1 82 67 A E H ><5S- 0 0 45 -4,-3.1 3,-0.9 -5,-0.2 4,-0.2 0.707 83.2-172.0 -95.9 -21.8 110.1 29.1 126.5 83 68 A G G ><< - 0 0 19 -4,-1.8 3,-0.6 -5,-0.6 55,-0.6 -0.264 61.4 -34.9 56.9-148.2 106.8 29.6 124.7 84 69 A E G 3 S+ 0 0 101 53,-0.3 -1,-0.2 52,-0.2 53,-0.1 0.510 118.0 89.2 -84.8 -9.6 107.0 29.8 120.8 85 70 A H G < S+ 0 0 179 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.792 100.1 22.7 -50.4 -34.1 110.3 31.6 120.8 86 71 A K S < S- 0 0 106 -3,-0.6 52,-0.5 -4,-0.2 2,-0.2 -1.000 82.2-125.0-146.0 126.5 112.2 28.3 120.7 87 72 A P B -b 138 0B 70 0, 0.0 52,-0.2 0, 0.0 3,-0.1 -0.556 31.3-113.7 -77.0 145.9 111.0 24.9 119.5 88 73 A F - 0 0 2 50,-2.1 -13,-0.1 -2,-0.2 49,-0.0 -0.456 47.7 -87.0 -71.5 151.2 111.3 22.0 122.0 89 74 A P - 0 0 85 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.237 33.3-122.1 -60.7 144.4 113.8 19.4 120.9 90 75 A A > - 0 0 19 -3,-0.1 3,-0.6 1,-0.1 480,-0.1 -0.474 26.0-121.0 -68.1 161.8 112.9 16.4 118.6 91 76 A F G > S+ 0 0 16 478,-0.4 3,-1.3 1,-0.2 477,-0.4 0.599 94.4 85.0 -83.7 -11.0 113.6 13.1 120.2 92 77 A D G 3 S+ 0 0 65 1,-0.3 -1,-0.2 478,-0.2 3,-0.1 0.365 84.0 56.0 -80.9 6.6 116.1 11.9 117.6 93 78 A R G < S+ 0 0 220 -3,-0.6 2,-0.4 1,-0.2 -1,-0.3 0.325 97.2 64.8-117.0 5.6 119.2 13.5 119.0 94 79 A F S < S- 0 0 150 -3,-1.3 474,-0.4 474,-0.1 -1,-0.2 -0.927 73.1-159.0-134.0 104.1 119.1 12.1 122.5 95 80 A S - 0 0 58 -2,-0.4 2,-0.3 472,-0.1 472,-0.2 -0.385 2.9-152.9 -86.8 162.6 119.6 8.3 122.7 96 81 A H E -D 566 0C 41 470,-2.7 470,-2.3 -2,-0.1 2,-0.2 -0.985 25.6-105.1-131.9 148.8 118.6 5.8 125.4 97 82 A L E -D 565 0C 137 -2,-0.3 468,-0.2 468,-0.2 2,-0.2 -0.470 38.1-114.8 -67.4 133.3 120.1 2.5 126.4 98 83 A N - 0 0 80 466,-2.3 2,-0.2 -2,-0.2 -1,-0.1 -0.513 40.1-132.3 -60.5 137.5 118.0 -0.5 125.3 99 84 A Q - 0 0 93 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.599 14.5 -98.1-102.7 162.6 116.8 -2.2 128.5 100 85 A S > - 0 0 69 -2,-0.2 3,-0.8 1,-0.1 -1,-0.1 -0.571 11.2-152.3 -77.7 128.2 116.8 -5.8 129.7 101 86 A N T 3 S+ 0 0 78 -2,-0.3 -1,-0.1 1,-0.2 4,-0.1 0.464 89.5 82.1 -64.4 -6.0 113.6 -7.8 129.3 102 87 A A T 3 + 0 0 82 2,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.715 62.7 98.7 -78.6 -21.4 115.0 -9.7 132.3 103 88 A V S < S- 0 0 44 -3,-0.8 5,-0.1 1,-0.1 -4,-0.0 -0.488 91.5-103.9 -61.9 126.4 113.7 -7.2 134.9 104 89 A P >> - 0 0 67 0, 0.0 3,-1.8 0, 0.0 4,-1.0 -0.318 20.1-127.7 -59.6 138.1 110.5 -8.6 136.2 105 90 A I H 3> S+ 0 0 17 1,-0.3 4,-2.1 2,-0.2 3,-0.3 0.824 107.3 68.0 -56.2 -31.4 107.4 -6.9 134.8 106 91 A S H 3> S+ 0 0 52 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.867 99.0 51.7 -55.4 -35.9 106.2 -6.4 138.4 107 92 A E H <> S+ 0 0 112 -3,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.869 106.1 53.5 -67.9 -37.3 109.1 -3.9 138.9 108 93 A R H X S+ 0 0 7 -4,-1.0 4,-2.6 -3,-0.3 -2,-0.2 0.879 107.4 51.0 -64.1 -41.8 108.1 -2.0 135.7 109 94 A F H X S+ 0 0 3 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.849 109.5 50.0 -64.4 -38.9 104.6 -1.6 137.0 110 95 A K H X S+ 0 0 170 -4,-1.5 4,-2.1 -5,-0.2 -2,-0.2 0.937 113.3 46.5 -64.5 -46.1 105.8 -0.2 140.3 111 96 A E H X S+ 0 0 64 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.908 111.9 50.7 -61.4 -44.9 108.1 2.2 138.4 112 97 A F H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.892 111.2 48.0 -62.4 -41.6 105.3 3.3 136.0 113 98 A Q H X S+ 0 0 66 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.900 113.2 48.5 -67.0 -41.5 102.9 4.0 138.8 114 99 A Q H X S+ 0 0 89 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.930 114.1 44.8 -63.4 -46.5 105.5 6.0 140.8 115 100 A L H X S+ 0 0 27 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.874 114.1 49.3 -68.8 -37.8 106.5 8.1 137.8 116 101 A R H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 5,-0.2 0.909 109.6 51.8 -66.3 -41.9 102.9 8.7 136.7 117 102 A K H X S+ 0 0 122 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.954 113.0 44.7 -60.0 -52.1 102.0 9.8 140.3 118 103 A E H X S+ 0 0 87 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.910 112.1 53.2 -52.4 -47.4 104.9 12.3 140.4 119 104 A N H X S+ 0 0 16 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.799 105.3 52.8 -65.3 -32.5 104.1 13.5 136.9 120 105 A L H X S+ 0 0 7 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.850 108.2 51.5 -73.0 -34.5 100.4 14.3 137.7 121 106 A N H X S+ 0 0 84 -4,-1.6 4,-1.6 -5,-0.2 -2,-0.2 0.970 111.4 47.2 -59.6 -53.8 101.6 16.3 140.8 122 107 A T H X S+ 0 0 29 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.897 108.8 55.5 -51.5 -44.7 103.9 18.3 138.5 123 108 A L H X S+ 0 0 2 -4,-2.1 4,-3.4 1,-0.2 -1,-0.2 0.934 108.5 47.4 -56.9 -46.2 101.1 18.8 135.9 124 109 A R H < S+ 0 0 101 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.775 111.7 51.3 -67.6 -29.1 98.8 20.3 138.6 125 110 A S H < S+ 0 0 81 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.900 119.6 34.9 -68.2 -44.6 101.7 22.6 139.7 126 111 A L H < S+ 0 0 50 -4,-2.6 2,-0.8 1,-0.2 -2,-0.2 0.873 118.3 48.0 -82.9 -43.2 102.4 23.8 136.2 127 112 A V < + 0 0 6 -4,-3.4 -1,-0.2 -5,-0.3 3,-0.1 -0.857 62.4 145.6-105.6 101.2 98.9 23.9 134.7 128 113 A Q + 0 0 156 -2,-0.8 2,-0.3 -3,-0.1 -1,-0.2 0.631 57.9 36.0-113.2 -19.7 96.6 25.7 137.2 129 114 A S S >> S- 0 0 53 1,-0.1 4,-0.8 0, 0.0 3,-0.7 -0.907 78.6-111.7-132.5 159.7 94.1 27.6 135.0 130 115 A E H >> S+ 0 0 144 -2,-0.3 4,-0.7 1,-0.2 3,-0.5 0.806 118.4 63.0 -51.5 -37.9 92.2 27.2 131.8 131 116 A A H >4 S+ 0 0 66 1,-0.2 3,-0.9 2,-0.2 4,-0.3 0.881 96.1 58.4 -58.2 -35.6 94.4 30.1 130.5 132 117 A D H X4 S+ 0 0 28 -3,-0.7 3,-0.7 1,-0.3 15,-0.2 0.786 98.6 59.3 -67.0 -27.5 97.5 27.8 131.0 133 118 A L H << S+ 0 0 7 -4,-0.8 15,-2.2 -3,-0.5 14,-0.4 0.760 100.5 55.5 -66.9 -29.3 95.9 25.3 128.6 134 119 A E T << S+ 0 0 93 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.413 81.8 121.3 -89.1 1.2 95.8 27.9 125.8 135 120 A R < - 0 0 103 -3,-0.7 12,-2.1 -4,-0.3 2,-0.4 -0.452 53.2-144.3 -69.9 136.9 99.5 28.5 126.1 136 121 A T E + C 0 146B 39 10,-0.2 10,-0.2 -2,-0.2 -52,-0.2 -0.821 24.7 165.8-114.5 140.8 101.5 27.8 123.0 137 122 A G E - C 0 145B 0 8,-2.7 8,-2.2 -2,-0.4 2,-0.5 -0.617 37.2 -95.8-128.3-163.0 104.9 26.5 122.2 138 123 A A E -bC 87 144B 15 -55,-0.6 -50,-2.1 -52,-0.5 6,-0.2 -0.965 17.4-150.9-133.7 111.1 106.7 25.2 119.1 139 124 A H E > - C 0 143B 5 4,-2.7 4,-1.6 -2,-0.5 -49,-0.1 -0.637 29.0-124.1 -73.5 135.4 107.0 21.6 117.9 140 125 A P T 4 S+ 0 0 51 0, 0.0 -1,-0.1 0, 0.0 -50,-0.1 0.714 104.5 13.6 -62.4 -17.3 110.2 21.3 115.8 141 126 A A T 4 S+ 0 0 35 2,-0.1 432,-0.0 434,-0.0 -2,-0.0 0.672 128.2 49.3-119.6 -40.4 108.2 20.0 112.8 142 127 A F T 4 S- 0 0 12 1,-0.2 2,-0.2 433,-0.0 435,-0.1 0.626 92.0-143.3 -82.4 -15.1 104.5 20.6 113.4 143 128 A G E < +C 139 0B 32 -4,-1.6 -4,-2.7 2,-0.0 -1,-0.2 -0.570 60.9 22.0 87.5-152.4 104.7 24.3 114.4 144 129 A V E +C 138 0B 72 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.250 66.8 178.0 -59.1 130.0 102.6 26.0 117.1 145 130 A V E -C 137 0B 0 -8,-2.2 -8,-2.7 219,-0.1 2,-0.3 -0.976 19.3-134.9-130.9 148.7 101.1 23.6 119.6 146 131 A K E > -C 136 0B 53 -2,-0.3 4,-1.7 -10,-0.2 3,-0.4 -0.667 23.7-117.3 -97.5 156.7 98.9 24.3 122.7 147 132 A V H > S+ 0 0 0 -12,-2.1 4,-2.6 -14,-0.4 5,-0.2 0.911 117.0 55.8 -56.1 -45.1 99.3 22.9 126.2 148 133 A R H > S+ 0 0 39 -15,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.814 104.9 53.7 -59.5 -31.8 95.8 21.2 125.8 149 134 A E H > S+ 0 0 18 -3,-0.4 4,-2.3 -16,-0.3 -1,-0.2 0.889 109.9 46.1 -72.1 -39.4 97.1 19.5 122.6 150 135 A L H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.899 115.5 46.9 -63.4 -43.7 100.1 18.0 124.5 151 136 A L H X S+ 0 0 3 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.889 113.5 48.3 -68.2 -37.8 97.9 16.9 127.3 152 137 A S H X S+ 0 0 0 -4,-2.3 4,-2.2 210,-0.3 211,-0.2 0.910 109.9 51.5 -67.7 -42.9 95.4 15.4 124.9 153 138 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 209,-0.2 -1,-0.2 0.868 107.0 56.0 -59.6 -36.8 98.1 13.7 123.0 154 139 A W H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.919 108.0 46.7 -59.1 -50.1 99.3 12.2 126.4 155 140 A V H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.927 114.5 46.8 -59.9 -47.4 95.9 10.7 127.1 156 141 A V H X S+ 0 0 11 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.811 106.0 59.4 -64.7 -38.2 95.7 9.2 123.7 157 142 A H H X S+ 0 0 4 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.943 107.0 47.5 -52.4 -52.6 99.2 7.9 123.9 158 143 A D H X S+ 0 0 2 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.957 115.6 44.2 -51.3 -54.3 98.2 5.9 126.9 159 144 A L H X S+ 0 0 3 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.887 111.1 53.2 -64.8 -40.4 95.0 4.6 125.2 160 145 A T H X S+ 0 0 27 -4,-2.9 4,-1.5 2,-0.2 -1,-0.2 0.893 112.3 45.3 -62.7 -41.1 96.8 3.8 121.9 161 146 A H H X S+ 0 0 6 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.863 108.6 55.3 -74.4 -35.2 99.4 1.7 123.7 162 147 A I H X S+ 0 0 8 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.930 109.9 49.0 -52.4 -47.9 96.8 -0.1 125.8 163 148 A A H X S+ 0 0 4 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.834 107.8 53.4 -65.0 -36.6 95.1 -1.0 122.5 164 149 A Q H X S+ 0 0 0 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.901 109.5 48.3 -63.4 -42.4 98.5 -2.2 121.2 165 150 A I H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.966 113.6 47.1 -61.6 -51.4 98.9 -4.5 124.2 166 151 A V H X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.885 112.6 49.2 -57.8 -44.7 95.3 -5.9 123.8 167 152 A R H X S+ 0 0 76 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.849 108.4 53.4 -64.5 -38.2 95.8 -6.5 120.1 168 153 A S H X S+ 0 0 0 -4,-1.9 4,-1.1 2,-0.2 -119,-0.3 0.905 111.0 46.4 -62.8 -43.5 99.1 -8.3 120.6 169 154 A X H >< S+ 0 0 1 -4,-1.9 3,-0.6 1,-0.2 4,-0.3 0.949 111.9 50.6 -64.3 -47.4 97.5 -10.6 123.1 170 155 A A H >< S+ 0 0 17 -4,-2.5 3,-1.9 1,-0.2 -2,-0.2 0.868 102.3 62.7 -54.1 -40.1 94.4 -11.3 120.8 171 156 A K H >< S+ 0 0 31 -4,-2.0 3,-2.3 1,-0.3 4,-0.3 0.841 85.4 74.0 -63.1 -33.0 96.8 -12.0 117.9 172 157 A R T << S+ 0 0 33 -4,-1.1 36,-0.4 -3,-0.6 -1,-0.3 0.763 99.8 45.4 -46.8 -29.9 98.2 -15.0 119.7 173 158 A Y T <> S+ 0 0 1 -3,-1.9 4,-2.4 -4,-0.3 -1,-0.3 0.162 73.2 119.0-108.8 19.2 94.9 -16.9 119.0 174 159 A D T <4 S+ 0 0 39 -3,-2.3 4,-0.2 1,-0.2 -1,-0.2 0.881 89.8 30.4 -48.7 -49.7 94.5 -16.0 115.3 175 160 A T T >4 S+ 0 0 56 31,-0.5 3,-1.7 -4,-0.3 -1,-0.2 0.882 115.4 62.7 -78.8 -40.2 94.7 -19.7 114.2 176 161 A D T 34 S+ 0 0 1 30,-0.4 162,-0.2 1,-0.3 163,-0.2 0.802 93.6 60.5 -53.8 -37.3 93.1 -20.9 117.5 177 162 A V T >< S- 0 0 2 -4,-2.4 3,-1.9 1,-0.2 -1,-0.3 0.638 84.2-177.0 -71.4 -12.8 89.7 -19.1 117.0 178 163 A G G X + 0 0 24 -3,-1.7 3,-1.7 1,-0.3 -1,-0.2 -0.268 66.1 6.2 53.7-126.2 89.3 -21.2 113.7 179 164 A P G 3 S+ 0 0 25 0, 0.0 4,-0.5 0, 0.0 3,-0.4 0.621 121.8 71.1 -69.2 -8.7 86.1 -20.2 111.9 180 165 A W G <> S+ 0 0 5 -3,-1.9 4,-2.1 1,-0.2 5,-0.2 0.604 72.2 93.2 -75.9 -13.1 85.4 -17.3 114.3 181 166 A K H <> S+ 0 0 105 -3,-1.7 4,-0.6 1,-0.2 -1,-0.2 0.901 85.0 44.5 -50.7 -53.4 88.3 -15.3 112.9 182 167 A E H >4 S+ 0 0 59 -3,-0.4 3,-1.5 1,-0.2 -1,-0.2 0.963 114.3 47.3 -60.4 -51.4 86.3 -13.3 110.3 183 168 A Y H >4 S+ 0 0 6 -4,-0.5 3,-2.2 202,-0.4 -1,-0.2 0.820 101.4 65.6 -63.8 -26.2 83.3 -12.4 112.6 184 169 A L H 3< S+ 0 0 22 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.652 97.5 57.3 -72.9 -14.3 85.7 -11.3 115.4 185 170 A G T << S+ 0 0 60 -3,-1.5 2,-0.6 -4,-0.6 -1,-0.3 0.431 92.1 86.1 -84.2 -2.2 86.8 -8.5 113.1 186 171 A I < - 0 0 55 -3,-2.2 3,-0.2 -4,-0.2 2,-0.1 -0.893 61.5-174.8-108.3 114.8 83.1 -7.3 112.8 187 172 A L + 0 0 46 -2,-0.6 -2,-0.0 1,-0.2 160,-0.0 -0.469 54.2 36.0-104.5 170.2 81.9 -4.9 115.5 188 173 A N 0 0 44 -2,-0.1 -1,-0.2 1,-0.1 63,-0.0 0.882 360.0 360.0 59.7 44.8 78.6 -3.2 116.5 189 174 A D 0 0 32 -3,-0.2 191,-1.9 191,-0.0 192,-0.1 0.416 360.0 360.0-148.1 360.0 76.6 -6.3 115.6 190 !* 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 0.0 191 -15 B D 0 0 190 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 137.0 126.2 -2.6 96.2 192 -14 B K + 0 0 138 279,-0.1 279,-2.7 278,-0.0 2,-0.2 -0.532 360.0 165.3 -89.6 131.4 122.6 -2.2 97.2 193 -13 B I E -E 470 0D 63 -2,-0.3 2,-0.3 277,-0.3 277,-0.2 -0.773 16.0-164.0-135.9 166.7 120.2 -5.2 97.1 194 -12 B H E -E 469 0D 58 275,-2.2 275,-2.7 -2,-0.2 2,-0.4 -0.957 19.1-121.2-149.7 167.6 116.8 -6.3 98.3 195 -11 B H > - 0 0 42 -2,-0.3 3,-0.7 273,-0.2 2,-0.3 -0.913 27.9-117.0-113.0 141.6 114.8 -9.4 98.7 196 -10 B H T 3 S- 0 0 2 271,-0.4 271,-0.1 268,-0.4 268,-0.1 -0.610 96.8 -13.3 -70.3 130.8 111.4 -10.1 97.1 197 -9 B H T > S- 0 0 12 -2,-0.3 3,-1.6 1,-0.1 267,-0.3 0.840 87.3-169.6 37.2 58.8 108.7 -10.5 99.7 198 -8 B H T < S+ 0 0 65 554,-2.0 3,-0.3 -3,-0.7 267,-0.1 0.793 71.3 31.0 -53.3 -47.2 111.5 -10.8 102.2 199 -7 B H T > S+ 0 0 33 1,-0.2 3,-1.7 -4,-0.1 4,-0.4 0.073 74.9 125.4-110.9 27.1 109.6 -11.9 105.3 200 -6 B E G X + 0 0 3 -3,-1.6 3,-1.6 1,-0.3 -1,-0.2 0.846 69.8 59.9 -48.0 -43.5 106.8 -13.9 103.8 201 -5 B N G 3 S+ 0 0 44 -3,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.696 93.9 65.0 -66.6 -20.8 107.6 -17.0 105.9 202 -4 B L G < S+ 0 0 92 -3,-1.7 2,-1.2 1,-0.2 -1,-0.3 0.635 81.6 80.2 -76.9 -13.1 107.0 -15.2 109.2 203 -3 B Y S < S+ 0 0 19 -3,-1.6 543,-0.4 -4,-0.4 2,-0.3 -0.470 73.3 89.3-102.8 64.7 103.3 -14.6 108.6 204 -2 B F - 0 0 103 -2,-1.2 2,-0.4 -3,-0.1 311,-0.0 -0.969 53.6-169.8-157.1 143.9 102.0 -18.0 109.6 205 -1 B Q - 0 0 40 -2,-0.3 2,-0.1 310,-0.1 3,-0.1 -0.995 11.2-149.0-147.4 138.1 101.0 -19.2 113.0 206 0 B G - 0 0 44 -2,-0.4 -31,-0.5 1,-0.1 2,-0.4 -0.148 49.1 -64.8 -88.7-164.5 100.1 -22.4 114.8 207 1 B X + 0 0 97 -32,-0.2 -1,-0.1 1,-0.1 -34,-0.1 -0.738 44.9 174.4 -89.5 127.3 97.8 -22.9 117.7 208 2 B N + 0 0 57 -2,-0.4 -1,-0.1 -36,-0.4 -35,-0.1 0.288 30.1 134.1-114.3 0.9 98.9 -21.2 121.0 209 3 B F + 0 0 8 -37,-0.1 2,-0.3 4,-0.1 3,-0.1 -0.362 25.4 175.5 -61.0 133.5 95.8 -22.0 123.2 210 4 B Q > - 0 0 83 1,-0.1 4,-2.5 -2,-0.0 5,-0.2 -0.987 30.5-137.2-134.9 129.8 96.6 -23.2 126.7 211 5 B X H > S+ 0 0 41 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.919 104.1 47.3 -51.5 -51.3 93.7 -23.8 129.2 212 6 B N H > S+ 0 0 85 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.891 113.9 47.4 -58.0 -43.9 95.6 -22.2 132.1 213 7 B E H > S+ 0 0 17 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.846 110.5 51.2 -70.1 -37.0 96.7 -19.2 130.1 214 8 B A H X S+ 0 0 3 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.915 109.4 51.3 -63.1 -45.4 93.2 -18.6 128.7 215 9 B I H X S+ 0 0 20 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.843 102.4 61.3 -61.9 -36.7 91.7 -18.7 132.2 216 10 B Q H X S+ 0 0 36 -4,-1.6 4,-0.6 2,-0.2 -1,-0.2 0.938 111.6 38.2 -56.1 -47.9 94.3 -16.2 133.4 217 11 B L H >X S+ 0 0 2 -4,-1.4 3,-1.6 1,-0.2 4,-1.4 0.963 115.0 51.7 -65.4 -53.4 92.9 -13.6 130.9 218 12 B L H 3< S+ 0 0 2 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.855 108.0 52.7 -57.5 -36.0 89.3 -14.5 131.3 219 13 B E H 3< S+ 0 0 73 -4,-2.5 4,-0.3 1,-0.2 -1,-0.3 0.717 111.4 47.8 -75.0 -14.9 89.5 -14.2 135.1 220 14 B R H S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.932 114.2 42.3 -61.4 -47.1 86.0 -7.8 134.8 223 17 B K H > S+ 0 0 76 -4,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.849 114.2 54.0 -65.9 -36.4 88.4 -6.3 137.4 224 18 B T H X S+ 0 0 5 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.939 110.2 45.0 -60.4 -51.5 90.4 -4.6 134.6 225 19 B L H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.2 5,-0.4 0.880 114.1 50.7 -61.4 -38.4 87.3 -2.9 133.1 226 20 B E H X S+ 0 0 71 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.941 111.9 45.3 -65.3 -49.0 86.2 -1.9 136.6 227 21 B V H < S+ 0 0 43 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.880 119.0 44.6 -59.8 -36.6 89.6 -0.3 137.6 228 22 B F H < S+ 0 0 5 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.880 127.8 22.5 -74.9 -42.8 89.7 1.4 134.2 229 23 B L H >< S+ 0 0 0 -4,-2.4 3,-2.2 -5,-0.2 -3,-0.2 0.703 89.3 109.7-105.9 -25.4 86.2 2.7 133.9 230 24 B E T 3< S+ 0 0 68 -4,-2.4 3,-0.1 -5,-0.4 -4,-0.0 -0.362 92.5 7.6 -66.8 125.7 84.8 3.0 137.5 231 25 B G T 3 S+ 0 0 54 1,-0.4 -1,-0.3 -2,-0.2 2,-0.1 0.437 93.2 136.3 84.1 0.5 84.4 6.5 138.6 232 26 B L < - 0 0 11 -3,-2.2 -1,-0.4 1,-0.1 -210,-0.1 -0.457 67.9 -90.6 -66.0 154.1 85.2 8.0 135.2 233 27 B S >> - 0 0 30 1,-0.1 3,-2.0 -2,-0.1 4,-0.9 -0.344 36.0-111.6 -64.0 148.6 82.9 10.8 134.2 234 28 B D H 3> S+ 0 0 97 1,-0.3 4,-1.5 2,-0.2 3,-0.4 0.795 113.5 73.3 -58.5 -29.5 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245 39 B T < - 0 0 29 -3,-1.1 -1,-0.2 1,-0.0 -3,-0.1 -0.888 69.1 -95.9-119.2 154.8 78.7 2.4 116.9 246 40 B W - 0 0 56 -2,-0.3 -5,-0.3 -3,-0.1 2,-0.1 -0.393 34.9-121.1 -73.7 147.6 78.1 1.2 120.4 247 41 B T > - 0 0 16 -7,-0.1 4,-2.0 1,-0.1 -7,-0.2 -0.339 28.8-105.5 -74.7 164.2 79.0 3.2 123.5 248 42 B V H > S+ 0 0 0 -9,-1.5 4,-1.8 -12,-0.3 -10,-0.2 0.900 124.0 51.4 -53.2 -46.4 81.5 2.0 126.1 249 43 B Y H > S+ 0 0 5 -12,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.933 109.3 50.0 -59.1 -44.5 78.6 1.3 128.4 250 44 B E H > S+ 0 0 77 -13,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.802 105.9 56.2 -67.2 -31.9 76.8 -0.7 125.7 251 45 B V H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.921 108.3 47.6 -65.7 -41.0 79.9 -2.7 125.1 252 46 B V H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.876 111.5 50.5 -65.4 -38.1 80.1 -3.8 128.8 253 47 B V H X S+ 0 0 45 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.911 108.7 53.1 -63.8 -41.4 76.4 -4.6 128.7 254 48 B H H X S+ 0 0 13 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.885 106.5 51.5 -61.0 -39.1 77.1 -6.7 125.6 255 49 B L H X S+ 0 0 1 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.906 109.4 50.9 -65.4 -41.1 79.9 -8.6 127.5 256 50 B I H X S+ 0 0 2 -4,-2.1 4,-1.3 2,-0.2 3,-0.3 0.915 107.5 53.5 -59.5 -45.1 77.3 -9.3 130.3 257 51 B E H X S+ 0 0 62 -4,-2.6 4,-2.8 1,-0.2 3,-0.3 0.901 106.6 51.3 -59.3 -42.4 74.9 -10.6 127.7 258 52 B A H X>S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 5,-1.0 0.798 106.0 56.3 -62.9 -31.9 77.5 -13.1 126.3 259 53 B E H <5S+ 0 0 5 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.820 114.9 39.1 -67.6 -33.1 78.1 -14.3 129.8 260 54 B K H <5S+ 0 0 116 -4,-1.3 -2,-0.2 -3,-0.3 -3,-0.1 0.911 135.1 13.4 -79.1 -46.5 74.4 -15.1 130.1 261 55 B T H <5S+ 0 0 46 -4,-2.8 -3,-0.2 -5,-0.1 -2,-0.2 0.554 119.6 44.1-115.3 -12.6 73.6 -16.5 126.7 262 56 B N T X5S+ 0 0 1 -4,-1.8 4,-1.8 -5,-0.3 5,-0.2 0.871 100.5 28.8-106.9 -83.4 76.8 -17.3 124.6 263 57 B W H > S+ 0 0 4 -6,-0.3 4,-2.7 1,-0.2 5,-0.2 0.906 115.2 53.0 -67.1 -47.4 79.0 -21.4 128.4 265 59 B P H > S+ 0 0 54 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.858 113.0 45.9 -52.6 -34.6 75.6 -22.4 126.9 266 60 B R H X S+ 0 0 11 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.826 109.6 53.9 -80.5 -34.4 77.4 -23.3 123.6 267 61 B L H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.954 110.9 46.7 -58.4 -50.5 80.1 -25.2 125.5 268 62 B R H X S+ 0 0 117 -4,-2.7 4,-2.1 1,-0.2 5,-0.2 0.858 111.3 51.9 -55.4 -42.8 77.4 -27.3 127.2 269 63 B F H X>S+ 0 0 35 -4,-1.5 4,-3.3 -5,-0.2 5,-0.7 0.919 109.4 49.0 -65.2 -44.9 75.7 -27.8 123.9 270 64 B I H X5S+ 0 0 2 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.956 116.0 43.0 -53.0 -54.3 78.9 -29.1 122.3 271 65 B L H <5S+ 0 0 25 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.801 124.0 36.1 -69.3 -27.9 79.6 -31.5 125.1 272 66 B Q H <5S+ 0 0 141 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.828 130.4 25.1 -95.2 -38.0 76.0 -32.7 125.4 273 67 B E H ><5S- 0 0 45 -4,-3.3 3,-1.4 -5,-0.2 -3,-0.2 0.673 82.2-169.4-100.2 -20.2 74.8 -32.7 121.7 274 68 B G G ><< - 0 0 20 -4,-1.9 50,-0.7 -5,-0.7 3,-0.5 -0.373 65.4 -33.4 57.4-140.4 78.0 -33.1 119.8 275 69 B E G 3 S+ 0 0 102 48,-0.3 -1,-0.2 1,-0.2 48,-0.1 0.477 117.3 93.3 -90.7 -1.8 77.6 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X S+ 0 0 5 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.864 108.2 52.0 -76.5 -30.1 84.9 -20.0 135.0 307 106 B N H X S+ 0 0 84 -4,-1.5 4,-1.4 2,-0.2 -2,-0.2 0.899 111.6 46.0 -66.5 -43.4 83.7 -22.5 137.6 308 107 B T H X S+ 0 0 30 -4,-2.0 4,-2.1 2,-0.2 3,-0.4 0.943 109.2 55.6 -61.8 -48.1 81.4 -24.1 135.1 309 108 B L H >X S+ 0 0 3 -4,-2.8 4,-2.5 1,-0.2 3,-0.6 0.951 108.5 48.6 -47.2 -53.2 84.2 -24.1 132.5 310 109 B R H 3< S+ 0 0 100 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.802 111.6 50.1 -59.1 -33.8 86.4 -26.0 135.0 311 110 B S H 3< S+ 0 0 75 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.770 117.1 38.8 -69.2 -34.4 83.6 -28.5 135.6 312 111 B L H << S+ 0 0 46 -4,-2.1 2,-0.6 -3,-0.6 -2,-0.2 0.747 115.6 47.9 -94.2 -30.4 82.9 -29.2 131.9 313 112 B V < + 0 0 9 -4,-2.5 -1,-0.2 -5,-0.3 3,-0.1 -0.907 61.2 156.6-119.2 95.1 86.5 -29.3 130.5 314 113 B Q + 0 0 151 -2,-0.6 2,-0.3 -3,-0.2 -1,-0.1 0.259 60.3 29.8-112.0 6.4 88.5 -31.5 132.8 315 114 B S S > S- 0 0 57 1,-0.1 3,-0.6 0, 0.0 4,-0.5 -0.975 75.4-115.7-158.8 161.7 91.3 -32.5 130.4 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26.0-126.4 -89.1 138.7 77.8 -24.3 114.3 326 125 B P T 4 S+ 0 0 62 0, 0.0 -1,-0.1 0, 0.0 -45,-0.0 0.788 105.1 12.6 -55.1 -29.8 74.8 -23.3 112.2 327 126 B A T 4 S+ 0 0 34 2,-0.1 56,-0.0 58,-0.0 -2,-0.0 0.710 128.4 50.3-113.1 -41.0 77.0 -21.5 109.6 328 127 B F T 4 S- 0 0 10 1,-0.3 2,-0.2 57,-0.0 -148,-0.0 0.610 90.0-146.8 -83.9 -11.1 80.6 -22.6 110.3 329 128 B G E < +G 325 0E 34 -4,-1.5 -4,-3.2 2,-0.0 -1,-0.3 -0.566 63.2 20.1 79.4-143.8 80.1 -26.3 110.5 330 129 B V E S+G 324 0E 80 -2,-0.2 2,-0.3 -6,-0.2 -6,-0.2 -0.394 70.6 179.5 -68.5 129.1 82.1 -28.5 112.8 331 130 B V E -G 323 0E 0 -8,-2.1 -8,-2.6 -2,-0.2 2,-0.2 -0.947 17.5-135.6-129.7 149.4 83.7 -26.5 115.7 332 131 B K E > -G 322 0E 71 -2,-0.3 4,-1.9 -10,-0.2 3,-0.4 -0.696 23.8-117.0-102.5 157.9 86.0 -27.7 118.5 333 132 B V H > S+ 0 0 0 -12,-2.3 4,-2.6 -15,-0.3 3,-0.3 0.960 116.7 57.5 -55.1 -48.4 85.9 -26.8 122.2 334 133 B R H > S+ 0 0 26 -15,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.826 106.5 50.1 -53.1 -35.9 89.4 -25.2 121.9 335 134 B E H > S+ 0 0 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96.0 18.6 117.0 365 164 B P G 3 S+ 0 0 32 0, 0.0 4,-0.5 0, 0.0 3,-0.4 0.584 121.3 73.9 -70.8 -9.2 99.1 17.8 114.8 366 165 B W G <> S+ 0 0 5 -3,-1.8 4,-2.6 1,-0.2 5,-0.2 0.591 70.9 94.6 -71.6 -8.9 99.9 14.7 116.9 367 166 B K T <4 S+ 0 0 104 -3,-1.7 4,-0.4 1,-0.2 -1,-0.2 0.903 85.1 41.6 -53.8 -53.5 97.0 12.9 115.2 368 167 B E T >4 S+ 0 0 58 -3,-0.4 3,-2.0 1,-0.2 -1,-0.2 0.948 115.9 48.0 -61.7 -49.5 98.9 11.2 112.4 369 168 B Y G >4 S+ 0 0 8 -4,-0.5 3,-3.0 206,-0.4 -1,-0.2 0.862 99.4 67.3 -64.1 -34.7 101.9 10.1 114.5 370 169 B L G 3< S+ 0 0 22 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.685 97.6 57.5 -57.7 -13.6 99.6 8.8 117.2 371 170 B G G < S+ 0 0 57 -3,-2.0 2,-0.6 -4,-0.4 -1,-0.3 0.443 89.3 87.9 -89.6 -0.9 98.7 6.2 114.5 372 171 B I < - 0 0 57 -3,-3.0 3,-0.3 -4,-0.1 2,-0.2 -0.888 59.6-176.7-110.8 115.0 102.3 5.1 114.1 373 172 B L + 0 0 43 -2,-0.6 -2,-0.1 1,-0.2 -212,-0.0 -0.512 56.2 34.3-107.2 167.0 103.4 2.3 116.4 374 173 B N 0 0 44 -2,-0.2 -1,-0.2 1,-0.1 -314,-0.0 0.717 360.0 360.0 61.9 27.8 106.7 0.6 117.1 375 174 B D 0 0 35 -3,-0.3 195,-1.7 195,-0.0 192,-0.2 0.547 360.0 360.0-131.2 360.0 108.8 3.8 116.4 376 !* 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 0.0 377 -11 C H > 0 0 148 0, 0.0 3,-0.9 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 123.5 69.9 -9.1 118.7 378 -10 C H T 3 - 0 0 6 1,-0.3 -96,-0.3 2,-0.1 4,-0.2 -0.625 360.0 -19.7 -78.2 125.7 73.1 -10.8 120.2 379 -9 C H T > S- 0 0 15 -2,-0.4 3,-1.8 2,-0.1 -1,-0.3 0.879 87.3-173.5 30.8 57.3 75.8 -11.2 117.5 380 -8 C H T < S+ 0 0 98 -191,-1.9 3,-0.4 -3,-0.9 -2,-0.1 0.794 71.2 31.1 -40.0 -57.8 73.0 -10.8 115.0 381 -7 C H T > S+ 0 0 31 1,-0.2 3,-1.4 -192,-0.1 -1,-0.3 -0.022 76.8 122.8-104.6 30.7 74.8 -11.5 111.8 382 -6 C E G X S+ 0 0 5 -3,-1.8 3,-1.5 1,-0.3 -1,-0.2 0.877 74.0 56.8 -55.2 -42.0 77.5 -14.0 113.0 383 -5 C N G 3 S+ 0 0 77 -3,-0.4 -1,-0.3 1,-0.3 3,-0.2 0.642 93.7 67.4 -68.4 -16.9 76.3 -16.6 110.5 384 -4 C L G < S+ 0 0 96 -3,-1.4 2,-0.7 1,-0.2 -1,-0.3 0.558 85.6 77.2 -79.4 -4.6 76.8 -14.2 107.6 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2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.869 111.3 51.0 -66.0 -38.5 87.6 -15.0 85.9 396 8 C A H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.907 109.8 49.2 -64.9 -45.2 91.1 -14.9 87.4 397 9 C I H X S+ 0 0 10 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.880 103.3 62.3 -60.3 -40.9 92.8 -14.5 84.0 398 10 C Q H X S+ 0 0 37 -4,-1.9 4,-0.6 -5,-0.2 -1,-0.2 0.887 111.2 38.9 -48.0 -47.1 90.3 -11.7 83.1 399 11 C L H >X S+ 0 0 4 -4,-1.3 4,-1.3 2,-0.2 3,-1.2 0.943 114.2 51.6 -70.9 -50.8 91.7 -9.7 86.0 400 12 C L H 3< S+ 0 0 2 -4,-2.4 3,-0.2 1,-0.3 -2,-0.2 0.856 107.6 53.9 -58.8 -37.6 95.4 -10.6 85.5 401 13 C E H 3< S+ 0 0 80 -4,-3.0 4,-0.4 1,-0.2 -1,-0.3 0.741 110.6 48.2 -68.8 -19.9 95.2 -9.7 81.8 402 14 C R H S+ 0 0 2 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.932 116.3 42.1 -59.6 -48.7 99.1 -3.7 83.2 405 17 C K H > S+ 0 0 89 -4,-0.4 4,-2.5 2,-0.2 5,-0.2 0.842 113.0 54.5 -64.4 -36.7 96.8 -1.7 80.9 406 18 C T H X S+ 0 0 4 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.922 110.0 46.0 -63.8 -43.1 94.8 -0.4 83.9 407 19 C L H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 5,-0.3 0.863 113.2 51.4 -71.3 -31.0 98.0 1.0 85.6 408 20 C E H X S+ 0 0 53 -4,-1.7 4,-2.4 -5,-0.2 -2,-0.2 0.935 110.7 45.2 -68.9 -49.3 99.1 2.4 82.3 409 21 C V H < S+ 0 0 23 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.889 119.8 44.7 -57.6 -40.4 95.9 4.3 81.5 410 22 C F H < S+ 0 0 4 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.876 127.1 23.4 -73.7 -41.0 95.8 5.5 85.2 411 23 C L H >< S+ 0 0 0 -4,-2.4 3,-1.8 -5,-0.2 -3,-0.2 0.721 89.9 105.4-108.0 -25.5 99.4 6.5 85.6 412 24 C E T 3< S+ 0 0 64 -4,-2.4 3,-0.1 -5,-0.3 -4,-0.0 -0.414 93.2 12.7 -66.2 127.6 100.9 7.3 82.2 413 25 C G T 3 S+ 0 0 44 1,-0.4 -1,-0.3 -2,-0.2 3,-0.1 0.319 93.0 132.4 88.5 -7.0 101.2 11.0 81.7 414 26 C L S < S- 0 0 11 -3,-1.8 -1,-0.4 1,-0.1 171,-0.1 -0.398 70.2 -90.0 -65.5 151.7 100.7 11.9 85.3 415 27 C S >> - 0 0 29 1,-0.1 3,-1.2 170,-0.1 4,-1.1 -0.290 35.1-113.7 -50.7 147.7 103.1 14.4 86.8 416 28 C D H 3> S+ 0 0 102 1,-0.3 4,-1.6 2,-0.2 5,-0.2 0.788 115.2 72.7 -58.5 -29.5 106.2 12.7 88.4 417 29 C S H 34 S+ 0 0 41 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.833 97.2 47.6 -47.6 -46.2 104.8 14.1 91.7 418 30 C W H X4 S+ 0 0 0 -3,-1.2 3,-1.0 1,-0.2 12,-0.3 0.882 110.3 51.8 -63.5 -42.0 102.0 11.4 91.4 419 31 C H H 3< S+ 0 0 10 -4,-1.1 12,-2.4 1,-0.2 13,-0.3 0.710 109.1 50.1 -71.8 -21.6 104.6 8.7 90.7 420 32 C Q T 3< S+ 0 0 69 -4,-1.6 -1,-0.2 10,-0.2 -2,-0.2 0.365 84.8 120.8 -97.1 0.8 106.7 9.6 93.7 421 33 C C < + 0 0 11 -3,-1.0 9,-1.5 -4,-0.2 2,-0.2 -0.393 35.4 168.2 -56.2 141.7 103.7 9.5 96.1 422 34 C N - 0 0 56 119,-0.4 7,-0.1 7,-0.2 3,-0.1 -0.802 47.4-104.1-141.0-175.6 103.9 7.1 99.0 423 35 C E S S- 0 0 55 1,-0.4 2,-0.2 5,-0.3 5,-0.1 0.003 80.0 -73.7 -99.6 27.9 102.0 6.4 102.3 424 36 C G S > S- 0 0 14 3,-0.2 3,-1.7 4,-0.1 -1,-0.4 -0.505 88.1 -1.0 111.2 177.2 104.7 8.0 104.6 425 37 C Y T 3 S+ 0 0 88 1,-0.3 3,-0.1 -2,-0.2 146,-0.0 -0.057 127.6 6.1 -44.1 131.5 108.1 7.2 105.8 426 38 C E T 3 S+ 0 0 148 1,-0.2 2,-0.3 -4,-0.0 -1,-0.3 0.671 99.6 119.2 61.9 24.5 109.6 3.9 104.7 427 39 C T < - 0 0 28 -3,-1.7 -1,-0.2 1,-0.0 -3,-0.2 -0.867 68.2 -98.6-111.2 154.8 106.7 3.0 102.3 428 40 C W - 0 0 58 -2,-0.3 -5,-0.3 -3,-0.1 2,-0.1 -0.345 30.1-122.3 -73.0 146.6 107.2 2.5 98.6 429 41 C T > - 0 0 17 -7,-0.1 4,-1.7 1,-0.1 -7,-0.2 -0.379 31.7-104.9 -74.2 162.7 106.5 5.1 95.9 430 42 C V H > S+ 0 0 0 -9,-1.5 4,-2.1 -12,-0.3 3,-0.5 0.931 124.7 52.5 -52.4 -47.9 104.0 4.4 93.2 431 43 C Y H > S+ 0 0 6 -12,-2.4 4,-2.3 1,-0.3 -1,-0.2 0.877 107.9 50.7 -56.0 -43.9 106.9 4.0 90.8 432 44 C E H > S+ 0 0 66 -13,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.786 106.2 55.6 -67.0 -28.0 108.5 1.4 93.2 433 45 C V H X S+ 0 0 0 -4,-1.7 4,-2.2 -3,-0.5 -2,-0.2 0.925 107.4 48.8 -71.4 -42.4 105.2 -0.5 93.4 434 46 C V H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.953 110.7 50.9 -58.8 -48.1 105.2 -0.8 89.6 435 47 C V H X S+ 0 0 20 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.888 109.6 51.1 -57.0 -42.3 108.9 -2.0 89.7 436 48 C H H X S+ 0 0 9 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.890 106.7 53.1 -60.1 -41.2 107.9 -4.6 92.3 437 49 C L H X S+ 0 0 1 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.909 109.0 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78.5 -2.5 101.8 618 40 D W - 0 0 54 -2,-0.3 -5,-0.3 -3,-0.1 2,-0.1 -0.332 33.9-119.6 -70.4 149.5 78.1 -1.3 98.2 619 41 D T > - 0 0 17 -7,-0.1 4,-1.8 1,-0.1 -7,-0.2 -0.372 31.1-105.6 -74.0 161.5 78.8 -3.4 95.2 620 42 D V H > S+ 0 0 0 -9,-1.5 4,-2.0 -12,-0.3 -10,-0.2 0.891 124.5 53.1 -50.2 -43.6 81.4 -2.3 92.7 621 43 D Y H > S+ 0 0 27 -12,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.885 106.3 51.0 -60.0 -45.6 78.5 -1.3 90.3 622 44 D E H > S+ 0 0 80 -13,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.822 106.6 55.1 -64.0 -30.7 76.9 0.8 93.0 623 45 D V H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.947 108.2 48.8 -69.8 -43.6 80.2 2.6 93.6 624 46 D V H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.955 112.0 48.2 -58.4 -51.5 80.3 3.5 89.8 625 47 D V H X S+ 0 0 6 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.897 109.7 54.2 -52.2 -43.0 76.6 4.8 89.9 626 48 D H H X S+ 0 0 5 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.890 104.8 52.4 -61.4 -42.4 77.6 6.8 93.1 627 49 D L H X S+ 0 0 1 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.888 109.0 51.1 -59.2 -39.1 80.5 8.5 91.2 628 50 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